data_2kmk_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 2kmk _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.622 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.2 m-85 . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.105 -0.702 . . . . 2.04 109.105 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.599 ' OD1' ' N ' ' A' ' 4' ' ' CYS . 45.5 t0 -107.25 133.38 51.9 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-O 123.013 1.387 . . . . 1.54 110.166 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.599 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 1.7 t -66.56 131.0 45.05 Favored 'General case' 0 C--N 1.288 -2.083 0 CA-C-N 113.682 -1.599 . . . . 1.01 110.327 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.33 32.11 1.82 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.409 -0.807 . . . . 3.1000000000000001 110.162 -178.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.0 mm -126.81 -71.17 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 120.871 -1.143 . . . . 1.9399999999999999 109.554 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.533 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 30.6 p -84.34 -50.67 7.61 Favored 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 119.325 -0.95 . . . . 2.0800000000000001 108.479 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.533 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 123.34 52.24 0.2 Allowed Glycine 0 N--CA 1.496 2.661 0 C-N-CA 120.83 -0.7 . . . . 1.8899999999999999 112.437 177.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -127.98 164.12 23.04 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.82 -1.4 . . . . 2.4900000000000002 109.623 178.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.4 t -112.81 159.09 19.35 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.686 1.232 . . . . 2.3300000000000001 113.198 -176.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 51.9 m-85 -139.16 125.36 20.13 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 114.968 -1.014 . . . . 1.75 109.784 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -68.29 -22.37 64.73 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 108.869 -0.789 . . . . 3.1099999999999999 108.869 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.665 HH21 ' N ' ' A' ' 15' ' ' SER . 0.0 OUTLIER -119.5 133.45 55.68 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.034 -0.728 . . . . 4.1600000000000001 109.034 -178.62 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.622 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 40.5 t -57.42 -33.36 67.81 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.004 -1.06 . . . . 2.27 108.259 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.665 ' N ' HH21 ' A' ' 13' ' ' ARG . 30.5 t -66.44 -39.41 88.88 Favored 'General case' 0 C--N 1.308 -1.213 0 O-C-N 121.626 -0.671 . . . . 2.23 110.301 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -34.35 77.89 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 106.473 -1.677 . . . . 2.2999999999999998 106.473 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.0 tp -70.6 -43.44 69.34 Favored 'General case' 0 C--O 1.202 -1.411 0 N-CA-C 106.256 -1.757 . . . . 1.3200000000000001 106.256 176.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.613 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 16.4 t -49.93 -62.62 1.46 Allowed 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.529 -1.357 . . . . 2.5099999999999998 109.451 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 88.0 m -54.19 -36.57 63.57 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 122.414 1.102 . . . . 1.78 108.757 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 49.9 t60 -65.47 -46.38 80.03 Favored 'General case' 0 C--N 1.284 -2.243 0 O-C-N 121.097 -1.002 . . . . 1.28 109.311 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 78.5 mt -60.91 -27.69 68.37 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 106.861 -1.533 . . . . 1.1599999999999999 106.861 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 18' ' ' SER . 27.4 mt -70.03 -27.35 64.59 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 107.253 -1.388 . . . . 1.47 107.253 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 95.3 mt -65.41 -39.96 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 O-C-N 120.507 -1.37 . . . . 1.45 108.111 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -73.22 -47.31 44.44 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 117.813 -1.555 . . . . 1.48 108.763 177.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.507 ' OG ' ' OG1' ' A' ' 27' ' ' THR . 25.7 p -73.89 -3.31 28.07 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 120.564 -1.335 . . . . 2.2799999999999998 110.033 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 44.4 63.51 1.63 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.575 -0.703 . . . . 1.8200000000000001 109.786 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.507 ' OG1' ' OG ' ' A' ' 25' ' ' SER . 1.3 m -101.27 111.86 24.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.968 -1.082 . . . . 1.3400000000000001 108.651 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 -126.0 71.98 69.59 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.432 -0.792 . . . . 1.79 109.989 -178.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -73.94 12.15 1.02 Allowed 'Trans proline' 0 C--N 1.308 -1.583 0 C-N-CA 121.954 1.769 . . . . 1.3400000000000001 113.789 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.407 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 61.6 m-85 -117.23 87.11 22.71 Favored Pre-proline 0 N--CA 1.501 2.108 0 N-CA-C 108.046 -1.094 . . . . 1.8899999999999999 108.046 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -84.96 131.12 4.29 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.642 2.228 . . . . 1.27 113.047 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.569 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 1.1 t -51.51 140.59 17.67 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 121.927 0.87 . . . . 0.96999999999999997 108.799 177.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.16 -17.32 52.79 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.861 -0.792 . . . . 3.7799999999999998 108.861 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.569 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 30.5 m-85 -110.58 -76.75 0.6 Allowed 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 119.101 -1.04 . . . . 1.45 112.424 -178.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.544 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 14.8 p -81.77 20.98 0.88 Allowed 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 122.406 1.098 . . . . 1.0800000000000001 110.714 -177.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.432 ' O ' ' C ' ' A' ' 37' ' ' LYS . . . 48.48 9.53 0.09 OUTLIER Glycine 0 N--CA 1.508 3.458 0 N-CA-C 115.513 0.965 . . . . 0.98999999999999999 115.513 176.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.556 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 13.1 mttp -54.35 174.95 0.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 122.503 3.152 . . . . 1.4099999999999999 107.802 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 83.8 mtm-85 -134.13 131.64 38.94 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.977 -1.077 . . . . 2.2999999999999998 109.853 -178.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -123.44 165.08 17.67 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.74 -0.837 . . . . 0.84999999999999998 108.74 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.638 ' H ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -108.96 12.76 25.13 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.772 -0.58 . . . . 1.1699999999999999 109.98 179.78 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -144.77 113.35 6.67 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.868 -1.145 . . . . 1.74 109.74 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.407 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 57.8 tttm -37.88 -72.2 0.06 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.324 -0.86 . . . . 3.3399999999999999 112.984 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 85.5 p -47.37 -34.98 7.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.367 -0.833 . . . . 1.7 111.205 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -67.92 -40.3 83.41 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 117.524 -1.67 . . . . 1.1699999999999999 107.395 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.678 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 11.1 tmm? -66.55 -47.15 73.75 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 120.711 -1.243 . . . . 1.97 107.974 176.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.508 ' O ' ' OG1' ' A' ' 49' ' ' THR . 6.0 tptp -54.07 -37.61 64.4 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.012 -1.055 . . . . 2.4199999999999999 108.531 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.506 ' CB ' ' NZ ' ' A' ' 47' ' ' LYS . 8.2 mtmp? -67.25 -29.19 68.74 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 106.14 -1.8 . . . . 2.7000000000000002 106.14 177.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.678 ' HB3' ' O ' ' A' ' 45' ' ' MET . 61.4 t60 -68.22 -66.31 0.58 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 106.776 -1.564 . . . . 0.53000000000000003 106.776 175.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 41.1 p -38.92 -33.04 0.1 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.732 -1.23 . . . . 1.1699999999999999 111.667 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.599 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.9 m-30 -75.16 -37.85 61.13 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.224 -0.658 . . . . 1.04 109.224 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 48' ' ' HIS . 14.9 pt -59.07 -24.1 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 105.017 -2.216 . . . . 0.82999999999999996 105.017 176.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.914 ' O ' ' N ' ' A' ' 54' ' ' GLY . 83.4 m-70 -80.11 -103.12 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 101.514 -3.513 . . . . 0.83999999999999997 101.514 170.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.599 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 72.7 p -8.68 -37.03 0.0 OUTLIER 'General case' 0 N--CA 1.518 2.927 0 C-N-CA 124.134 0.974 . . . . 1.3600000000000001 112.6 -175.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.914 ' N ' ' O ' ' A' ' 52' ' ' HIS . . . 98.99 21.18 16.31 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 110.591 -1.004 . . . . 0.57999999999999996 110.591 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.454 ' HB2' ' CG ' ' A' ' 50' ' ' PHE . 30.1 mt-10 -82.51 125.64 31.34 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.481 -1.011 . . . . 1.6000000000000001 112.673 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -134.71 73.92 66.09 Favored Pre-proline 0 N--CA 1.504 2.248 0 N-CA-C 108.493 -0.929 . . . . 3.0499999999999998 108.493 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -61.11 -11.13 17.37 Favored 'Trans proline' 0 N--CA 1.496 1.619 0 C-N-CA 124.131 3.221 . . . . 0.75 113.964 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -99.65 93.21 5.72 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 118.852 -1.139 . . . . 0.98999999999999999 109.603 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.51 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 48.9 mtmt -93.94 123.27 37.19 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.662 -0.815 . . . . 2.7799999999999998 111.752 -178.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.484 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -80.4 121.07 25.26 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 106.052 -1.833 . . . . 0.67000000000000004 106.052 176.478 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 7.1 mm-40 -85.58 14.83 5.15 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 120.761 -1.212 . . . . 1.71 108.194 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.484 ' HB ' ' SG ' ' A' ' 60' ' ' CYS . 21.2 t -93.77 -56.94 4.72 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.723 0 C-N-CA 120.083 -0.647 . . . . 1.03 110.136 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.0 p -121.24 25.65 9.39 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.273 -0.892 . . . . 1.1799999999999999 111.024 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 58.49 30.94 65.78 Favored Glycine 0 N--CA 1.494 2.524 0 O-C-N 120.856 -1.152 . . . . 1.1299999999999999 112.706 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -107.3 152.7 23.77 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-N 118.998 1.399 . . . . 2.0600000000000001 108.511 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -126.5 150.51 48.7 Favored 'General case' 0 N--CA 1.502 2.156 0 CA-C-O 121.807 0.813 . . . . 1.1000000000000001 111.738 -177.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.539 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 82.7 m-85 -134.34 153.41 51.9 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 122.425 1.107 . . . . 1.1200000000000001 113.404 -177.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.0 m -78.29 -41.1 34.88 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 115.47 -0.786 . . . . 1.75 108.907 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -103.78 144.75 31.07 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.926 0.869 . . . . 3.3599999999999999 110.56 -177.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.537 ' O ' ' N ' ' A' ' 73' ' ' LEU . 27.9 p -70.61 -45.66 64.85 Favored 'General case' 0 C--O 1.195 -1.804 0 N-CA-C 106.951 -1.5 . . . . 1.5900000000000001 106.951 178.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.415 ' C ' ' O ' ' A' ' 70' ' ' SER . 0.4 OUTLIER -47.01 -43.15 19.25 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.237 -1.023 . . . . 1.8999999999999999 108.237 179.164 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -69.66 -32.87 71.77 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 107.383 -1.34 . . . . 1.4399999999999999 107.383 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 70' ' ' SER . 16.2 tp -68.91 -57.54 5.37 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 106.436 -1.69 . . . . 0.69999999999999996 106.436 176.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.465 HD13 HG21 ' A' ' 74' ' ' ILE . 79.2 mt -42.9 -57.38 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 O-C-N 121.0 -1.062 . . . . 1.54 110.185 178.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.7 m -59.21 -41.82 89.48 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.015 -1.053 . . . . 1.55 108.659 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.539 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 22.7 t60 -59.93 -43.74 94.76 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 122.216 1.007 . . . . 0.94999999999999996 108.37 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.9 t -68.29 -36.4 79.32 Favored 'General case' 0 C--N 1.309 -1.164 0 O-C-N 120.875 -1.141 . . . . 1.1699999999999999 108.123 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 85.5 mtt-85 -54.75 -38.57 67.33 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 107.597 -1.26 . . . . 2.54 107.597 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 34.7 mttp -64.99 -43.88 91.12 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 118.714 -1.195 . . . . 2.6299999999999999 107.98 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 49.9 m-70 -62.15 -44.37 96.77 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 117.186 -1.806 . . . . 0.97999999999999998 108.713 177.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.1 m -51.64 -57.08 10.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.625 -0.672 . . . . 1.4399999999999999 109.564 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 109.513 -1.435 . . . . 1.8700000000000001 109.513 179.876 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.62 ' CE1' ' N ' ' A' ' 14' ' ' SER . 4.2 m-85 . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 108.723 -0.843 . . . . 1.29 108.723 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.618 ' OD1' ' N ' ' A' ' 4' ' ' CYS . 61.3 t0 -108.19 136.55 47.66 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.816 1.294 . . . . 1.3799999999999999 110.85 -179.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.618 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 1.7 t -68.54 126.57 30.08 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 114.589 -1.187 . . . . 0.5 109.386 178.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.458 ' HD2' ' H ' ' A' ' 5' ' ' LYS . 2.3 mptt -92.59 26.69 2.56 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.359 -0.838 . . . . 2.0699999999999998 109.308 -178.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 74.7 mt -125.27 -72.04 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.37 -0.831 . . . . 1.8799999999999999 111.247 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 29.7 p -86.54 -45.73 10.81 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.694 -1.254 . . . . 0.87 110.899 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.401 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 126.17 45.5 0.23 Allowed Glycine 0 N--CA 1.5 2.905 0 O-C-N 121.1 -1.0 . . . . 0.59999999999999998 112.267 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -127.28 156.0 42.62 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.972 -1.311 . . . . 1.8400000000000001 108.918 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.433 ' C ' ' CD1' ' A' ' 11' ' ' PHE . 54.4 m -113.32 165.15 12.71 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.64 -1.288 . . . . 1.3600000000000001 112.579 -176.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.553 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 46.4 m-85 -142.12 124.81 15.91 Favored 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 121.665 0.745 . . . . 0.93000000000000005 110.72 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -62.44 -24.57 67.5 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.775 -0.824 . . . . 2.5 108.775 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.9 mmm180 -119.64 138.39 53.28 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.182 -0.673 . . . . 3.4199999999999999 109.182 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.62 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 1.0 OUTLIER -64.44 -37.79 88.77 Favored 'General case' 0 C--N 1.301 -1.504 0 C-N-CA 118.991 -1.084 . . . . 1.3700000000000001 108.834 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.473 ' O ' ' OG ' ' A' ' 18' ' ' SER . 77.4 p -55.81 -48.89 74.62 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 107.799 -1.186 . . . . 1.6100000000000001 107.799 178.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.419 ' H ' ' HG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -56.91 -36.53 70.27 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 107.671 -1.233 . . . . 1.4299999999999999 107.671 178.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 tp -70.95 -34.85 71.87 Favored 'General case' 0 C--O 1.201 -1.472 0 N-CA-C 107.312 -1.366 . . . . 0.85999999999999999 107.312 177.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.573 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 18.5 p -58.98 -60.6 3.61 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.038 -1.038 . . . . 1.6200000000000001 108.888 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.481 ' N ' ' OG ' ' A' ' 18' ' ' SER . 68.3 m -52.8 -34.39 53.31 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 122.063 0.935 . . . . 1.0700000000000001 108.518 179.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.553 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 63.1 t60 -68.39 -45.81 71.71 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-O 122.809 1.29 . . . . 0.75 108.323 178.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 38.1 mt -58.05 -35.82 71.89 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 106.753 -1.573 . . . . 0.77000000000000002 106.753 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 18' ' ' SER . 13.3 mt -62.86 -35.63 80.61 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.466 -0.939 . . . . 0.83999999999999997 108.466 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 67.9 mt -57.58 -34.93 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 O-C-N 120.322 -1.486 . . . . 1.1599999999999999 108.548 177.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -81.15 -36.08 30.69 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.431 -1.308 . . . . 1.1499999999999999 111.497 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.637 ' O ' ' CG ' ' A' ' 26' ' ' ASP . 1.3 m -83.56 -59.86 2.31 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.421 -1.424 . . . . 1.6499999999999999 108.649 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.637 ' CG ' ' O ' ' A' ' 25' ' ' SER . 3.3 p-10 97.66 54.63 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.966 0 CA-C-O 122.039 0.923 . . . . 2.3300000000000001 110.19 178.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.464 ' O ' ' C ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -63.84 -46.83 83.28 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.3 -0.875 . . . . 1.1799999999999999 108.944 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.499 ' NH1' ' ND1' ' A' ' 40' ' ' HIS . 0.4 OUTLIER 36.33 65.83 2.05 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.558 -0.714 . . . . 1.1699999999999999 110.374 179.586 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -88.94 12.29 2.78 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.595 2.197 . . . . 0.70999999999999996 113.752 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.408 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 69.8 m-85 -117.45 86.15 21.88 Favored Pre-proline 0 N--CA 1.498 1.973 0 O-C-N 121.009 -1.057 . . . . 0.93000000000000005 109.354 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -84.99 130.96 4.22 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 123.043 2.495 . . . . 0.92000000000000004 114.063 -178.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.53 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -53.04 139.43 28.16 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 122.1 0.952 . . . . 0.82999999999999996 110.376 179.025 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.587 ' NE2' ' H ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -81.64 -20.96 38.56 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.485 -0.779 . . . . 1.4099999999999999 110.201 179.711 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.53 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 22.4 m-85 -103.95 -73.38 0.67 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.632 -1.292 . . . . 1.01 111.993 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.465 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 20.4 p -78.83 -19.48 51.94 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.849 -1.157 . . . . 1.04 112.139 -177.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.27 -7.67 58.51 Favored Glycine 0 N--CA 1.509 3.562 0 O-C-N 120.405 -1.434 . . . . 0.97999999999999998 115.18 175.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -51.15 168.42 0.06 Allowed 'General case' 0 N--CA 1.502 2.155 0 CA-C-N 121.126 2.463 . . . . 2.8300000000000001 109.522 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.463 ' N ' ' NE ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -125.8 133.21 52.09 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.719 -1.238 . . . . 1.8200000000000001 109.08 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -118.95 166.53 12.73 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.482 -0.761 . . . . 0.55000000000000004 109.885 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.521 ' N ' ' ND1' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -102.81 2.71 35.87 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.796 -0.565 . . . . 0.97999999999999998 111.036 -179.601 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' A' ' 42' ' ' LYS . 38.8 mt-30 -146.62 118.08 7.96 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.467 -1.395 . . . . 1.6699999999999999 111.055 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 41' ' ' GLN . 37.4 tttm -37.08 -69.46 0.11 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.458 -0.776 . . . . 2.5499999999999998 111.895 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.1 m -48.07 -27.79 2.5 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.843 -1.16 . . . . 1.8999999999999999 110.682 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -74.75 -40.18 61.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.994 -1.066 . . . . 0.82999999999999996 108.172 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.658 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 4.8 tmm? -68.6 -47.44 66.69 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.379 -1.451 . . . . 1.0900000000000001 107.472 176.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -52.56 -37.55 58.09 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.416 -1.327 . . . . 2.2000000000000002 107.416 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.52 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.5 mtpt -63.13 -32.84 74.32 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 105.351 -2.092 . . . . 1.45 105.351 176.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.658 ' HB3' ' O ' ' A' ' 45' ' ' MET . 65.0 t60 -69.54 -63.83 1.0 Allowed 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 107.813 -1.18 . . . . 0.68999999999999995 107.813 177.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.469 ' C ' ' O ' ' A' ' 48' ' ' HIS . 70.5 p -39.9 -38.31 0.67 Allowed 'General case' 0 N--CA 1.482 1.154 0 O-C-N 120.4 -1.438 . . . . 1.1000000000000001 110.249 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.613 ' CE1' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-85 -70.26 -35.17 73.6 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.166 -0.959 . . . . 0.71999999999999997 109.503 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' A' ' 48' ' ' HIS . 4.4 pt -57.45 -21.25 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 C-N-CA 118.158 -1.417 . . . . 0.78000000000000003 107.392 176.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . 0.286 77.9 m-70 -94.22 -35.86 12.28 Favored 'General case' 0 N--CA 1.53 3.556 0 O-C-N 120.917 -1.115 . . . . 0.82999999999999996 112.998 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.448 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 68.6 p -74.67 -17.67 60.64 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.748 0.785 . . . . 1.28 109.094 -176.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.63 7.6 68.8 Favored Glycine 0 C--N 1.292 -1.876 0 N-CA-C 107.941 -2.064 . . . . 0.60999999999999999 107.941 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.613 ' OE1' ' CE1' ' A' ' 50' ' ' PHE . 91.8 mt-10 -73.48 115.41 12.83 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 122.313 1.054 . . . . 1.53 112.409 -177.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.0 mttm -125.2 68.77 58.46 Favored Pre-proline 0 N--CA 1.495 1.818 0 N-CA-C 108.597 -0.89 . . . . 2.2400000000000002 108.597 177.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HD3' ' C ' ' A' ' 55' ' ' GLU . 31.6 Cg_exo -56.69 -10.55 5.45 Favored 'Trans proline' 0 N--CA 1.503 2.074 0 C-N-CA 123.425 2.75 . . . . 0.85999999999999999 114.487 -179.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.588 ' CE1' ' OG ' ' A' ' 70' ' ' SER . 98.7 m-70 -99.42 85.84 3.25 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.474 -1.391 . . . . 1.1299999999999999 109.288 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -84.41 124.76 31.67 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.368 -0.833 . . . . 3.0099999999999998 110.072 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.673 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 0.5 OUTLIER -54.41 -89.02 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.785 0 O-C-N 121.864 -0.523 . . . . 0.89000000000000001 110.02 179.24 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.673 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 3.9 mm-40 120.06 -10.17 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.372 0 CA-C-O 121.79 0.805 . . . . 2.1099999999999999 110.238 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.5 t -94.69 -53.21 8.6 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-O 122.006 0.908 . . . . 1.77 108.631 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 26.8 p -108.48 -8.67 15.5 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.913 -0.585 . . . . 1.48 110.135 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.68 33.39 16.21 Favored Glycine 0 N--CA 1.498 2.795 0 O-C-N 121.17 -0.956 . . . . 1.22 113.123 177.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.1 tttm -109.32 174.53 5.82 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.356 -1.673 . . . . 3.04 108.117 178.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -137.41 156.36 48.29 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.398 -1.439 . . . . 1.24 111.79 -177.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -137.75 147.77 45.01 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 122.522 1.153 . . . . 1.21 113.758 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.0 m -81.21 -27.15 35.41 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 115.023 -0.99 . . . . 1.5700000000000001 109.428 178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -120.67 144.15 48.34 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 118.916 -1.114 . . . . 3.3999999999999999 111.0 -178.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.588 ' OG ' ' CE1' ' A' ' 58' ' ' HIS . 17.1 m -65.12 -42.6 93.77 Favored 'General case' 0 C--O 1.197 -1.674 0 C-N-CA 119.248 -0.981 . . . . 1.8999999999999999 108.831 178.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.8 m -50.34 -44.26 54.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.038 -1.039 . . . . 1.9099999999999999 108.524 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -69.04 -33.61 73.87 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 118.48 -1.288 . . . . 2.75 108.731 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.2 tp -73.05 -47.16 47.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.414 -1.429 . . . . 0.91000000000000003 108.907 177.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.452 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 67.8 mt -55.01 -52.68 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.544 -1.347 . . . . 2.1400000000000001 108.307 178.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 91.8 m -59.14 -47.96 83.37 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 118.878 -1.129 . . . . 1.6599999999999999 108.182 178.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.2 t60 -54.75 -49.23 71.36 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.752 0.787 . . . . 0.93999999999999995 109.84 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.0 t -67.89 -31.22 70.85 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.382 -1.449 . . . . 1.23 108.928 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 44.5 mtp180 -61.42 -31.63 71.57 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 106.805 -1.554 . . . . 3.2599999999999998 106.805 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -67.42 -46.32 73.51 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 107.255 -1.387 . . . . 3.1000000000000001 107.255 177.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -59.98 -65.94 0.6 Allowed 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 117.383 -1.727 . . . . 1.0 109.275 178.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.5 m -54.74 -55.25 31.92 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.714 -0.616 . . . . 1.4299999999999999 110.03 -178.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.518 0 N-CA-C 109.243 -1.543 . . . . 1.46 109.243 179.828 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.598 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.5 m-85 . . . . . 0 N--CA 1.496 1.87 0 N-CA-C 108.711 -0.848 . . . . 0.93999999999999995 108.711 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.14 112.08 21.17 Favored 'General case' 0 N--CA 1.512 2.627 0 CA-C-O 122.797 1.284 . . . . 1.78 113.5 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.1 131.33 15.94 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-N 114.372 -1.286 . . . . 0.81999999999999995 111.478 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -90.61 -22.36 21.26 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.649 -0.657 . . . . 2.9500000000000002 112.003 -178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.711 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 1.1 mp -74.82 -69.29 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 O-C-N 120.253 -1.529 . . . . 1.46 111.479 -177.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.0 p -92.14 -18.77 23.05 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.727 -1.233 . . . . 0.87 110.018 -178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.86 51.59 2.8 Favored Glycine 0 N--CA 1.502 3.074 0 C-N-CA 119.999 -1.096 . . . . 0.89000000000000001 114.552 175.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -121.63 160.89 23.45 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 119.603 1.702 . . . . 1.8300000000000001 108.251 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 36.8 m -112.42 149.83 31.99 Favored 'General case' 0 N--CA 1.51 2.566 0 CA-C-O 122.51 1.148 . . . . 1.71 113.7 -175.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.543 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.6 m-85 -130.33 123.3 29.67 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.176 -0.92 . . . . 0.77000000000000002 110.484 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.496 ' CD ' ' N ' ' A' ' 12' ' ' LYS . 11.6 mptt -63.46 -20.64 65.75 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 109.091 -0.707 . . . . 3.6899999999999999 109.091 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.667 ' HB2' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -121.26 137.25 54.77 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.679 -0.638 . . . . 1.5600000000000001 109.625 -178.231 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.598 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 0.0 OUTLIER -61.36 -34.7 75.74 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 118.887 -1.125 . . . . 1.0900000000000001 107.99 179.575 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.8 t -63.32 -44.58 94.56 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.682 -0.636 . . . . 1.47 110.139 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.667 ' OG1' ' HB2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -62.27 -32.8 73.56 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 106.637 -1.616 . . . . 1.1000000000000001 106.637 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.9 tp -72.63 -35.87 67.91 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.527 -1.286 . . . . 0.73999999999999999 107.527 177.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.443 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 18.5 m -59.31 -59.13 5.95 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.802 -1.186 . . . . 1.0800000000000001 108.726 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 80.4 m -53.71 -35.73 61.47 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.102 -1.073 . . . . 1.04 108.102 178.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.543 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 55.1 t60 -66.34 -47.65 72.79 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 122.262 1.029 . . . . 0.45000000000000001 108.719 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 49.3 mt -58.42 -29.97 66.52 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 107.545 -1.28 . . . . 0.93999999999999995 107.545 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 18' ' ' SER . 86.7 mt -73.3 -27.76 61.72 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 107.724 -1.213 . . . . 0.66000000000000003 107.724 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.41 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 72.4 mt -63.02 -33.78 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 106.988 -1.486 . . . . 0.62 106.988 177.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -79.57 -44.08 21.76 Favored 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 119.805 -0.758 . . . . 0.71999999999999997 111.168 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.418 ' O ' ' C ' ' A' ' 26' ' ' ASP . 1.2 m -85.86 2.97 43.76 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.201 -1.562 . . . . 1.1799999999999999 108.57 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.418 ' C ' ' O ' ' A' ' 25' ' ' SER . 4.6 m-20 36.31 57.42 1.05 Allowed 'General case' 0 N--CA 1.498 1.975 0 CA-C-O 121.719 0.771 . . . . 1.3999999999999999 111.155 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 58.2 m -68.85 -52.25 31.79 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.794 -0.817 . . . . 1.1499999999999999 108.794 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.464 ' HD2' ' N ' ' A' ' 28' ' ' ARG . 5.5 mpt_? 43.12 61.1 10.1 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.318 -0.864 . . . . 0.90000000000000002 110.503 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.47 19.75 0.31 Allowed 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.085 1.856 . . . . 0.69999999999999996 113.731 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -126.8 88.92 53.37 Favored Pre-proline 0 N--CA 1.503 2.184 0 O-C-N 120.611 -1.306 . . . . 1.05 109.338 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.94 136.97 9.57 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.817 2.345 . . . . 0.70999999999999996 114.095 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.602 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -60.56 129.74 43.06 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.536 -0.913 . . . . 0.42999999999999999 108.536 179.399 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -74.06 -11.67 60.39 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-N 116.058 -0.519 . . . . 1.96 110.772 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.501 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 40.5 m-85 -113.86 -70.45 0.8 Allowed 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.507 -1.37 . . . . 0.89000000000000001 112.541 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.602 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 18.0 p -89.28 -7.54 55.21 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.893 -1.129 . . . . 0.34000000000000002 111.18 -178.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.485 ' C ' ' HB3' ' A' ' 32' ' ' CYS . . . 87.88 -3.78 85.85 Favored Glycine 0 N--CA 1.5 2.901 0 N-CA-C 115.821 1.088 . . . . 0.39000000000000001 115.821 175.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.536 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 19.4 mttm -48.08 148.07 1.9 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-N 121.795 2.797 . . . . 1.48 106.93 178.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -117.45 134.79 54.45 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.068 -1.645 . . . . 2.2999999999999998 109.449 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 17.9 m-85 -119.19 175.48 5.77 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.433 -0.792 . . . . 0.53000000000000003 109.016 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.492 ' H ' ' CD2' ' A' ' 40' ' ' HIS . 5.0 p80 -113.31 8.56 18.07 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.639 -0.663 . . . . 1.1000000000000001 111.362 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.507 ' O ' ' C ' ' A' ' 42' ' ' LYS . 28.1 mt-30 -143.1 111.51 6.24 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.453 -1.404 . . . . 2.0299999999999998 110.421 179.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' A' ' 45' ' ' MET . 49.4 tttm -30.95 -80.59 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.527 -0.733 . . . . 1.6399999999999999 111.05 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 42' ' ' LYS . 10.8 p -36.12 -31.15 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.144 -0.973 . . . . 1.1599999999999999 111.718 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -75.55 -40.9 56.18 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 118.359 -1.337 . . . . 0.81000000000000005 108.349 179.796 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.617 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.5 tmm? -65.28 -46.23 81.27 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.434 -1.691 . . . . 0.68999999999999995 106.434 177.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.563 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 52.9 mmtt -50.7 -36.83 38.07 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 107.476 -1.305 . . . . 2.0 107.476 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.407 ' O ' HG22 ' A' ' 51' ' ' ILE . 5.4 mtmp? -63.33 -32.09 73.41 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 106.395 -1.706 . . . . 2.54 106.395 177.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.623 ' O ' ' N ' ' A' ' 51' ' ' ILE . 66.3 t60 -72.6 -67.32 0.56 Allowed 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.273 -1.38 . . . . 0.37 107.273 177.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.563 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 41.7 p -40.68 -32.28 0.2 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 120.136 -1.602 . . . . 1.0600000000000001 109.61 177.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.553 ' CZ ' ' OE1' ' A' ' 55' ' ' GLU . 3.9 m-30 -70.41 -32.82 70.6 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 121.074 -1.016 . . . . 0.59999999999999998 108.955 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.623 ' N ' ' O ' ' A' ' 48' ' ' HIS . 15.6 pt -71.1 -16.75 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 C-N-CA 118.409 -1.316 . . . . 0.46999999999999997 109.264 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.447 ' NE2' ' HB2' ' A' ' 34' ' ' TYR . 67.1 m-70 -90.86 -30.68 16.81 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.403 -1.436 . . . . 0.32000000000000001 109.061 176.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.406 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 62.8 p -85.23 -11.2 55.43 Favored 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 112.608 0.596 . . . . 1.1899999999999999 112.608 -176.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 83.15 14.75 73.86 Favored Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.071 -1.612 . . . . 0.45000000000000001 109.071 -178.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.553 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 85.2 mt-10 -74.5 130.51 39.75 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.282 -1.128 . . . . 1.77 111.031 -177.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.1 mmtt -139.46 67.42 37.82 Favored Pre-proline 0 N--CA 1.487 1.418 0 N-CA-C 108.581 -0.896 . . . . 1.9199999999999999 108.581 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.55 -7.7 11.35 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.9 2.4 . . . . 0.53000000000000003 113.122 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -105.73 93.19 4.51 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.734 -1.229 . . . . 0.57999999999999996 109.019 179.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.464 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 91.5 mttt -94.31 123.72 37.88 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.068 -1.02 . . . . 1.76 110.761 -178.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.02 119.09 24.52 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.532 -1.284 . . . . 0.80000000000000004 107.532 177.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.464 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 38.6 mm-40 -74.79 -16.17 60.72 Favored 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 112.439 0.533 . . . . 1.75 112.439 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 40.7 t -69.54 -55.97 13.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.039 0 O-C-N 120.187 -1.571 . . . . 1.72 111.469 -178.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.8 p -112.11 -0.07 15.74 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 119.305 -0.958 . . . . 0.92000000000000004 110.83 -177.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.79 31.8 55.17 Favored Glycine 0 N--CA 1.498 2.803 0 C-N-CA 119.768 -1.206 . . . . 0.80000000000000004 112.516 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -102.16 168.72 9.18 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 106.203 -1.777 . . . . 2.3799999999999999 106.203 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -139.09 149.19 44.26 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.436 -1.415 . . . . 0.68000000000000005 110.836 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.419 ' HZ ' ' CE1' ' A' ' 76' ' ' HIS . 31.2 m-85 -133.46 151.53 51.8 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 122.061 0.934 . . . . 0.65000000000000002 112.905 -177.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 79.7 p -79.08 -27.39 43.02 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.717 -0.674 . . . . 1.1100000000000001 109.777 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -116.72 140.13 49.77 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.877 -1.139 . . . . 2.5099999999999998 111.189 -178.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.449 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -64.18 -45.28 89.05 Favored 'General case' 0 C--O 1.2 -1.538 0 N-CA-C 108.223 -1.028 . . . . 1.28 108.223 178.194 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.0 t -49.75 -35.87 23.85 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.299 -0.876 . . . . 1.01 108.923 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -74.96 -31.21 61.42 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.193 -1.41 . . . . 1.02 107.193 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' A' ' 70' ' ' SER . 43.7 tp -72.73 -54.52 8.72 Favored 'General case' 0 C--O 1.199 -1.582 0 N-CA-C 107.288 -1.375 . . . . 0.88 107.288 176.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.429 ' C ' ' O ' ' A' ' 73' ' ' LEU . 72.0 mt -45.34 -51.14 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 O-C-N 120.438 -1.414 . . . . 1.6499999999999999 108.549 178.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 57.2 m -62.43 -45.84 91.24 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 120.8 -1.188 . . . . 1.4399999999999999 109.313 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.419 ' CE1' ' HZ ' ' A' ' 67' ' ' PHE . 22.1 t60 -60.84 -43.34 98.43 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 122.141 0.972 . . . . 0.80000000000000004 109.593 -179.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -69.33 -32.55 71.71 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 120.779 -1.2 . . . . 1.8 108.283 178.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 82' ' ' GLY . 93.0 mtt180 -62.83 -31.88 72.98 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 106.673 -1.602 . . . . 2.8399999999999999 106.673 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.03 -43.55 87.27 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 118.134 -1.426 . . . . 2.1200000000000001 107.29 178.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 68.3 m-70 -66.12 -33.41 75.72 Favored 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 118.099 -1.44 . . . . 1.1200000000000001 109.506 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 17.5 p -103.0 16.79 25.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.303 -0.873 . . . . 1.98 111.265 -177.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.488 2.129 0 C-N-CA 119.237 -1.459 . . . . 2.1499999999999999 109.686 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.621 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.2 m-85 . . . . . 0 N--CA 1.493 1.723 0 N-CA-C 109.113 -0.699 . . . . 70.069999999999993 109.113 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -113.72 120.79 42.04 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 122.526 1.155 . . . . 83.590000000000003 112.414 -177.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.486 ' O ' ' HA2' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -52.62 126.61 20.27 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 108.377 -0.972 . . . . 50.890000000000001 108.377 177.257 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.31 -17.33 34.87 Favored 'General case' 0 C--N 1.289 -2.053 0 O-C-N 120.846 -1.159 . . . . 99.159999999999997 111.939 -177.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.422 HG21 HD11 ' A' ' 6' ' ' ILE . 7.9 mm -77.91 -72.75 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 120.822 -1.174 . . . . 112.28 112.592 -177.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.5 p -87.3 -32.0 19.91 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 106.516 -1.661 . . . . 82.079999999999998 106.516 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.486 ' HA2' ' O ' ' A' ' 4' ' ' CYS . . . 95.94 53.77 1.47 Allowed Glycine 0 N--CA 1.496 2.652 0 C-N-CA 118.513 -1.803 . . . . 195.93000000000001 114.54 174.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -115.71 164.56 14.18 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 104.438 -2.43 . . . . 114.22 104.438 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 90.2 p -115.7 149.19 38.8 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 119.826 -1.796 . . . . 78.049999999999997 113.847 -175.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 17.3 m-85 -129.21 129.69 45.36 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.682 0.753 . . . . 54.659999999999997 110.453 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.3 mtpt -73.31 -22.2 60.4 Favored 'General case' 0 N--CA 1.497 1.894 0 CA-C-O 121.785 0.803 . . . . 101.13 109.562 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.479 ' CB ' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -113.63 131.03 56.28 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.693 -0.855 . . . . 74.890000000000001 108.693 -177.516 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.621 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 98.3 p -58.63 -32.44 69.04 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.771 -1.206 . . . . 25.870000000000001 107.899 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 76.0 p -64.68 -41.48 96.02 Favored 'General case' 0 N--CA 1.485 1.315 0 O-C-N 121.541 -0.724 . . . . 23.449999999999999 110.337 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.479 ' OG1' ' CB ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -65.38 -33.5 76.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.078 -1.452 . . . . 32.270000000000003 107.078 179.816 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 tp -72.83 -36.36 67.49 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 107.509 -1.293 . . . . 97.780000000000001 107.509 177.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.575 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 20.7 t -57.84 -60.44 3.71 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.067 -1.021 . . . . 34.229999999999997 108.794 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 58.3 m -52.36 -40.55 62.15 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 122.526 1.155 . . . . 30.690000000000001 109.32 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 61.8 t60 -63.31 -46.05 88.5 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 108.116 -1.068 . . . . 81.829999999999998 108.116 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.7 mt -58.44 -31.4 67.73 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 106.638 -1.616 . . . . 156.93000000000001 106.638 178.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 18' ' ' SER . 35.7 mt -70.02 -24.49 63.29 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 115.278 -0.874 . . . . 64.069999999999993 108.685 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 86.9 mt -68.32 -33.3 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 107.13 -1.433 . . . . 150.09999999999999 107.13 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.5 m-70 -80.71 -38.31 29.09 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.434 -1.307 . . . . 55.939999999999998 109.744 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 m -84.78 -3.63 58.7 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 120.596 -1.315 . . . . 89.099999999999994 108.846 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 22' ' ' LEU . 53.7 m-20 47.94 51.3 14.62 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 121.385 0.612 . . . . 62.890000000000001 110.248 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -91.55 130.67 37.34 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.354 -0.841 . . . . 115.68000000000001 109.509 179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.0 mtt-85 -144.84 76.06 14.07 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 120.98 -1.075 . . . . 115.33 109.374 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.46 10.23 1.3 Allowed 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 121.843 1.695 . . . . 90.269999999999996 113.385 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.467 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 73.5 m-85 -115.19 81.72 8.33 Favored Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 120.985 -1.072 . . . . 131.19 108.434 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.81 126.07 7.06 Favored 'Trans proline' 0 C--N 1.312 -1.342 0 C-N-CA 122.509 2.139 . . . . 108.54000000000001 112.746 -178.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.501 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.1 OUTLIER -48.32 142.88 5.14 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.174 0.988 . . . . 43.399999999999999 110.08 178.204 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -83.36 -11.79 57.26 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.691 -0.631 . . . . 113.04000000000001 110.831 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.501 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 52.6 m-85 -117.67 -73.42 0.64 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.242 -1.536 . . . . 118.47 112.187 -178.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 18.3 p -79.21 -27.32 42.53 Favored 'General case' 0 N--CA 1.504 2.242 0 C-N-CA 119.088 -1.045 . . . . 56.060000000000002 110.634 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 104.94 1.46 42.23 Favored Glycine 0 N--CA 1.488 2.125 0 C-N-CA 119.405 -1.379 . . . . 19.149999999999999 114.218 175.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -54.73 153.32 6.09 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 121.12 2.46 . . . . 73.469999999999999 106.023 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -117.28 138.94 51.41 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.305 -1.497 . . . . 160.56 109.681 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.446 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 51.6 m-85 -120.18 160.53 22.73 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.078 -1.014 . . . . 72.450000000000003 110.153 -179.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.6 ' H ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -99.91 -7.67 24.96 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 116.234 -0.439 . . . . 97.769999999999996 110.542 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.517 ' O ' ' C ' ' A' ' 42' ' ' LYS . 88.3 mt-30 -130.3 109.24 10.61 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.885 -1.135 . . . . 106.11 109.32 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.585 ' O ' ' N ' ' A' ' 45' ' ' MET . 85.5 tttt -29.74 -82.47 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.781 -0.574 . . . . 136.28999999999999 111.199 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 42' ' ' LYS . 2.1 m -37.71 -30.42 0.03 OUTLIER 'General case' 0 C--N 1.291 -1.938 0 O-C-N 121.204 -0.935 . . . . 65.219999999999999 111.879 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 41' ' ' GLN . 57.6 t0 -72.35 -36.31 68.75 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.108 -1.62 . . . . 40.659999999999997 107.314 178.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.597 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.1 tmm? -71.31 -47.3 57.54 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.326 -1.361 . . . . 31.66 107.326 176.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.517 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 7.7 tptp -50.54 -39.06 48.01 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.21 -1.404 . . . . 103.12 107.21 -179.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.458 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.8 mtmt -64.41 -34.97 79.42 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 106.178 -1.786 . . . . 48.509999999999998 106.178 176.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.639 ' O ' HG12 ' A' ' 51' ' ' ILE . 64.8 t60 -65.38 -65.49 0.67 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 107.426 -1.324 . . . . 65.659999999999997 107.426 176.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.517 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 31.9 p -42.2 -33.32 0.59 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.227 -1.545 . . . . 47.020000000000003 109.9 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.508 ' CE2' ' OE1' ' A' ' 55' ' ' GLU . 2.6 m-85 -71.69 -27.65 63.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.86 -1.15 . . . . 54.630000000000003 109.572 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.639 HG12 ' O ' ' A' ' 48' ' ' HIS . 15.0 pt -74.96 -17.55 16.23 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 121.058 -1.026 . . . . 99.090000000000003 109.149 176.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 59.2 m-70 -89.34 -30.27 18.53 Favored 'General case' 0 N--CA 1.516 2.847 0 C-N-CA 118.065 -1.454 . . . . 59.329999999999998 107.916 176.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.437 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 38.6 p -77.18 -23.16 51.56 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.654 0.74 . . . . 97.329999999999998 109.061 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.69 22.64 35.9 Favored Glycine 0 N--CA 1.485 1.966 0 N-CA-C 108.276 -1.93 . . . . 23.68 108.276 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.508 ' OE1' ' CE2' ' A' ' 50' ' ' PHE . 86.5 mt-10 -85.66 127.1 34.4 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 122.394 1.092 . . . . 47.259999999999998 112.026 -177.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -137.76 78.83 35.58 Favored Pre-proline 0 C--N 1.296 -1.731 0 N-CA-C 107.588 -1.264 . . . . 86.790000000000006 107.588 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -67.37 -13.02 37.91 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 C-N-CA 123.101 2.534 . . . . 151.44 112.782 -178.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -96.34 91.32 5.79 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 118.437 -1.305 . . . . 42.670000000000002 108.623 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.404 ' O ' ' OE1' ' A' ' 61' ' ' GLN . 91.5 mttt -93.0 122.07 34.98 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.214 -0.929 . . . . 72.959999999999994 110.014 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.426 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -72.93 121.66 20.41 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.006 -1.109 . . . . 38.909999999999997 108.006 178.592 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.404 ' OE1' ' O ' ' A' ' 59' ' ' LYS . 1.6 mm100 -84.25 7.99 17.37 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.297 -0.877 . . . . 124.0 109.855 -178.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.46 ' HB ' ' CD2' ' A' ' 80' ' ' HIS . 21.7 t -91.65 -59.66 2.83 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 C-N-CA 119.566 -0.854 . . . . 56.07 109.546 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.1 p -111.22 -12.63 14.09 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.285 0.846 . . . . 63.829999999999998 113.285 -178.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.47 12.4 51.25 Favored Glycine 0 N--CA 1.505 3.247 0 O-C-N 120.057 -1.652 . . . . 23.809999999999999 112.867 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -86.18 166.79 15.47 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.087 -1.82 . . . . 120.73999999999999 106.087 177.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -132.41 144.76 50.73 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.481 -1.387 . . . . 39.509999999999998 109.702 -178.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.459 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 82.3 m-85 -128.49 147.03 50.65 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 122.237 1.018 . . . . 62.57 112.183 -177.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.1 m -74.31 -36.79 63.73 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.631 -0.713 . . . . 84.840000000000003 109.089 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -116.19 141.62 47.91 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.403 1.097 . . . . 93.390000000000001 111.751 -178.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.547 ' HG ' ' N ' ' A' ' 71' ' ' SER . 32.4 p -59.6 -40.83 88.79 Favored 'General case' 0 C--O 1.197 -1.664 0 N-CA-C 107.842 -1.169 . . . . 67.340000000000003 107.842 178.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.547 ' N ' ' HG ' ' A' ' 70' ' ' SER . 2.2 t -48.18 -41.9 28.27 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.374 -0.829 . . . . 68.680000000000007 110.004 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 -76.19 -29.73 57.76 Favored 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 118.321 -1.351 . . . . 33.829999999999998 108.307 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' A' ' 74' ' ' ILE . 48.3 tp -70.44 -55.65 8.5 Favored 'General case' 0 C--O 1.195 -1.804 0 N-CA-C 107.517 -1.29 . . . . 75.650000000000006 107.517 176.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.403 ' C ' ' O ' ' A' ' 73' ' ' LEU . 79.9 mt -45.91 -52.23 3.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 O-C-N 120.666 -1.271 . . . . 27.719999999999999 108.985 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.3 m -61.45 -45.87 92.45 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.985 -1.072 . . . . 95.200000000000003 109.702 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.459 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 11.6 t60 -64.56 -38.07 89.73 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 122.496 1.141 . . . . 66.299999999999997 109.09 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.53 -31.93 70.45 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 107.332 -1.358 . . . . 87.230000000000004 107.332 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 82' ' ' GLY . 10.0 mmt85 -63.36 -38.9 92.94 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 107.709 -1.219 . . . . 73.269999999999996 107.709 177.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.0 mttm -60.41 -44.07 96.07 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 118.014 -1.474 . . . . 80.849999999999994 107.403 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.46 ' CD2' ' HB ' ' A' ' 62' ' ' VAL . 59.3 m-70 -61.3 -35.73 78.15 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 117.002 -1.879 . . . . 46.009999999999998 107.898 177.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.4 m -98.26 24.16 7.53 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 107.918 -1.142 . . . . 89.5 107.918 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 109.476 -1.45 . . . . 8.6500000000000004 109.476 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.666 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.6 m-85 . . . . . 0 N--CA 1.497 1.91 0 CA-C-O 121.609 0.719 . . . . 70.069999999999993 109.152 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.7 139.56 40.93 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 122.272 1.034 . . . . 83.590000000000003 110.844 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -72.53 130.24 40.18 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 122.046 0.927 . . . . 50.890000000000001 110.593 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -92.95 22.89 4.55 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 109.311 -0.626 . . . . 99.159999999999997 109.311 -177.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.3 mm -123.72 -58.24 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.055 -1.028 . . . . 112.28 113.603 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.9 p -103.79 -38.5 7.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.706 -1.246 . . . . 82.079999999999998 110.537 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 133.04 13.58 1.54 Allowed Glycine 0 N--CA 1.506 3.362 0 CA-C-O 118.727 -1.041 . . . . 195.93000000000001 114.463 177.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -104.01 164.11 11.92 Favored 'General case' 0 N--CA 1.516 2.837 0 CA-C-N 121.167 2.483 . . . . 114.22 113.805 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.5 t -117.36 160.06 21.75 Favored 'General case' 0 N--CA 1.511 2.593 0 CA-C-O 122.511 1.148 . . . . 78.049999999999997 113.195 -176.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.539 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.9 m-85 -140.06 127.9 21.95 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-N 115.455 -0.793 . . . . 54.659999999999997 110.401 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.442 ' H ' HH21 ' A' ' 13' ' ' ARG . 47.5 mttp -72.59 -23.63 60.98 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 122.612 1.196 . . . . 101.13 109.217 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.71 ' N ' ' HE ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -119.17 115.5 24.36 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 114.784 -1.098 . . . . 74.890000000000001 110.158 -177.275 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.666 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 1.3 t -50.39 -33.69 21.59 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 118.4 -1.32 . . . . 25.870000000000001 109.303 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 p -56.28 -39.96 73.5 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.262 -1.524 . . . . 23.449999999999999 109.304 -178.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.1 m -72.64 -32.02 65.56 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.389 -0.967 . . . . 32.270000000000003 108.389 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.7 tp -72.73 -44.98 60.99 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 106.395 -1.706 . . . . 97.780000000000001 106.395 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.596 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 45.1 m -44.35 -53.96 6.28 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.84 -1.17 . . . . 34.229999999999997 107.84 178.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.7 m -59.63 -41.33 90.22 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.911 0.863 . . . . 30.690000000000001 109.008 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.539 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 56.6 t60 -63.18 -35.73 81.26 Favored 'General case' 0 C--N 1.291 -1.94 0 CA-C-O 122.423 1.106 . . . . 81.829999999999998 108.602 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.2 mt -70.73 -34.69 72.16 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.103 -1.814 . . . . 156.93000000000001 106.103 178.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 18' ' ' SER . 22.2 mt -65.4 -21.48 66.67 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.215 -1.402 . . . . 64.069999999999993 107.215 177.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 80.2 mt -74.89 -41.05 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 120.864 -1.148 . . . . 150.09999999999999 109.262 178.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -76.01 -27.71 57.48 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 118.027 -1.469 . . . . 55.939999999999998 108.865 178.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -86.91 -25.75 24.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.3 -0.875 . . . . 89.099999999999994 108.694 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 64.64 50.9 2.01 Favored 'General case' 0 C--N 1.29 -1.998 0 O-C-N 121.404 -0.81 . . . . 62.890000000000001 109.56 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.435 ' C ' HH11 ' A' ' 28' ' ' ARG . 2.3 m -98.23 127.46 44.17 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.445 -0.784 . . . . 115.68000000000001 109.261 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.435 HH11 ' C ' ' A' ' 27' ' ' THR . 1.7 mpt_? -136.36 80.04 40.81 Favored Pre-proline 0 N--CA 1.495 1.783 0 O-C-N 121.147 -0.971 . . . . 115.33 109.878 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -75.69 17.88 0.65 Allowed 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 122.296 1.997 . . . . 90.269999999999996 114.13 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.497 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 61.9 m-85 -124.1 82.73 56.4 Favored Pre-proline 0 N--CA 1.497 1.9 0 N-CA-C 107.657 -1.238 . . . . 131.19 107.657 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -79.41 147.49 20.23 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 C-N-CA 122.689 2.259 . . . . 108.54000000000001 114.396 -177.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.625 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.5 OUTLIER -71.78 137.29 47.54 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-O 121.674 0.75 . . . . 43.399999999999999 109.826 -179.029 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.56 -15.68 54.04 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 120.414 -0.515 . . . . 113.04000000000001 110.476 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.468 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 25.0 m-85 -119.09 -51.82 2.32 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 115.185 1.55 . . . . 118.47 115.185 -175.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.625 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.6 p -100.54 -18.62 16.55 Favored 'General case' 0 N--CA 1.517 2.917 0 O-C-N 120.414 -1.429 . . . . 56.060000000000002 113.843 -175.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 124.54 -32.58 4.04 Favored Glycine 0 N--CA 1.512 3.744 0 O-C-N 119.597 -1.94 . . . . 19.149999999999999 114.548 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -51.67 160.69 0.61 Allowed 'General case' 0 C--N 1.292 -1.915 0 O-C-N 120.895 -1.356 . . . . 73.469999999999999 112.698 -177.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -131.97 152.96 50.78 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 107.801 -1.185 . . . . 160.56 107.801 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.467 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 35.4 m-85 -135.02 162.18 33.19 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-O 121.979 0.895 . . . . 72.450000000000003 110.36 -178.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.492 ' N ' ' ND1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -94.17 -11.92 29.4 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 115.598 -0.728 . . . . 97.769999999999996 110.863 -178.796 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' C ' ' A' ' 42' ' ' LYS . 65.7 mt-30 -131.86 116.24 16.95 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.928 -1.107 . . . . 106.11 110.126 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.499 ' O ' ' N ' ' A' ' 45' ' ' MET . 81.9 tttt -34.32 -74.21 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.197 -0.939 . . . . 136.28999999999999 111.384 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -43.98 -34.43 1.7 Allowed 'General case' 0 C--N 1.295 -1.775 0 O-C-N 121.566 -0.709 . . . . 65.219999999999999 111.287 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -68.36 -40.74 81.39 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.332 -1.729 . . . . 40.659999999999997 106.332 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.647 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 9.1 tmm? -69.45 -47.61 63.46 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 119.965 -1.709 . . . . 31.66 108.05 176.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.556 ' O ' ' OG1' ' A' ' 49' ' ' THR . 31.7 ttmt -50.9 -35.97 35.75 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.681 -1.229 . . . . 103.12 107.681 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.454 ' O ' HG21 ' A' ' 51' ' ' ILE . 25.9 mtmm -67.9 -32.78 73.5 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 105.596 -2.002 . . . . 48.509999999999998 105.596 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.803 ' O ' HG12 ' A' ' 51' ' ' ILE . 73.9 t60 -64.67 -65.21 0.7 Allowed 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 106.121 -1.807 . . . . 65.659999999999997 106.121 174.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.556 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 41.0 p -40.79 -37.05 0.7 Allowed 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.934 -1.104 . . . . 47.020000000000003 110.521 178.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.489 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 4.0 m-30 -65.52 -36.99 85.46 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.034 -1.042 . . . . 54.630000000000003 109.082 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.803 HG12 ' O ' ' A' ' 48' ' ' HIS . 10.5 pt -59.91 -36.58 67.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 N-CA-C 106.857 -1.535 . . . . 99.090000000000003 106.857 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -74.4 -32.08 62.57 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.452 -1.405 . . . . 59.329999999999998 110.852 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.587 ' HG1' ' CG ' ' A' ' 55' ' ' GLU . 69.3 p -85.56 -8.7 58.14 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.551 -1.343 . . . . 97.329999999999998 111.626 -176.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 74.0 13.78 80.71 Favored Glycine 0 N--CA 1.49 2.284 0 O-C-N 120.761 -1.212 . . . . 23.68 110.082 -178.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.587 ' CG ' ' HG1' ' A' ' 53' ' ' THR . 98.0 mt-10 -75.82 107.78 8.23 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.98 0.895 . . . . 47.259999999999998 110.657 -178.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -115.49 79.66 7.32 Favored Pre-proline 0 C--N 1.292 -1.912 0 N-CA-C 108.241 -1.022 . . . . 86.790000000000006 108.241 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -75.06 -13.31 21.33 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.488 2.126 . . . . 151.44 114.125 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -90.73 82.08 5.77 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 120.267 -1.521 . . . . 42.670000000000002 109.421 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -77.31 140.03 39.92 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 122.003 0.906 . . . . 72.959999999999994 111.404 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.473 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -103.11 115.4 30.52 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.621 -1.992 . . . . 38.909999999999997 105.621 177.569 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -85.12 14.05 5.53 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.34 -1.475 . . . . 124.0 109.934 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.473 ' HB ' ' SG ' ' A' ' 60' ' ' CYS . 46.8 t -95.47 -38.93 9.22 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 O-C-N 121.255 -0.903 . . . . 56.07 110.439 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.7 p -131.3 -8.01 3.78 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 122.139 0.971 . . . . 63.829999999999998 108.877 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.16 31.94 33.2 Favored Glycine 0 C--N 1.29 -2.024 0 O-C-N 120.837 -1.164 . . . . 23.809999999999999 111.195 176.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -96.36 -172.4 2.52 Favored 'General case' 0 C--N 1.287 -2.127 0 N-CA-C 103.216 -2.883 . . . . 120.73999999999999 103.216 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -165.74 148.13 7.44 Favored 'General case' 0 C--N 1.265 -3.077 0 N-CA-C 105.739 -1.949 . . . . 39.509999999999998 105.739 -176.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.55 ' CZ ' ' CG ' ' A' ' 76' ' ' HIS . 2.7 m-85 -129.22 146.77 51.06 Favored 'General case' 0 C--N 1.28 -2.419 0 C-N-CA 117.79 -1.564 . . . . 62.57 113.401 -175.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.406 ' OG ' ' HG3' ' A' ' 69' ' ' GLN . 4.9 p -70.7 -8.03 49.06 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 115.277 -0.874 . . . . 84.840000000000003 108.993 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.406 ' HG3' ' OG ' ' A' ' 68' ' ' SER . 24.7 mt-30 -145.4 130.82 18.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.036 -1.04 . . . . 93.390000000000001 111.312 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.596 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -51.1 -48.9 61.59 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.767 -1.208 . . . . 67.340000000000003 109.3 177.224 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.436 ' C ' ' O ' ' A' ' 70' ' ' SER . 0.3 OUTLIER -44.6 -44.87 9.18 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.969 -1.082 . . . . 68.680000000000007 108.7 -179.304 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.407 ' O ' ' CB ' ' A' ' 76' ' ' HIS . 63.0 m-20 -70.66 -28.1 64.53 Favored 'General case' 0 C--N 1.291 -1.976 0 C-N-CA 118.187 -1.405 . . . . 33.829999999999998 108.145 178.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.596 ' N ' ' O ' ' A' ' 70' ' ' SER . 37.6 tp -70.19 -59.33 2.95 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 106.778 -1.564 . . . . 75.650000000000006 106.778 175.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 91.5 mt -46.78 -54.34 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.376 -1.452 . . . . 27.719999999999999 109.875 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.435 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 3.2 m -61.96 -43.27 99.19 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 119.631 -1.918 . . . . 95.200000000000003 109.004 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.55 ' CG ' ' CZ ' ' A' ' 67' ' ' PHE . 16.2 t60 -58.94 -45.65 89.91 Favored 'General case' 0 C--N 1.296 -1.76 0 O-C-N 121.12 -0.988 . . . . 66.299999999999997 109.39 -178.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.6 t -69.15 -33.78 73.95 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 120.244 -1.535 . . . . 87.230000000000004 107.997 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 75' ' ' THR . 4.3 mtt85 -50.83 -41.04 57.3 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 106.49 -1.67 . . . . 73.269999999999996 106.49 178.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -64.6 -45.02 88.75 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 118.252 -1.379 . . . . 80.849999999999994 108.582 178.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.422 ' CD2' ' HB ' ' A' ' 62' ' ' VAL . 63.7 m-70 -62.49 -35.28 78.85 Favored 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 116.52 -2.072 . . . . 46.009999999999998 108.52 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 50.6 p -96.09 19.1 12.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.085 -1.01 . . . . 89.5 109.786 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.552 0 N-CA-C 109.381 -1.487 . . . . 8.6500000000000004 109.381 178.971 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.576 ' CE2' ' N ' ' A' ' 14' ' ' SER . 3.7 m-85 . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.671 0.748 . . . . 70.069999999999993 109.158 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.904 ' O ' ' O ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -108.68 103.24 12.29 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 122.009 0.909 . . . . 83.590000000000003 110.761 -178.558 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.904 ' O ' ' O ' ' A' ' 3' ' ' ASP . 19.4 t -13.88 157.21 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.214 0 CA-C-N 114.621 -1.172 . . . . 50.890000000000001 109.573 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.7 mttp -120.36 20.44 11.92 Favored 'General case' 0 N--CA 1.507 2.385 0 N-CA-C 106.474 -1.676 . . . . 99.159999999999997 106.474 174.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.527 ' HB ' ' NE2' ' A' ' 24' ' ' HIS . 6.3 mm -126.13 -80.35 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 CA-C-N 115.333 -0.848 . . . . 112.28 110.361 -178.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.8 p -81.45 -36.2 29.66 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.269 -1.519 . . . . 82.079999999999998 109.384 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.88 43.44 1.12 Allowed Glycine 0 N--CA 1.506 3.302 0 C-N-CA 119.696 -1.24 . . . . 195.93000000000001 113.521 177.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.474 ' HG2' ' N ' ' A' ' 10' ' ' SER . 49.5 tttm -112.19 160.39 17.64 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.503 -1.586 . . . . 114.22 107.856 178.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.474 ' N ' ' HG2' ' A' ' 9' ' ' LYS . 57.6 p -112.32 146.96 37.34 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 123.499 1.619 . . . . 78.049999999999997 114.708 -174.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.506 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 49.4 m-85 -130.22 125.69 35.52 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 113.35 -1.75 . . . . 54.659999999999997 110.047 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.1 mttp -70.82 -21.21 62.49 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 122.631 1.205 . . . . 101.13 108.507 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.516 ' NH2' ' H ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -114.68 136.82 52.64 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 114.893 -1.049 . . . . 74.890000000000001 110.19 -177.178 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.576 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 19.3 t -65.62 -36.4 83.6 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.041 -1.037 . . . . 25.870000000000001 108.978 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.436 ' O ' ' OG ' ' A' ' 18' ' ' SER . 0.1 OUTLIER -65.96 -38.99 90.01 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.186 -0.946 . . . . 23.449999999999999 110.293 -179.26 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.8 m -66.11 -31.31 72.1 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 105.854 -1.906 . . . . 32.270000000000003 105.854 178.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.9 tp -73.19 -35.14 66.33 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 106.712 -1.588 . . . . 97.780000000000001 106.712 176.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.62 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 40.3 p -57.91 -57.16 14.0 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.782 -1.199 . . . . 34.229999999999997 108.308 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.9 m -53.53 -41.17 66.12 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 122.439 1.114 . . . . 30.690000000000001 108.863 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.506 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 55.3 t60 -62.78 -47.47 83.35 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-O 122.511 1.148 . . . . 81.829999999999998 108.411 178.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 37.9 mt -58.19 -30.72 66.65 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.025 -1.472 . . . . 156.93000000000001 107.025 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 18' ' ' SER . 61.3 mt -72.41 -26.69 61.96 Favored 'General case' 0 C--O 1.205 -1.246 0 N-CA-C 107.967 -1.123 . . . . 64.069999999999993 107.967 178.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 49.5 mt -64.07 -34.0 65.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 O-C-N 120.046 -1.659 . . . . 150.09999999999999 107.028 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.527 ' NE2' ' HB ' ' A' ' 6' ' ' ILE . 89.7 m-70 -81.21 -37.29 28.88 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 118.697 -1.201 . . . . 55.939999999999998 110.477 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.51 ' O ' ' C ' ' A' ' 26' ' ' ASP . 57.4 m -93.6 1.87 56.54 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.387 -1.446 . . . . 89.099999999999994 109.043 -179.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.51 ' C ' ' O ' ' A' ' 25' ' ' SER . 1.1 p30 32.47 59.86 0.38 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.436 0.636 . . . . 62.890000000000001 110.164 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 91.5 m -70.65 -54.54 11.53 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 108.077 -1.083 . . . . 115.68000000000001 108.077 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.408 ' HG2' HH11 ' A' ' 28' ' ' ARG . 23.3 mtt-85 40.69 67.64 2.76 Favored Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.731 -0.605 . . . . 115.33 110.843 179.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -89.1 26.24 0.57 Allowed 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.639 2.226 . . . . 90.269999999999996 113.847 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.535 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 63.9 m-85 -122.73 76.54 47.54 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 120.694 -1.254 . . . . 131.19 107.634 179.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.29 125.81 12.28 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 122.696 2.264 . . . . 108.54000000000001 114.507 -176.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.9 OUTLIER -52.92 135.24 36.8 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.636 -0.876 . . . . 43.399999999999999 108.636 177.914 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.7 -11.57 58.24 Favored 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.372 -0.931 . . . . 113.04000000000001 109.652 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.519 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 85.6 m-85 -104.71 -74.29 0.65 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.798 -1.189 . . . . 118.47 111.659 -178.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.555 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 28.4 p -85.98 -19.82 29.83 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 118.614 -1.234 . . . . 56.060000000000002 111.487 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.71 0.16 55.33 Favored Glycine 0 N--CA 1.498 2.771 0 O-C-N 120.409 -1.432 . . . . 19.149999999999999 114.867 175.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.5 mttp -54.57 164.84 0.66 Allowed 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 121.737 2.769 . . . . 73.469999999999999 107.42 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -123.85 107.56 11.52 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.454 -1.404 . . . . 160.56 109.132 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.596 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 31.6 m-85 -89.44 170.63 10.37 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.334 -0.854 . . . . 72.450000000000003 111.15 -178.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.776 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 0.3 OUTLIER -117.1 40.25 3.05 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 115.651 -0.704 . . . . 97.769999999999996 111.037 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.776 ' HG3' ' O ' ' A' ' 40' ' ' HIS . 12.9 mt-30 179.72 105.73 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 108.473 -0.936 . . . . 106.11 108.473 177.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.535 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 33.8 tttp -32.35 -65.37 0.15 Allowed 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 112.627 0.603 . . . . 136.28999999999999 112.627 -178.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.1 m -52.89 -39.15 62.46 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.502 -0.749 . . . . 65.219999999999999 111.11 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -64.74 -42.1 95.43 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.309 -1.367 . . . . 40.659999999999997 107.309 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.593 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 61.9 ttp -63.32 -44.9 93.62 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.33 -1.481 . . . . 31.66 107.22 177.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.64 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 22.9 mttm -51.41 -42.44 61.46 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 107.547 -1.279 . . . . 103.12 107.547 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -59.63 -30.99 69.11 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 106.361 -1.718 . . . . 48.509999999999998 106.361 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.596 ' ND1' ' HZ ' ' A' ' 39' ' ' PHE . 76.3 t60 -71.19 -65.14 0.78 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 107.419 -1.326 . . . . 65.659999999999997 107.419 176.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.64 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 19.4 p -43.99 -31.07 0.82 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.586 -1.321 . . . . 47.020000000000003 110.003 178.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -71.39 -34.02 70.02 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.457 -0.777 . . . . 54.630000000000003 109.198 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.596 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.0 pt -65.95 -36.64 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 C-N-CA 118.029 -1.468 . . . . 99.090000000000003 108.362 176.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.474 ' NE2' ' HB2' ' A' ' 34' ' ' TYR . 78.1 m-70 -69.48 -32.04 70.69 Favored 'General case' 0 N--CA 1.524 3.232 0 O-C-N 120.142 -1.599 . . . . 59.329999999999998 110.368 178.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 63.1 p -82.27 -17.48 45.76 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.506 -0.746 . . . . 97.329999999999998 109.599 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 84.13 17.38 65.08 Favored Glycine 0 N--CA 1.481 1.697 0 N-CA-C 107.359 -2.297 . . . . 23.68 107.359 -177.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -76.48 116.97 17.65 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 122.143 0.973 . . . . 47.259999999999998 110.348 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -125.72 78.47 69.03 Favored Pre-proline 0 N--CA 1.49 1.575 0 N-CA-C 108.76 -0.83 . . . . 86.790000000000006 108.76 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -65.0 -10.66 26.36 Favored 'Trans proline' 0 C--N 1.309 -1.548 0 C-N-CA 122.589 2.193 . . . . 151.44 112.804 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -112.34 95.79 5.65 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 117.762 -1.575 . . . . 42.670000000000002 109.434 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -97.96 129.49 44.86 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.22 -0.925 . . . . 72.959999999999994 110.219 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.84 120.55 17.59 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 107.147 -1.427 . . . . 38.909999999999997 107.147 178.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -88.2 9.7 22.01 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.275 -1.009 . . . . 124.0 108.275 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.2 t -94.56 -59.89 2.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 C-N-CA 119.929 -0.709 . . . . 56.07 111.026 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.4 p -114.56 -17.87 11.59 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 113.987 1.106 . . . . 63.829999999999998 113.987 -177.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.86 -11.75 7.37 Favored Glycine 0 N--CA 1.514 3.891 0 CA-C-N 122.112 2.233 . . . . 23.809999999999999 114.765 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.5 tttp -86.8 166.0 15.56 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.077 -1.837 . . . . 120.73999999999999 112.024 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.52 151.82 48.98 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.19 -0.944 . . . . 39.509999999999998 112.228 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.539 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 90.6 m-85 -132.49 144.18 50.27 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 122.264 1.03 . . . . 62.57 112.922 -177.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.9 t -78.47 -40.03 36.68 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.293 -1.003 . . . . 84.840000000000003 108.293 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -106.29 140.66 38.88 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.965 0.888 . . . . 93.390000000000001 110.747 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.503 ' HG ' ' N ' ' A' ' 71' ' ' SER . 75.2 p -62.33 -40.37 96.12 Favored 'General case' 0 C--O 1.195 -1.796 0 N-CA-C 107.86 -1.163 . . . . 67.340000000000003 107.86 178.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.503 ' N ' ' HG ' ' A' ' 70' ' ' SER . 0.4 OUTLIER -51.66 -35.1 41.02 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.621 -0.674 . . . . 68.680000000000007 110.078 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -80.57 -32.77 36.5 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.012 -1.075 . . . . 33.829999999999998 108.581 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 77' ' ' SER . 13.6 tp -73.71 -35.21 65.1 Favored 'General case' 0 C--O 1.202 -1.402 0 N-CA-C 106.914 -1.513 . . . . 75.650000000000006 106.914 176.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.566 ' O ' ' OG ' ' A' ' 77' ' ' SER . 66.6 mt -59.25 -54.16 38.14 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 O-C-N 120.486 -1.384 . . . . 27.719999999999999 107.732 177.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.65 ' O ' ' N ' ' A' ' 78' ' ' ARG . 55.2 m -57.98 -61.76 2.31 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 122.705 1.24 . . . . 95.200000000000003 107.91 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.539 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 13.0 t60 -45.59 -40.7 9.13 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.079 -1.082 . . . . 66.299999999999997 108.079 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.566 ' OG ' ' O ' ' A' ' 74' ' ' ILE . 95.6 p -69.45 -32.07 70.77 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 107.207 -1.405 . . . . 87.230000000000004 107.207 177.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.65 ' N ' ' O ' ' A' ' 75' ' ' THR . 51.8 mtp85 -61.41 -39.76 91.9 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.071 -1.018 . . . . 73.269999999999996 108.915 178.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.3 mttt -59.17 -45.72 90.27 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 105.622 -1.992 . . . . 80.849999999999994 105.622 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 47.7 m-70 -60.06 -43.13 95.62 Favored 'General case' 0 C--N 1.295 -1.78 0 C-N-CA 117.211 -1.796 . . . . 46.009999999999998 109.305 175.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.433 ' HG1' ' HA ' ' A' ' 78' ' ' ARG . 75.4 p -91.82 22.13 4.39 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.379 -1.45 . . . . 89.5 108.919 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.486 2.002 0 N-CA-C 109.875 -1.29 . . . . 8.6500000000000004 109.875 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.474 ' CE2' ' N ' ' A' ' 14' ' ' SER . 1.7 m-85 . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 108.44 -0.948 . . . . 70.069999999999993 108.44 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.5 p-10 -103.23 128.42 50.24 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 122.483 1.135 . . . . 83.590000000000003 110.341 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.34 123.88 19.41 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 108.123 -1.066 . . . . 50.890000000000001 108.123 178.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -83.43 -8.7 59.34 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.297 -0.877 . . . . 99.159999999999997 109.758 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.3 mm -83.14 -70.0 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.767 -1.208 . . . . 112.28 110.618 -179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 24.2 p -94.42 -23.9 17.56 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 120.816 -1.177 . . . . 82.079999999999998 111.215 -178.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 101.93 37.32 3.44 Favored Glycine 0 N--CA 1.504 3.226 0 C-N-CA 119.214 -1.47 . . . . 195.93000000000001 114.047 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -113.86 161.87 17.05 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.556 -1.556 . . . . 114.22 107.512 177.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.3 t -114.02 166.3 11.74 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.377 -1.452 . . . . 78.049999999999997 112.739 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.544 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 53.0 m-85 -143.18 127.94 18.22 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 114.643 -1.162 . . . . 54.659999999999997 109.775 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.632 ' NZ ' ' NH1' ' A' ' 13' ' ' ARG . 7.0 mtmp? -70.36 -24.45 62.97 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.609 0.719 . . . . 101.13 109.433 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.828 ' HE ' ' H ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -118.5 138.24 52.65 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.611 -0.681 . . . . 74.890000000000001 109.309 -178.642 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.474 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 22.9 t -59.87 -34.13 72.74 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 120.95 -1.094 . . . . 25.870000000000001 108.706 -179.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.405 ' O ' ' OG ' ' A' ' 18' ' ' SER . 1.0 OUTLIER -62.46 -44.18 97.03 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 121.245 -0.909 . . . . 23.449999999999999 109.004 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.576 ' HG1' ' HE ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -61.51 -32.72 72.77 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 106.977 -1.49 . . . . 32.270000000000003 106.977 179.675 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.5 tp -73.83 -37.64 64.79 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.112 -1.44 . . . . 97.780000000000001 107.112 177.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.628 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 31.9 p -57.6 -58.53 7.93 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.796 -1.19 . . . . 34.229999999999997 109.195 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.429 ' N ' ' OG ' ' A' ' 18' ' ' SER . 97.0 m -57.07 -34.96 68.81 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 122.026 0.917 . . . . 30.690000000000001 108.961 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 62.1 t60 -65.94 -49.55 67.52 Favored 'General case' 0 C--N 1.295 -1.761 0 O-C-N 121.003 -1.061 . . . . 81.829999999999998 108.488 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 71.1 mt -55.25 -30.27 59.71 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 106.743 -1.577 . . . . 156.93000000000001 106.743 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 18' ' ' SER . 26.0 mt -70.9 -29.2 65.2 Favored 'General case' 0 C--O 1.208 -1.088 0 N-CA-C 108.178 -1.045 . . . . 64.069999999999993 108.178 178.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.414 ' N ' ' O ' ' A' ' 20' ' ' HIS . 65.4 mt -62.14 -36.1 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 O-C-N 119.877 -1.764 . . . . 150.09999999999999 107.728 177.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -80.97 -31.15 34.92 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 118.765 -1.174 . . . . 55.939999999999998 111.192 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.8 m -92.98 -5.0 51.66 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.173 -1.579 . . . . 89.099999999999994 108.875 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 46.21 73.22 0.18 Allowed 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 109.245 -0.65 . . . . 62.890000000000001 109.245 -178.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.5 m -107.84 122.59 47.08 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.53 -0.915 . . . . 115.68000000000001 108.53 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -139.02 85.55 15.86 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.078 -1.014 . . . . 115.33 109.974 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -83.07 7.84 4.97 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 122.498 2.132 . . . . 90.269999999999996 113.388 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -112.27 93.94 24.38 Favored Pre-proline 0 N--CA 1.499 1.982 0 O-C-N 120.988 -1.07 . . . . 131.19 109.036 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.451 ' CB ' ' HE ' ' A' ' 38' ' ' ARG . 93.0 Cg_endo -85.78 129.29 3.5 Favored 'Trans proline' 0 N--CA 1.491 1.325 0 C-N-CA 122.636 2.224 . . . . 108.54000000000001 115.099 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.577 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -55.43 135.11 50.66 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.017 -1.105 . . . . 43.399999999999999 108.017 177.374 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -80.55 -16.27 54.62 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 121.826 -0.546 . . . . 113.04000000000001 110.954 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.48 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 13.9 m-85 -109.77 -66.61 1.05 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.603 -1.311 . . . . 118.47 112.333 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.577 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.9 p -91.01 12.72 18.84 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.602 -1.311 . . . . 56.060000000000002 112.209 -178.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 37' ' ' LYS . . . 69.79 -11.44 1.84 Allowed Glycine 0 N--CA 1.511 3.651 0 O-C-N 121.099 -1.001 . . . . 19.149999999999999 115.581 175.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.417 ' C ' ' O ' ' A' ' 36' ' ' GLY . 21.9 tttp -46.55 154.44 0.3 Allowed 'General case' 0 N--CA 1.507 2.411 0 CA-C-N 120.423 2.111 . . . . 73.469999999999999 108.717 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.451 ' HE ' ' CB ' ' A' ' 31' ' ' PRO . 1.1 mmt85 -120.23 147.6 44.74 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 120.081 -1.637 . . . . 160.56 109.785 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.532 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 77.5 m-85 -128.7 171.86 11.79 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.537 -0.727 . . . . 72.450000000000003 109.373 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.592 ' N ' ' ND1' ' A' ' 40' ' ' HIS . 2.8 p-80 -109.58 -8.43 14.99 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.828 -0.545 . . . . 97.769999999999996 111.108 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -128.52 123.13 32.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.745 -1.222 . . . . 106.11 109.708 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -43.88 -66.1 0.42 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.887 -1.133 . . . . 136.28999999999999 111.177 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 21.9 t -47.18 -33.28 5.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.356 -0.84 . . . . 65.219999999999999 111.094 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -69.09 -45.2 70.86 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.129 -1.029 . . . . 40.659999999999997 108.28 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.54 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 35.7 ttp -63.03 -46.18 88.8 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.215 -1.402 . . . . 31.66 107.215 177.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.55 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 3.9 mmpt? -52.04 -40.74 61.54 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.33 -0.989 . . . . 103.12 108.33 -179.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 42.6 mtmt -63.14 -32.83 74.31 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 107.272 -1.381 . . . . 48.509999999999998 107.272 178.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.54 ' HB3' ' O ' ' A' ' 45' ' ' MET . 53.6 t60 -69.4 -65.82 0.66 Allowed 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 106.753 -1.573 . . . . 65.659999999999997 106.753 177.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.55 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 25.6 p -42.38 -30.43 0.33 Allowed 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.832 -1.168 . . . . 47.020000000000003 109.936 177.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.56 ' CD1' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-30 -73.46 -34.99 65.66 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.301 -0.875 . . . . 54.630000000000003 110.283 -179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 48' ' ' HIS . 19.2 pt -69.13 -22.28 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 C-N-CA 118.191 -1.404 . . . . 99.090000000000003 107.583 177.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.436 ' CE1' ' HB2' ' A' ' 34' ' ' TYR . 45.0 m-70 -79.72 -32.48 41.2 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.022 -1.048 . . . . 59.329999999999998 108.86 176.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.462 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 76.3 p -87.88 -11.98 46.13 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.709 -0.62 . . . . 97.329999999999998 112.175 -177.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.57 19.58 65.83 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 107.87 -2.092 . . . . 23.68 107.87 -177.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.56 ' OE1' ' CD1' ' A' ' 50' ' ' PHE . 32.3 mt-10 -79.14 130.24 35.29 Favored 'General case' 0 C--N 1.306 -1.3 0 O-C-N 121.379 -1.071 . . . . 47.259999999999998 110.922 -177.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -145.85 62.47 8.41 Favored Pre-proline 0 N--CA 1.49 1.567 0 N-CA-C 109.065 -0.717 . . . . 86.790000000000006 109.065 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -53.1 -15.47 5.09 Favored 'Trans proline' 0 N--CA 1.501 1.962 0 C-N-CA 123.132 2.554 . . . . 151.44 113.314 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.596 ' CE1' ' OG ' ' A' ' 70' ' ' SER . 95.9 m-70 -94.54 96.16 9.28 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.85 -1.156 . . . . 42.670000000000002 108.86 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.444 ' O ' ' C ' ' A' ' 60' ' ' CYS . 95.9 mttt -93.6 120.46 33.9 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.035 -1.041 . . . . 72.959999999999994 110.615 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.664 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 3.9 t -38.47 -86.68 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.728 -0.607 . . . . 38.909999999999997 109.765 179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.664 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 8.7 mm100 117.1 -16.51 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.732 0 CA-C-O 122.173 0.987 . . . . 124.0 108.804 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.403 ' N ' ' SG ' ' A' ' 60' ' ' CYS . 5.6 t -95.86 -63.04 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 CA-C-O 121.776 0.798 . . . . 56.07 109.994 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 23.8 p -101.42 -14.05 17.72 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.856 -0.528 . . . . 63.829999999999998 111.647 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.71 27.43 9.04 Favored Glycine 0 N--CA 1.504 3.207 0 O-C-N 120.372 -1.455 . . . . 23.809999999999999 111.709 178.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -105.37 164.0 12.19 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.514 -1.58 . . . . 120.73999999999999 107.41 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.444 ' C ' ' CD2' ' A' ' 67' ' ' PHE . . . -134.27 163.22 30.11 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.897 -1.127 . . . . 39.509999999999998 111.518 -177.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.444 ' CD2' ' C ' ' A' ' 66' ' ' ALA . 66.2 m-85 -145.5 147.18 31.87 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 122.569 1.176 . . . . 62.57 113.548 -177.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 78.6 p -81.6 -10.72 59.36 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 115.266 -0.879 . . . . 84.840000000000003 109.193 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -133.63 145.06 49.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.214 -0.928 . . . . 93.390000000000001 110.646 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.596 ' OG ' ' CE1' ' A' ' 58' ' ' HIS . 10.0 m -71.2 -47.44 57.42 Favored 'General case' 0 C--O 1.197 -1.685 0 C-N-CA 119.45 -0.9 . . . . 67.340000000000003 109.135 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -50.45 -33.22 20.26 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.193 -0.942 . . . . 68.680000000000007 108.58 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -77.37 -34.09 55.12 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.976 -1.078 . . . . 33.829999999999998 108.347 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.0 tp -73.28 -39.41 65.39 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.105 -1.072 . . . . 75.650000000000006 108.105 177.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.428 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 93.0 mt -57.86 -53.79 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 O-C-N 120.768 -1.207 . . . . 27.719999999999999 108.666 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.439 ' HA ' ' HE ' ' A' ' 78' ' ' ARG . 97.4 m -59.08 -43.86 91.83 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.865 -1.147 . . . . 95.200000000000003 108.372 179.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.409 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 31.8 t60 -58.54 -43.34 89.22 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 122.563 1.173 . . . . 66.299999999999997 108.149 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 36.4 t -68.38 -34.51 76.18 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.173 -0.955 . . . . 87.230000000000004 109.279 178.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' A' ' 75' ' ' THR . 28.1 mtm180 -61.38 -33.68 74.07 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 107.948 -1.13 . . . . 73.269999999999996 107.948 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -47.9 77.59 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 107.19 -1.411 . . . . 80.849999999999994 107.19 178.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 53.3 m-70 -61.05 -44.96 96.61 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 117.834 -1.547 . . . . 46.009999999999998 109.077 178.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 33.8 m -50.31 -54.8 18.85 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.442 -0.786 . . . . 89.5 110.383 -177.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.65 -1.38 . . . . 8.6500000000000004 109.65 179.995 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.548 ' CE1' ' N ' ' A' ' 14' ' ' SER . 13.7 m-85 . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 108.834 -0.802 . . . . 70.069999999999993 108.834 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -104.96 137.36 42.83 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 122.287 1.041 . . . . 83.590000000000003 112.016 -178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.57 130.26 38.52 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-N 115.199 -0.91 . . . . 50.890000000000001 110.34 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -98.82 32.12 2.72 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 121.216 0.532 . . . . 99.159999999999997 109.617 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.426 ' HB ' ' NE2' ' A' ' 24' ' ' HIS . 5.2 mm -126.92 -78.38 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.293 -0.879 . . . . 112.28 108.82 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.54 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 31.7 p -83.26 -52.07 6.9 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.559 -1.645 . . . . 82.079999999999998 106.559 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.54 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 121.46 62.77 0.23 Allowed Glycine 0 N--CA 1.496 2.659 0 C-N-CA 119.761 -1.209 . . . . 195.93000000000001 113.401 176.6 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -131.11 161.6 31.73 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 106.357 -1.72 . . . . 114.22 106.357 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.3 p -115.37 167.91 10.44 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.094 -1.629 . . . . 78.049999999999997 112.466 -176.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.508 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 55.3 m-85 -145.43 131.95 19.79 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 115.078 -0.965 . . . . 54.659999999999997 110.966 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -19.57 63.07 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 115.788 -0.642 . . . . 101.13 110.035 -179.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.429 ' O ' ' OG1' ' A' ' 16' ' ' THR . 0.1 OUTLIER -124.9 136.81 54.12 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.32 -0.863 . . . . 74.890000000000001 109.975 -178.32 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.548 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 30.5 t -56.07 -33.12 64.72 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 118.975 -1.09 . . . . 25.870000000000001 108.337 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.5 p -65.22 -42.06 93.81 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.039 -0.726 . . . . 23.449999999999999 109.039 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.429 ' OG1' ' O ' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -63.44 -33.25 75.14 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.336 -1.357 . . . . 32.270000000000003 107.336 179.555 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.7 tp -72.37 -46.32 55.91 Favored 'General case' 0 C--O 1.199 -1.59 0 N-CA-C 106.009 -1.848 . . . . 97.780000000000001 106.009 177.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.623 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 19.1 t -48.74 -58.84 4.16 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.162 -0.961 . . . . 34.229999999999997 108.505 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.4 m -54.61 -36.49 64.51 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.06 0.933 . . . . 30.690000000000001 109.163 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.508 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 64.4 t60 -68.21 -47.08 68.85 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-O 122.5 1.143 . . . . 81.829999999999998 108.269 179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.9 mt -59.97 -34.35 73.18 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 106.448 -1.686 . . . . 156.93000000000001 106.448 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 18' ' ' SER . 7.0 mt -62.36 -31.18 71.79 Favored 'General case' 0 C--O 1.205 -1.246 0 N-CA-C 107.237 -1.394 . . . . 64.069999999999993 107.237 178.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.415 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 65.1 mt -63.01 -34.88 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.38 -1.45 . . . . 150.09999999999999 108.112 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.426 ' NE2' ' HB ' ' A' ' 6' ' ' ILE . 97.2 m-70 -85.59 -14.39 45.89 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.248 -0.981 . . . . 55.939999999999998 109.434 178.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.537 ' O ' ' C ' ' A' ' 26' ' ' ASP . 4.9 p -108.62 0.24 20.59 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.945 -1.097 . . . . 89.099999999999994 109.457 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.537 ' C ' ' O ' ' A' ' 25' ' ' SER . 9.9 m-20 27.88 51.5 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.323 0.582 . . . . 62.890000000000001 109.845 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.498 HG22 ' H ' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -66.53 -47.09 74.01 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.882 -0.784 . . . . 115.68000000000001 108.882 179.601 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.498 ' H ' HG22 ' A' ' 27' ' ' THR . 9.6 mpt_? 37.33 65.76 2.42 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.694 -0.629 . . . . 115.33 111.354 178.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -83.07 31.58 0.52 Allowed 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.998 2.465 . . . . 90.269999999999996 113.378 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -136.13 76.23 51.79 Favored Pre-proline 0 N--CA 1.5 2.066 0 O-C-N 120.795 -1.191 . . . . 131.19 108.605 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.415 ' HB3' ' HE ' ' A' ' 38' ' ' ARG . 18.5 Cg_exo -66.09 160.4 44.84 Favored 'Trans proline' 0 N--CA 1.502 2.028 0 C-N-CA 123.331 2.688 . . . . 108.54000000000001 114.681 -178.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.565 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -83.79 136.53 34.11 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 122.058 0.932 . . . . 43.399999999999999 108.633 178.215 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -79.23 -16.92 55.77 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 115.842 -0.617 . . . . 113.04000000000001 109.772 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.538 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 18.1 m-85 -111.89 -71.02 0.78 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.779 -1.201 . . . . 118.47 112.634 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.565 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 20.1 p -83.03 -18.72 38.73 Favored 'General case' 0 N--CA 1.517 2.883 0 O-C-N 120.331 -1.481 . . . . 56.060000000000002 113.7 -177.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.567 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 114.05 -35.01 4.68 Favored Glycine 0 N--CA 1.511 3.65 0 O-C-N 120.189 -1.569 . . . . 19.149999999999999 113.518 176.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.567 ' O ' ' O ' ' A' ' 36' ' ' GLY . 5.8 mtpm? -26.57 149.34 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.862 0 O-C-N 121.075 -1.25 . . . . 73.469999999999999 110.772 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.433 ' NH2' ' O ' ' A' ' 36' ' ' GLY . 3.2 mmp_? -116.89 136.61 52.81 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.823 -1.176 . . . . 160.56 107.823 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.424 ' CZ ' ' CG ' ' A' ' 48' ' ' HIS . 34.1 m-85 -124.91 176.78 6.41 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.311 -0.996 . . . . 72.450000000000003 108.311 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.63 ' CD2' ' O ' ' A' ' 40' ' ' HIS . 1.5 t-80 -113.34 -19.38 11.76 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.73 -0.788 . . . . 97.769999999999996 111.563 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' A' ' 44' ' ' ASP . 67.5 mt-30 -121.88 128.43 51.59 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.728 -1.232 . . . . 106.11 111.635 -178.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.42 ' C ' ' O ' ' A' ' 41' ' ' GLN . 35.1 tptt -41.98 -71.05 0.09 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.227 -0.921 . . . . 136.28999999999999 110.109 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.411 ' C ' ' O ' ' A' ' 42' ' ' LYS . 26.0 p -43.5 -29.26 0.44 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.909 -1.12 . . . . 65.219999999999999 110.619 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 41' ' ' GLN . 4.8 m-20 -70.57 -47.59 59.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.377 -1.452 . . . . 40.659999999999997 107.822 178.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.497 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.0 tmm? -63.98 -48.01 78.12 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.425 -1.422 . . . . 31.66 107.796 178.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.589 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 90.2 mttt -51.1 -36.02 38.25 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.041 -1.096 . . . . 103.12 108.041 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.58 ' O ' HG23 ' A' ' 51' ' ' ILE . 30.3 mtpt -68.49 -34.52 76.06 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.106 -1.442 . . . . 48.509999999999998 107.106 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.793 ' O ' HG12 ' A' ' 51' ' ' ILE . 66.3 t60 -70.94 -64.49 0.89 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 106.9 -1.518 . . . . 65.659999999999997 106.9 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.589 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 16.9 p -42.66 -33.6 0.75 Allowed 'General case' 0 C--N 1.31 -1.148 0 O-C-N 120.414 -1.429 . . . . 47.020000000000003 108.775 177.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.514 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.1 m-85 -69.54 -28.06 65.69 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.057 -1.027 . . . . 54.630000000000003 108.233 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.793 HG12 ' O ' ' A' ' 48' ' ' HIS . 12.6 pt -73.34 -19.12 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 120.74 -1.225 . . . . 99.090000000000003 109.32 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.429 ' CD2' ' HB2' ' A' ' 34' ' ' TYR . 69.4 m-70 -89.9 -31.49 17.27 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.367 -1.458 . . . . 59.329999999999998 108.754 177.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.514 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 41.3 p -84.65 -20.73 30.84 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-N 115.345 -0.843 . . . . 97.329999999999998 109.329 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 71.72 49.06 25.41 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 108.606 -1.798 . . . . 23.68 108.606 -177.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.42 110.49 22.5 Favored 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.515 -0.991 . . . . 47.259999999999998 109.025 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -117.86 70.75 7.51 Favored Pre-proline 0 N--CA 1.494 1.725 0 O-C-N 121.5 -0.75 . . . . 86.790000000000006 110.556 -178.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -60.76 -8.2 8.91 Favored 'Trans proline' 0 N--CA 1.505 2.163 0 C-N-CA 123.841 3.027 . . . . 151.44 114.082 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.411 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 96.7 m-70 -101.83 93.0 5.07 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.549 -1.345 . . . . 42.670000000000002 108.315 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.457 ' CB ' ' NZ ' ' A' ' 59' ' ' LYS . 7.3 mtpm? -94.78 128.12 41.27 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.281 -0.887 . . . . 72.959999999999994 110.151 -178.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.419 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -79.43 124.64 28.64 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.702 0.763 . . . . 38.909999999999997 109.586 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -85.66 11.26 11.23 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.254 -0.904 . . . . 124.0 110.046 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.528 ' HB ' ' CD2' ' A' ' 80' ' ' HIS . 22.3 t -98.81 -58.1 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 120.865 -1.147 . . . . 56.07 111.049 -178.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 31.8 p -107.15 -25.5 11.52 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.157 -0.964 . . . . 63.829999999999998 109.76 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 109.39 10.85 22.96 Favored Glycine 0 N--CA 1.5 2.94 0 O-C-N 120.901 -1.125 . . . . 23.809999999999999 111.687 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 tttm -88.81 174.54 7.92 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.446 -1.62 . . . . 120.73999999999999 108.765 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -137.65 150.38 47.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.761 -1.212 . . . . 39.509999999999998 111.419 -177.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.508 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 63.8 m-85 -132.09 147.68 52.45 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 122.167 0.984 . . . . 62.57 111.534 -178.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.8 m -83.55 -19.6 35.33 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 108.934 -0.765 . . . . 84.840000000000003 108.934 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -122.53 146.1 47.71 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.121 -1.032 . . . . 93.390000000000001 111.697 -177.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 10.6 m -65.45 -40.82 93.69 Favored 'General case' 0 C--O 1.199 -1.571 0 N-CA-C 106.794 -1.558 . . . . 67.340000000000003 106.794 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.5 t -50.24 -45.69 54.23 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.479 -0.763 . . . . 68.680000000000007 109.356 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -73.25 -30.99 63.84 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 118.72 -1.192 . . . . 33.829999999999998 109.459 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 18.2 tp -74.4 -39.76 62.47 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.869 -1.144 . . . . 75.650000000000006 108.987 177.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.406 ' O ' ' CG ' ' A' ' 78' ' ' ARG . 97.3 mt -63.6 -50.4 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 120.254 -1.529 . . . . 27.719999999999999 107.67 177.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.7 m -57.98 -49.8 75.58 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 122.286 1.041 . . . . 95.200000000000003 108.64 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.508 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 28.3 t60 -58.64 -48.7 80.15 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.783 0.801 . . . . 66.299999999999997 110.717 -178.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.1 t -70.09 -34.29 72.97 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 120.136 -1.602 . . . . 87.230000000000004 108.656 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.406 ' CG ' ' O ' ' A' ' 74' ' ' ILE . 19.8 mmt180 -55.9 -32.13 63.46 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 107.083 -1.451 . . . . 73.269999999999996 107.083 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -69.29 -47.9 63.21 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.946 -1.131 . . . . 80.849999999999994 107.946 177.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.528 ' CD2' ' HB ' ' A' ' 62' ' ' VAL . 60.1 m-70 -56.98 -58.04 9.9 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 117.078 -1.849 . . . . 46.009999999999998 107.9 178.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 49.5 m -49.12 -52.27 27.11 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.102 -1.073 . . . . 89.5 108.102 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 109.392 -1.483 . . . . 8.6500000000000004 109.392 179.928 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.574 ' N ' ' CD1' ' A' ' 2' ' ' PHE . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 107.51 -1.293 . . . . 1.52 107.51 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.573 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 0.5 OUTLIER -110.63 132.99 53.71 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 122.532 1.158 . . . . 1.6699999999999999 110.95 -178.755 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.29 129.82 41.88 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 113.886 -1.506 . . . . 0.92000000000000004 111.037 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -103.64 30.6 4.93 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.276 -0.89 . . . . 2.9399999999999999 109.315 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.481 HG21 HD13 ' A' ' 6' ' ' ILE . 29.0 mt -121.45 -29.59 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 119.754 -0.778 . . . . 1.51 111.0 -178.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.5 p -142.07 -27.75 0.63 Allowed 'General case' 0 C--N 1.298 -1.667 0 C-N-CA 118.995 -1.082 . . . . 1.51 109.784 -179.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 112.06 61.58 0.46 Allowed Glycine 0 N--CA 1.498 2.792 0 C-N-CA 119.489 -1.338 . . . . 1.4299999999999999 114.1 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.413 ' HZ1' ' HG2' ' A' ' 9' ' ' LYS . 52.0 tttm -142.83 150.95 40.6 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.543 -1.563 . . . . 1.8799999999999999 107.817 175.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.6 p -109.86 158.8 17.8 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.731 -1.231 . . . . 1.26 111.911 -176.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.629 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 63.1 m-85 -136.68 128.17 28.55 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 115.275 -0.875 . . . . 0.69999999999999996 111.335 -178.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -69.99 -21.1 63.26 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 115.447 -0.797 . . . . 3.04 108.96 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.82 140.82 51.8 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 122.123 0.964 . . . . 2.4900000000000002 109.976 -177.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.5 t -59.49 -33.36 71.24 Favored 'General case' 0 C--N 1.289 -2.029 0 O-C-N 120.48 -1.388 . . . . 1.4299999999999999 107.411 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.695 ' HG ' ' H ' ' A' ' 16' ' ' THR . 66.1 p -61.55 -52.0 66.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 119.94 -0.704 . . . . 1.5700000000000001 109.462 -178.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.695 ' H ' ' HG ' ' A' ' 15' ' ' SER . 0.0 OUTLIER -58.2 -36.02 72.5 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.184 -1.043 . . . . 1.51 108.184 -179.865 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.8 tp -69.62 -40.51 76.55 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 107.128 -1.434 . . . . 0.75 107.128 177.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.656 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.5 t -53.12 -50.25 64.88 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.283 -0.886 . . . . 0.93999999999999995 109.389 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 74.9 m -65.09 -38.26 90.17 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.948 -1.095 . . . . 1.6299999999999999 108.816 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.629 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 43.8 t60 -61.27 -41.95 97.8 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.218 -1.03 . . . . 0.89000000000000001 108.218 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 54.2 mt -62.51 -35.34 79.08 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 106.969 -1.493 . . . . 0.92000000000000004 106.969 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.656 ' HG ' ' O ' ' A' ' 18' ' ' SER . 31.9 mt -65.5 -30.05 70.77 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.643 -1.243 . . . . 1.1699999999999999 107.643 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 67.8 mt -59.87 -40.11 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 O-C-N 120.102 -1.624 . . . . 1.49 106.64 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.407 ' CG ' HG21 ' A' ' 6' ' ' ILE . 77.7 m-70 -72.76 -60.88 2.02 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 118.432 -1.307 . . . . 1.4199999999999999 109.44 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.424 ' O ' ' C ' ' A' ' 26' ' ' ASP . 20.2 m -62.11 -5.7 2.45 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.835 -1.165 . . . . 2.0800000000000001 112.148 -178.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 25' ' ' SER . 65.3 m-20 43.73 63.18 1.66 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.844 -1.16 . . . . 1.45 109.132 -177.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.528 ' C ' HH11 ' A' ' 28' ' ' ARG . 1.8 m -99.4 111.26 23.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.424 -0.797 . . . . 1.45 109.294 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.528 HH11 ' C ' ' A' ' 27' ' ' THR . 1.7 mpt_? -125.45 79.22 67.25 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.47 -0.769 . . . . 1.3700000000000001 110.225 -179.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -78.54 9.08 3.33 Favored 'Trans proline' 0 C--N 1.313 -1.314 0 C-N-CA 122.682 2.255 . . . . 1.2 112.437 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.505 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 60.0 m-85 -117.92 84.94 21.98 Favored Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 121.303 -0.873 . . . . 1.3400000000000001 109.435 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -83.43 143.03 10.85 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.321 2.014 . . . . 1.0700000000000001 112.943 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.478 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -67.15 149.72 50.11 Favored 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 119.298 -0.961 . . . . 0.51000000000000001 109.796 -179.307 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -87.42 -23.54 24.48 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.93 -0.708 . . . . 1.9299999999999999 111.633 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.491 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 5.2 m-85 -102.91 -69.78 0.78 Allowed 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 117.364 -1.734 . . . . 1.23 111.289 -179.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 15.3 p -81.15 -23.34 38.34 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.559 -1.338 . . . . 0.51000000000000001 111.728 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.609 ' O ' ' NH1' ' A' ' 38' ' ' ARG . . . 102.72 -4.33 50.05 Favored Glycine 0 N--CA 1.514 3.855 0 O-C-N 120.201 -1.562 . . . . 0.56000000000000005 116.441 174.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.5 ' C ' ' O ' ' A' ' 36' ' ' GLY . 36.0 mttp -47.14 156.91 0.2 Allowed 'General case' 0 N--CA 1.509 2.489 0 CA-C-N 122.39 3.095 . . . . 1.9199999999999999 108.649 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.609 ' NH1' ' O ' ' A' ' 36' ' ' GLY . 9.6 mmt-85 -111.09 123.54 50.4 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 107.465 -1.309 . . . . 2.9100000000000001 107.465 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.449 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 82.9 m-85 -113.85 164.62 13.52 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.712 -1.242 . . . . 0.68999999999999995 109.889 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.552 ' N ' ' ND1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -103.19 -6.64 21.94 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 116.243 -0.435 . . . . 1.1499999999999999 111.073 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.537 ' N ' ' HD1' ' A' ' 40' ' ' HIS . 85.1 mt-30 -133.33 119.67 20.03 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.538 -1.351 . . . . 1.21 110.201 -179.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.505 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 71.8 tttt -41.61 -61.32 1.1 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.521 -0.737 . . . . 1.24 110.895 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.4 p -53.7 -30.14 42.28 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.254 -0.904 . . . . 1.9199999999999999 111.971 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -76.67 -39.71 51.3 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 117.385 -1.726 . . . . 1.48 107.588 178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.646 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 7.6 tmm? -60.81 -46.72 89.44 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 105.728 -1.953 . . . . 1.0600000000000001 105.728 176.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.511 ' O ' ' OG1' ' A' ' 49' ' ' THR . 59.8 tttp -54.2 -38.0 65.16 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.105 -1.072 . . . . 3.0800000000000001 108.105 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.467 ' O ' HG21 ' A' ' 51' ' ' ILE . 47.5 mtpt -66.47 -32.65 74.14 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 106.582 -1.636 . . . . 1.8 106.582 177.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.674 ' O ' HG12 ' A' ' 51' ' ' ILE . 71.0 t60 -64.74 -60.12 3.47 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 107.016 -1.476 . . . . 0.47999999999999998 107.016 176.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.511 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 54.2 p -47.46 -36.67 10.39 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 120.944 -1.098 . . . . 0.84999999999999998 111.154 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.66 ' HA ' ' HG1' ' A' ' 53' ' ' THR . 3.2 m-85 -69.3 -31.77 70.46 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.633 -1.292 . . . . 0.87 109.666 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 48' ' ' HIS . 3.0 pt -65.21 -32.49 58.49 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.236 0 C-N-CA 118.423 -1.311 . . . . 0.76000000000000001 108.159 177.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.427 ' CE1' ' HB2' ' A' ' 34' ' ' TYR 0.251 60.6 m-70 -77.07 -33.88 57.08 Favored 'General case' 0 N--CA 1.537 3.879 0 O-C-N 120.492 -1.38 . . . . 0.83999999999999997 111.054 177.48 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.66 ' HG1' ' HA ' ' A' ' 50' ' ' PHE . 73.9 p -79.66 -16.68 55.31 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 106.17 -1.789 . . . . 1.3100000000000001 106.17 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 67.58 68.98 1.48 Allowed Glycine 0 C--O 1.203 -1.831 0 N-CA-C 104.396 -3.481 . . . . 1.0900000000000001 104.396 -174.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.443 ' OE1' ' CD1' ' A' ' 50' ' ' PHE . 50.1 mt-10 -120.91 128.48 52.82 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.449 -0.945 . . . . 1.9199999999999999 108.449 -179.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.9 mmtm -133.36 79.03 61.9 Favored Pre-proline 0 C--N 1.297 -1.702 0 C-N-CA 119.938 -0.705 . . . . 1.8400000000000001 109.335 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.87 0.9 5.05 Favored 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 122.158 1.905 . . . . 0.82999999999999996 112.801 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.501 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 97.1 m-70 -112.85 89.86 3.19 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.101 -1.0 . . . . 0.81000000000000005 108.851 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.434 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 62.3 mttp -94.5 133.43 38.12 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.092 -1.005 . . . . 2.2799999999999998 112.268 -177.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.35 117.81 21.44 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 106.821 -1.548 . . . . 0.39000000000000001 106.821 176.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.434 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 22.0 mm-40 -84.19 12.64 6.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.56 -0.713 . . . . 2.8599999999999999 109.221 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.7 t -98.03 -65.67 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.888 0 C-N-CA 120.044 -0.662 . . . . 0.95999999999999996 111.088 -179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.2 p -107.26 -7.62 16.68 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.504 -0.878 . . . . 0.58999999999999997 113.179 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 111.25 -11.78 28.76 Favored Glycine 0 N--CA 1.515 3.963 0 C-N-CA 118.437 -1.84 . . . . 0.56999999999999995 113.884 176.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -78.58 169.11 18.77 Favored 'General case' 0 N--CA 1.509 2.515 0 CA-C-N 120.171 1.986 . . . . 1.3999999999999999 111.526 -177.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -138.42 150.67 46.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.374 -0.829 . . . . 1.1200000000000001 109.487 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.56 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 35.9 m-85 -133.31 152.38 51.92 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 122.482 1.134 . . . . 0.56999999999999995 112.794 -177.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.9 p -81.62 -29.94 33.04 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 115.055 -0.975 . . . . 2.1099999999999999 108.537 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -117.28 146.91 43.0 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 122.114 0.959 . . . . 1.7 111.604 -178.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.45 ' O ' HG13 ' A' ' 74' ' ' ILE . 6.1 m -65.96 -44.07 86.06 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 118.792 -1.163 . . . . 1.6399999999999999 107.937 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 t -49.13 -42.49 39.52 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.149 -0.969 . . . . 2.3700000000000001 109.136 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.8 m-20 -71.48 -33.71 69.53 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 117.673 -1.611 . . . . 0.84999999999999998 108.096 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.1 tp -64.62 -52.43 57.51 Favored 'General case' 0 N--CA 1.504 2.23 0 N-CA-C 106.182 -1.784 . . . . 1.1200000000000001 106.182 175.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 70' ' ' SER . 45.1 mt -52.13 -55.52 9.72 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 O-C-N 121.135 -0.978 . . . . 1.55 110.865 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.0 m -59.63 -41.52 90.63 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 119.778 -1.826 . . . . 1.23 107.725 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.56 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 42.0 t60 -62.04 -45.42 93.65 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.951 0.881 . . . . 0.41999999999999998 109.726 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 38.8 t -68.11 -32.89 73.51 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.003 -1.11 . . . . 1.04 108.003 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -61.04 -38.79 87.4 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.768 -1.197 . . . . 1.99 107.768 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -44.86 95.03 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 118.185 -1.406 . . . . 2.3799999999999999 107.331 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -57.83 -53.37 58.98 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 118.014 -1.474 . . . . 0.65000000000000002 109.273 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 56.5 p -58.85 -48.02 82.85 Favored 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 118.391 -1.323 . . . . 1.6299999999999999 108.999 -177.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.041 0 C-N-CA 118.948 -1.596 . . . . 1.8500000000000001 109.797 179.102 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 . . . . . 0 N--CA 1.502 2.142 0 CA-C-O 121.279 0.561 . . . . 1.97 109.633 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -109.18 144.91 36.64 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 122.474 1.13 . . . . 2.6000000000000001 111.579 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -84.69 127.93 34.35 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.03 -0.986 . . . . 2.3700000000000001 109.998 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.8 mttp -94.97 37.24 1.16 Allowed 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.207 -0.933 . . . . 2.6400000000000001 109.455 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.524 ' HB ' ' CD2' ' A' ' 24' ' ' HIS . 12.8 mm -131.5 -26.75 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.488 -1.382 . . . . 2.8199999999999998 112.345 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.4 p -136.78 -35.6 0.71 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.6 -1.312 . . . . 3.0299999999999998 110.233 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.04 46.08 0.39 Allowed Glycine 0 N--CA 1.509 3.504 0 O-C-N 120.553 -1.342 . . . . 3.1000000000000001 113.549 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -136.89 159.62 41.33 Favored 'General case' 0 N--CA 1.511 2.618 0 CA-C-N 119.286 1.543 . . . . 3.52 110.611 177.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.9 p -116.76 154.5 30.54 Favored 'General case' 0 N--CA 1.512 2.671 0 N-CA-C 113.913 1.079 . . . . 3.1400000000000001 113.913 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -131.81 131.75 43.15 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-O 122.144 0.973 . . . . 2.3799999999999999 111.746 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.643 ' H ' ' NH1' ' A' ' 13' ' ' ARG . 37.2 mmtm -74.61 -22.56 58.88 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 122.187 0.994 . . . . 4.2699999999999996 109.259 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.643 ' NH1' ' H ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -118.21 136.12 53.84 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 115.172 -0.922 . . . . 3.48 111.39 -177.239 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 t -65.2 -34.34 78.15 Favored 'General case' 0 C--O 1.195 -1.809 0 C-N-CA 118.379 -1.328 . . . . 1.53 108.917 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 p -59.37 -37.48 78.0 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.318 -1.489 . . . . 1.8200000000000001 109.718 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 29.8 m -73.77 -29.83 62.43 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.622 -1.298 . . . . 2.1699999999999999 107.612 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.1 tp -72.45 -50.39 26.53 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 106.239 -1.764 . . . . 1.5600000000000001 106.239 176.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.663 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 75.8 m -49.04 -61.27 2.16 Favored 'General case' 0 C--N 1.289 -2.044 0 O-C-N 120.835 -1.166 . . . . 1.8500000000000001 109.071 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 27.3 m -52.78 -36.38 58.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.039 -1.038 . . . . 1.52 109.094 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -68.16 -44.76 75.25 Favored 'General case' 0 C--N 1.294 -1.807 0 O-C-N 121.303 -0.873 . . . . 2.1800000000000002 109.17 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.0 mt -60.71 -29.25 69.23 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 105.532 -2.025 . . . . 2.0800000000000001 105.532 177.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 18' ' ' SER . 27.3 mt -71.22 -27.34 63.41 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.745 -1.205 . . . . 1.1599999999999999 107.745 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.546 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 66.8 mt -62.57 -44.4 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 120.086 -1.634 . . . . 2.1499999999999999 108.268 178.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.524 ' CD2' ' HB ' ' A' ' 6' ' ' ILE . 77.2 m-70 -69.84 -59.35 2.99 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.455 -1.298 . . . . 2.4199999999999999 108.99 177.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.4 m -58.5 -12.39 3.92 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.664 -1.272 . . . . 2.1099999999999999 110.783 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.546 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 5.0 m-20 50.19 57.94 6.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.652 -0.655 . . . . 1.5800000000000001 109.614 -178.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.8 m -90.42 105.66 17.97 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.31 -0.869 . . . . 2.9700000000000002 109.596 179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -122.74 80.56 48.78 Favored Pre-proline 0 N--CA 1.497 1.918 0 O-C-N 121.256 -0.902 . . . . 3.46 109.63 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -84.0 15.76 2.07 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 123.114 2.543 . . . . 1.71 114.361 -179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.493 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 85.8 m-85 -118.86 86.53 30.98 Favored Pre-proline 0 N--CA 1.501 2.114 0 O-C-N 120.963 -1.086 . . . . 1.6599999999999999 108.476 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -82.93 128.85 5.24 Favored 'Trans proline' 0 C--N 1.31 -1.469 0 C-N-CA 122.739 2.293 . . . . 1.3100000000000001 112.844 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.586 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 0.4 OUTLIER -47.94 142.6 4.84 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 122.426 1.108 . . . . 1.0 109.722 178.879 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.439 ' CD ' ' N ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.9 -11.83 57.87 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.549 -0.751 . . . . 2.2999999999999998 109.925 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.572 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 22.9 m-85 -118.13 -73.88 0.63 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.429 -1.42 . . . . 1.3300000000000001 111.168 -179.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.575 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 14.2 p -84.02 19.48 1.76 Allowed 'General case' 0 N--CA 1.515 2.813 0 CA-C-O 121.889 0.852 . . . . 1.04 110.242 -179.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.482 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 42.87 10.42 0.01 OUTLIER Glycine 0 N--CA 1.503 3.123 0 CA-C-N 114.095 -1.411 . . . . 1.1699999999999999 114.407 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.586 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 69.6 tttt -52.42 172.84 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 121.977 2.888 . . . . 2.6899999999999999 105.698 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.5 mtp85 -131.03 142.1 50.28 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 119.427 -2.046 . . . . 2.7400000000000002 110.683 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.489 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 60.0 m-85 -126.6 167.47 15.62 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.748 -0.834 . . . . 1.1599999999999999 108.748 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.623 ' O ' ' ND1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -100.59 -24.2 14.5 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.859 -0.526 . . . . 1.95 111.239 -178.764 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.456 ' O ' ' C ' ' A' ' 42' ' ' LYS . 46.8 mt-30 -118.02 116.8 27.62 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.277 -1.515 . . . . 2.3700000000000001 111.607 -178.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.658 ' HZ3' ' NZ ' ' A' ' 46' ' ' LYS . 62.6 tttm -34.02 -66.2 0.17 Allowed 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.058 -1.026 . . . . 2.79 112.32 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 93.4 p -48.62 -31.2 6.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.971 -1.081 . . . . 1.7 110.366 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.449 ' N ' ' O ' ' A' ' 41' ' ' GLN . 96.7 m-20 -70.09 -44.07 69.81 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.66 -1.275 . . . . 1.3100000000000001 107.652 177.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.549 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 18.9 ttp -64.98 -46.16 82.63 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 120.696 -1.252 . . . . 1.6299999999999999 107.976 177.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.658 ' NZ ' ' HZ3' ' A' ' 42' ' ' LYS . 5.3 tppt? -53.31 -37.96 62.72 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.367 -1.346 . . . . 2.9199999999999999 107.367 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.569 ' O ' HG22 ' A' ' 51' ' ' ILE . 9.4 mtpt -64.25 -33.18 75.23 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 106.25 -1.759 . . . . 3.2200000000000002 106.25 177.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.694 ' O ' HG12 ' A' ' 51' ' ' ILE . 58.7 t60 -69.06 -62.61 1.31 Allowed 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 107.702 -1.221 . . . . 0.90000000000000002 107.702 177.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.431 ' C ' ' O ' ' A' ' 48' ' ' HIS . 75.8 p -43.61 -36.05 1.98 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 120.639 -1.288 . . . . 1.3899999999999999 110.329 178.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.619 ' CZ ' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-30 -68.59 -32.45 72.36 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 108.416 -0.957 . . . . 1.21 108.416 179.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.694 HG12 ' O ' ' A' ' 48' ' ' HIS . 7.1 pt -64.6 -31.81 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 C-N-CA 118.058 -1.457 . . . . 0.93999999999999995 108.846 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 -77.74 -33.47 52.91 Favored 'General case' 0 N--CA 1.521 3.079 0 O-C-N 120.729 -1.232 . . . . 0.84999999999999998 110.404 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.5 p -87.54 -6.98 58.1 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.92 0.867 . . . . 1.47 109.66 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 52.71 69.84 1.08 Allowed Glycine 0 C--N 1.292 -1.881 0 N-CA-C 106.139 -2.784 . . . . 0.66000000000000003 106.139 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.619 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 33.0 mt-10 -115.24 130.1 56.82 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 105.319 -2.104 . . . . 1.97 105.319 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.7 mttm -138.74 80.98 23.99 Favored Pre-proline 0 C--N 1.304 -1.373 0 O-C-N 120.911 -1.118 . . . . 2.8100000000000001 110.467 -177.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -73.31 13.7 0.66 Allowed 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.863 2.375 . . . . 0.92000000000000004 112.615 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -116.2 83.44 1.95 Allowed 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.045 -1.035 . . . . 1.3899999999999999 110.064 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -87.18 138.41 31.51 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.122 -0.986 . . . . 2.2200000000000002 111.434 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.572 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -99.27 120.05 38.92 Favored 'General case' 0 C--N 1.289 -2.053 0 N-CA-C 107.383 -1.34 . . . . 1.03 107.383 177.537 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -85.36 16.46 3.69 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 108.619 -0.882 . . . . 2.73 108.619 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.572 ' HB ' ' SG ' ' A' ' 60' ' ' CYS . 20.1 t -95.25 -57.16 4.58 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.746 0 CA-C-O 121.622 0.725 . . . . 1.6200000000000001 109.151 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.8 p -115.16 -7.65 12.42 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.495 -0.753 . . . . 0.97999999999999998 111.775 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.4 -3.42 56.51 Favored Glycine 0 N--CA 1.509 3.503 0 O-C-N 120.143 -1.598 . . . . 0.71999999999999997 112.779 177.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.7 tttp -84.26 153.44 23.57 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.266 -1.726 . . . . 2.8100000000000001 111.885 -177.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -121.03 145.09 48.14 Favored 'General case' 0 N--CA 1.514 2.768 0 O-C-N 121.753 -0.592 . . . . 1.29 110.935 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.434 ' HZ ' ' CE1' ' A' ' 76' ' ' HIS . 31.3 m-85 -128.05 161.85 28.22 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 122.128 0.966 . . . . 1.8899999999999999 112.689 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.9 t -84.86 -35.7 22.05 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 115.536 -0.756 . . . . 2.0299999999999998 110.239 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -113.87 141.69 47.02 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 120.929 -1.107 . . . . 2.8500000000000001 110.746 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.5 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.4 OUTLIER -63.04 -46.23 88.53 Favored 'General case' 0 C--O 1.202 -1.414 0 N-CA-C 108.03 -1.1 . . . . 2.9399999999999999 108.03 178.219 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.457 ' C ' ' O ' ' A' ' 70' ' ' SER . 91.9 p -44.16 -39.59 4.43 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.023 -1.048 . . . . 2.8799999999999999 108.695 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -76.29 -32.97 59.07 Favored 'General case' 0 C--N 1.293 -1.856 0 C-N-CA 118.783 -1.167 . . . . 2.4199999999999999 108.721 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.5 ' N ' ' O ' ' A' ' 70' ' ' SER . 26.4 tp -70.33 -53.36 17.02 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 106.491 -1.67 . . . . 2.0299999999999998 106.491 175.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.506 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 86.9 mt -46.97 -54.58 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 O-C-N 121.029 -1.045 . . . . 3.1699999999999999 109.065 177.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.512 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 21.1 m -60.06 -46.64 88.89 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-O 122.539 1.161 . . . . 3.5499999999999998 108.97 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.434 ' CE1' ' HZ ' ' A' ' 67' ' ' PHE . 26.4 t60 -56.02 -48.07 76.62 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.655 -0.702 . . . . 2.3500000000000001 109.613 -179.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -33.02 73.56 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 119.932 -1.73 . . . . 2.4399999999999999 107.621 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.512 ' HB2' ' O ' ' A' ' 75' ' ' THR . 35.0 mtp85 -54.34 -31.32 54.1 Favored 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 105.985 -1.857 . . . . 5.4500000000000002 105.985 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -73.46 -49.89 24.48 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.223 -0.991 . . . . 3.5499999999999998 108.765 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 61.5 m-70 -56.23 -61.67 2.23 Favored 'General case' 0 N--CA 1.501 2.08 0 C-N-CA 116.841 -1.943 . . . . 2.4700000000000002 108.785 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 31.7 m -57.57 -53.1 61.99 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.264 -1.013 . . . . 3.48 108.264 -179.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.514 0 N-CA-C 109.363 -1.495 . . . . 3.75 109.363 179.862 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.538 ' CE1' ' N ' ' A' ' 14' ' ' SER . 0.9 OUTLIER . . . . . 0 N--CA 1.499 2.01 0 N-CA-C 108.517 -0.92 . . . . 2.25 108.517 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -107.53 135.61 48.7 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 122.539 1.161 . . . . 2.25 112.33 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.676 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 4.1 t -60.5 121.35 11.91 Favored 'General case' 0 N--CA 1.499 2.021 0 CA-C-N 114.625 -1.171 . . . . 1.74 109.432 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.7 mttp -94.8 28.5 2.67 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.204 -0.935 . . . . 2.7799999999999998 108.828 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.3 mm -128.86 -63.38 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 N-CA-C 107.538 -1.282 . . . . 2.4700000000000002 107.538 -178.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.636 ' N ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -126.4 45.98 2.55 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 124.015 1.864 . . . . 2.54 110.0 179.29 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 20.45 60.73 0.01 OUTLIER Glycine 0 CA--C 1.568 3.403 0 N-CA-C 121.525 3.37 . . . . 2.5600000000000001 121.525 172.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.676 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 9.9 ttmm -115.07 139.89 49.5 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 105.663 -1.977 . . . . 2.79 105.663 171.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.3 t -93.52 145.05 24.8 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-O 122.438 1.113 . . . . 2.9500000000000002 112.715 -177.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.49 ' HZ ' ' ND1' ' A' ' 20' ' ' HIS . 77.3 m-85 -127.16 130.27 49.46 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.912 0.863 . . . . 2.1400000000000001 110.204 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -68.92 -27.93 66.21 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.948 -0.76 . . . . 3.8399999999999999 108.948 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 13' ' ' ARG . 0.4 OUTLIER -121.65 140.51 52.18 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 121.699 0.762 . . . . 3.7799999999999998 109.624 -178.928 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.538 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 0.6 OUTLIER -60.2 -32.73 71.37 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 118.042 -1.463 . . . . 2.1800000000000002 108.088 179.202 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.506 ' HG ' ' H ' ' A' ' 16' ' ' THR . 97.5 p -55.7 -60.95 2.72 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.192 -0.942 . . . . 2.73 109.069 -178.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.506 ' H ' ' HG ' ' A' ' 15' ' ' SER . 23.0 m -53.36 -32.12 47.82 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.517 -0.92 . . . . 2.7200000000000002 108.517 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 tp -72.08 -39.72 68.76 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 118.077 -1.449 . . . . 1.52 107.657 177.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.709 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 58.6 m -53.01 -50.86 63.36 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.965 -1.084 . . . . 1.7 108.479 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.3 m -59.57 -36.63 76.58 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.975 0.893 . . . . 2.6800000000000002 108.876 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.49 ' ND1' ' HZ ' ' A' ' 11' ' ' PHE . 23.4 t60 -69.01 -38.38 79.2 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 107.552 -1.277 . . . . 1.1499999999999999 107.552 179.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.423 ' O ' ' N ' ' A' ' 24' ' ' HIS . 87.3 mt -67.41 -38.4 84.54 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 119.853 -1.78 . . . . 1.51 106.397 177.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.709 ' HG ' ' O ' ' A' ' 18' ' ' SER . 28.9 mt -56.17 -35.35 67.12 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 105.953 -1.869 . . . . 2.3599999999999999 105.953 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.464 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 82.3 mt -61.07 -31.41 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 N-CA-C 107.256 -1.387 . . . . 1.1799999999999999 107.256 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.423 ' N ' ' O ' ' A' ' 21' ' ' LEU . 87.8 m-70 -88.4 -19.51 26.49 Favored 'General case' 0 N--CA 1.514 2.774 0 C-N-CA 118.472 -1.291 . . . . 2.0699999999999998 111.231 179.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.417 ' O ' ' C ' ' A' ' 26' ' ' ASP . 61.1 m -101.16 3.76 41.41 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 107.441 -1.318 . . . . 2.8100000000000001 107.441 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.576 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.1 OUTLIER 41.03 53.97 3.31 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.875 -0.787 . . . . 1.96 108.875 -179.218 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.426 ' O ' ' HD3' ' A' ' 28' ' ' ARG . 1.3 m -97.3 110.74 23.23 Favored 'General case' 0 N--CA 1.485 1.285 0 O-C-N 121.528 -0.732 . . . . 2.77 109.393 -179.123 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.426 ' HD3' ' O ' ' A' ' 27' ' ' THR . 19.2 mmt180 -129.51 63.33 67.47 Favored Pre-proline 0 N--CA 1.49 1.538 0 N-CA-C 107.996 -1.113 . . . . 3.1400000000000001 107.996 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -72.56 17.63 0.36 Allowed 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 121.803 1.669 . . . . 1.55 113.973 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -113.72 80.85 5.28 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 120.876 -1.14 . . . . 1.3500000000000001 108.991 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.34 131.54 8.66 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 C-N-CA 122.109 1.873 . . . . 2.2799999999999998 113.888 -178.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.429 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -58.94 149.29 27.58 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 121.696 0.76 . . . . 2.29 109.868 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -82.34 -15.44 52.85 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.77 -0.581 . . . . 4.2800000000000002 112.45 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.545 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 3.9 m-85 -113.95 -50.67 2.81 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.224 -1.548 . . . . 2.8799999999999999 113.37 -178.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 16.1 p -103.72 7.09 37.25 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.487 -1.383 . . . . 3.0299999999999998 111.16 -177.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.542 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 73.85 -1.6 45.7 Favored Glycine 0 N--CA 1.492 2.427 0 O-C-N 121.29 -0.881 . . . . 2.8700000000000001 114.312 176.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.542 ' O ' ' O ' ' A' ' 36' ' ' GLY . 11.8 mttp -41.89 166.0 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.212 0 CA-C-N 120.679 2.24 . . . . 3.4199999999999999 108.85 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.404 ' HE ' ' N ' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -128.81 133.13 47.93 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.401 -0.963 . . . . 3.7799999999999998 108.401 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -126.71 174.34 8.81 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.34 -0.85 . . . . 1.6100000000000001 109.255 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.573 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -115.36 -7.26 12.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 122.0 -0.437 . . . . 2.0699999999999998 110.505 -179.383 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.416 ' O ' ' C ' ' A' ' 42' ' ' LYS . 85.0 mt-30 -132.13 124.0 28.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.694 -1.254 . . . . 2.6200000000000001 109.358 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.416 ' C ' ' O ' ' A' ' 41' ' ' GLN . 84.6 tttt -42.05 -65.15 0.49 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.129 -0.982 . . . . 2.5299999999999998 110.257 -178.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.8 p -49.2 -32.98 11.39 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.733 -0.604 . . . . 1.3400000000000001 111.101 -178.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.2 -48.63 70.01 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.752 -1.217 . . . . 1.8999999999999999 107.744 177.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.533 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 10.8 tmm? -62.84 -46.84 86.05 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.472 -1.392 . . . . 1.5700000000000001 108.617 177.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.499 ' O ' ' OG1' ' A' ' 49' ' ' THR . 35.1 mmtt -53.34 -41.21 65.53 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 120.87 -1.144 . . . . 2.4700000000000002 108.711 -178.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -63.51 -32.82 74.38 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.168 -1.419 . . . . 2.0 107.168 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.691 ' O ' HG12 ' A' ' 51' ' ' ILE . 47.0 t60 -68.66 -61.25 1.9 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.896 -1.52 . . . . 2.0099999999999998 106.896 176.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.507 ' O ' HG21 ' A' ' 53' ' ' THR . 24.1 p -41.9 -34.77 0.72 Allowed 'General case' 0 N--CA 1.486 1.35 0 O-C-N 120.323 -1.485 . . . . 1.26 109.281 178.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.586 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 5.2 m-30 -69.26 -32.27 71.35 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.806 -1.184 . . . . 0.97999999999999998 108.918 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.691 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.0 pt -61.85 -34.16 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 C-N-CA 118.318 -1.353 . . . . 2.1099999999999999 107.72 175.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -75.07 -27.72 60.06 Favored 'General case' 0 N--CA 1.51 2.548 0 C-N-CA 117.775 -1.57 . . . . 2.4199999999999999 109.309 176.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.586 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 68.1 p -91.53 -2.06 57.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.16 -0.962 . . . . 1.9399999999999999 110.279 -177.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.36 17.89 2.07 Favored Glycine 0 N--CA 1.502 3.038 0 N-CA-C 109.944 -1.262 . . . . 1.2 109.944 -177.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.611 ' O ' ' C ' ' A' ' 56' ' ' LYS . 77.4 mt-10 -75.74 20.27 0.18 Allowed 'General case' 0 N--CA 1.506 2.339 0 N-CA-C 115.836 1.791 . . . . 1.27 115.836 -176.092 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.611 ' C ' ' O ' ' A' ' 55' ' ' GLU . 3.0 mptp? -24.57 96.81 0.06 OUTLIER Pre-proline 0 N--CA 1.508 2.457 0 O-C-N 121.058 -1.026 . . . . 1.77 110.867 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.448 ' N ' ' O ' ' A' ' 55' ' ' GLU . 2.4 Cg_endo -78.86 -19.84 10.75 Favored 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 122.971 2.447 . . . . 0.81999999999999995 112.431 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -81.65 102.65 10.82 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.908 -1.145 . . . . 0.83999999999999997 107.908 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.672 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 86.5 mttt -104.55 118.02 35.55 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.915 -1.115 . . . . 1.54 111.595 -177.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 26.8 t -83.71 125.37 31.81 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.229 -0.919 . . . . 1.1100000000000001 108.739 178.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.672 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 1.1 mm-40 -96.92 13.82 27.52 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.212 -0.93 . . . . 2.5499999999999998 111.26 -177.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.467 ' HB ' ' CD2' ' A' ' 80' ' ' HIS . 97.1 t -87.13 -34.88 7.85 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.086 0 N-CA-C 106.338 -1.727 . . . . 1.8100000000000001 106.338 178.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 26.6 p -123.58 -30.13 3.66 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 114.846 -1.07 . . . . 1.5900000000000001 108.261 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.02 13.51 31.33 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 111.16 -0.776 . . . . 1.26 111.16 178.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -97.33 132.77 42.75 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.283 -1.716 . . . . 2.6000000000000001 111.206 -177.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.19 148.24 23.07 Favored 'General case' 0 N--CA 1.508 2.456 0 CA-C-O 122.227 1.013 . . . . 1.24 113.685 -177.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.442 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 88.5 m-85 -128.92 151.13 49.98 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.992 0.901 . . . . 0.84999999999999998 111.534 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.421 ' OG ' ' HG3' ' A' ' 69' ' ' GLN . 16.9 p -86.63 -10.35 54.04 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 115.798 -0.637 . . . . 1.3400000000000001 109.768 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.421 ' HG3' ' OG ' ' A' ' 68' ' ' SER . 56.5 mt-30 -132.31 142.97 49.56 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.249 -0.907 . . . . 1.75 111.146 -177.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.664 ' HG ' ' N ' ' A' ' 71' ' ' SER . 51.7 p -66.51 -44.48 82.42 Favored 'General case' 0 C--O 1.198 -1.638 0 N-CA-C 107.174 -1.417 . . . . 1.4099999999999999 107.174 177.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.664 ' N ' ' HG ' ' A' ' 70' ' ' SER . 23.2 t -52.41 -42.59 64.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.231 -0.918 . . . . 1.8899999999999999 109.915 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.415 ' O ' ' HB3' ' A' ' 76' ' ' HIS . 2.9 m-20 -70.16 -30.29 67.4 Favored 'General case' 0 C--N 1.298 -1.674 0 C-N-CA 118.084 -1.446 . . . . 1.3500000000000001 107.913 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.9 tp -73.49 -42.1 62.27 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.941 -1.133 . . . . 0.89000000000000001 107.941 177.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 90.7 mt -59.67 -53.63 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 O-C-N 120.826 -1.171 . . . . 1.76 109.111 179.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 2.5 m -63.97 -48.98 74.33 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 122.374 1.083 . . . . 1.3999999999999999 108.746 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.442 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 15.8 t60 -51.65 -45.47 63.38 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 123.079 1.418 . . . . 1.0600000000000001 107.852 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 44.8 t -67.23 -35.61 79.93 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 120.581 -1.324 . . . . 1.8300000000000001 108.288 178.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 82' ' ' GLY . 2.2 mmm180 -55.81 -35.14 66.0 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 106.986 -1.487 . . . . 2.7999999999999998 106.986 178.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -63.98 -44.37 92.9 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.193 -1.403 . . . . 1.7 108.061 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.467 ' CD2' ' HB ' ' A' ' 62' ' ' VAL . 68.5 m-70 -57.44 -62.61 1.65 Allowed 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 116.139 -2.225 . . . . 1.52 108.304 178.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.446 ' O ' ' C ' ' A' ' 82' ' ' GLY . 29.4 p -80.19 21.48 0.59 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.516 -0.74 . . . . 1.6799999999999999 109.509 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.494 2.548 0 N-CA-C 109.796 -1.321 . . . . 2.6000000000000001 109.796 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.408 ' CE2' ' N ' ' A' ' 14' ' ' SER . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 CA-C-O 121.47 0.652 . . . . 1.3700000000000001 109.569 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.505 ' OD2' ' N ' ' A' ' 5' ' ' LYS . 8.5 t70 -108.61 142.99 38.26 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 121.998 0.904 . . . . 2.3700000000000001 110.269 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER -66.67 -36.48 82.63 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.142 -0.688 . . . . 2.2000000000000002 109.142 179.212 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.524 ' HB2' ' O ' ' A' ' 4' ' ' CYS . 73.6 mttt 75.06 -23.81 0.23 Allowed 'General case' 0 N--CA 1.498 1.956 0 CA-C-O 121.037 0.446 . . . . 2.8100000000000001 110.159 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.573 ' HB ' ' CD2' ' A' ' 24' ' ' HIS . 12.7 mm -67.84 -66.95 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 O-C-N 120.932 -1.105 . . . . 2.96 109.746 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.9 p -94.31 -24.5 17.39 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.275 -0.89 . . . . 3.1400000000000001 109.95 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.94 38.51 1.69 Allowed Glycine 0 N--CA 1.496 2.695 0 C-N-CA 120.081 -1.057 . . . . 2.9300000000000002 112.404 177.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.413 ' O ' ' OD1' ' A' ' 3' ' ' ASP . 19.0 ttmm -115.08 154.37 29.02 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.482 -1.599 . . . . 3.48 108.49 178.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.54 ' C ' ' CD1' ' A' ' 11' ' ' PHE . 44.8 m -112.04 163.7 13.98 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 122.112 0.958 . . . . 2.0699999999999998 111.985 -177.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.636 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.2 m-85 -141.46 124.71 16.47 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 122.226 1.012 . . . . 1.4399999999999999 110.738 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -68.67 -30.56 69.26 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 122.175 0.988 . . . . 2.4900000000000002 109.158 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.95 132.79 56.37 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-N 115.646 -0.707 . . . . 3.0800000000000001 109.296 -178.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.408 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 7.2 t -59.21 -30.41 68.21 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 118.741 -1.184 . . . . 1.8899999999999999 109.903 -178.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.3 t -63.37 -47.53 81.71 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 120.278 -1.514 . . . . 2.6400000000000001 109.365 -179.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.9 m -61.81 -30.73 71.01 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.312 -1.366 . . . . 1.6200000000000001 107.312 179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.481 ' HB2' ' HB2' ' A' ' 11' ' ' PHE . 11.5 tp -74.2 -35.84 63.95 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 107.022 -1.473 . . . . 1.4299999999999999 107.022 177.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.576 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 32.7 t -56.42 -58.9 6.04 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.718 -1.239 . . . . 1.6899999999999999 108.223 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.496 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 55.1 m -55.87 -38.77 70.57 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.726 0.774 . . . . 1.9399999999999999 109.83 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.636 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 45.3 t60 -66.65 -44.37 82.07 Favored 'General case' 0 C--N 1.294 -1.843 0 O-C-N 120.742 -1.224 . . . . 1.9299999999999999 108.247 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.7 mt -61.46 -29.75 70.16 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 106.363 -1.717 . . . . 2.02 106.363 178.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 18' ' ' SER . 21.9 mt -66.16 -29.9 70.27 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 106.621 -1.622 . . . . 1.0900000000000001 106.621 177.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.432 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 88.4 mt -65.33 -36.58 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 O-C-N 120.577 -1.327 . . . . 2.4199999999999999 108.304 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.573 ' CD2' ' HB ' ' A' ' 6' ' ' ILE . 72.1 m-70 -82.06 -28.99 32.11 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 118.149 -1.42 . . . . 2.3799999999999999 110.563 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.453 ' OG ' ' OG1' ' A' ' 27' ' ' THR . 35.0 p -92.42 -1.82 56.74 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.681 -1.262 . . . . 1.3600000000000001 108.22 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 48.4 m-20 44.5 65.35 1.08 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 115.95 -0.568 . . . . 1.04 110.134 -179.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.453 ' OG1' ' OG ' ' A' ' 25' ' ' SER . 0.6 OUTLIER -104.65 112.2 25.2 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.425 -0.954 . . . . 1.3 108.425 179.262 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.572 HH21 ' CG ' ' A' ' 40' ' ' HIS . 0.4 OUTLIER -124.16 72.7 56.53 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.311 -0.868 . . . . 2.9100000000000001 108.81 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -74.43 9.77 1.74 Allowed 'Trans proline' 0 C--N 1.312 -1.38 0 C-N-CA 122.037 1.825 . . . . 1.6599999999999999 113.514 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -114.49 81.73 7.11 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.005 -1.06 . . . . 2.1299999999999999 108.656 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -75.93 137.98 20.33 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.253 1.968 . . . . 1.99 113.037 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.57 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -64.79 137.27 57.68 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 107.893 -1.151 . . . . 1.9099999999999999 107.893 179.223 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.464 ' CD ' ' N ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -78.1 -15.04 59.23 Favored 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.497 -0.752 . . . . 2.7799999999999998 110.663 -178.834 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.449 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 40.4 m-85 -110.97 -72.88 0.7 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.613 -1.304 . . . . 2.4900000000000002 111.747 -178.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.554 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.9 p -85.16 2.04 45.38 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.071 -1.018 . . . . 2.6899999999999999 111.472 -178.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.445 ' C ' ' HB3' ' A' ' 32' ' ' CYS . . . 80.84 -12.49 35.47 Favored Glycine 0 N--CA 1.504 3.19 0 O-C-N 120.94 -1.1 . . . . 2.5 114.289 175.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.57 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 1.8 mttm -47.58 119.39 2.71 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 119.561 1.68 . . . . 3.0299999999999998 109.247 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -98.77 135.69 39.87 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.945 -1.097 . . . . 3.0299999999999998 110.976 -178.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.516 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 28.2 m-85 -115.23 174.47 5.98 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.416 -0.803 . . . . 1.3400000000000001 110.147 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.892 ' H ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -107.05 -19.68 13.54 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 116.306 -0.407 . . . . 1.95 110.751 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.53 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 48.8 mt-30 -114.46 110.48 19.91 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 120.718 -1.239 . . . . 2.8300000000000001 110.032 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.491 ' C ' ' O ' ' A' ' 41' ' ' GLN . 44.6 tttp -34.33 -57.11 0.5 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.232 -0.917 . . . . 3.3300000000000001 110.892 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.06 -33.79 63.03 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.408 -0.808 . . . . 2.8199999999999998 111.073 -178.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.734 ' OD1' ' N ' ' A' ' 45' ' ' MET . 35.2 p30 -71.18 -37.5 72.15 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.181 -1.408 . . . . 2.2000000000000002 108.072 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.734 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 9.9 ttp -67.71 -47.42 69.43 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 120.319 -1.488 . . . . 2.1200000000000001 108.061 177.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.499 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 36.6 mttm -50.2 -41.23 49.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.636 -1.29 . . . . 3.3500000000000001 107.565 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -60.85 -35.06 75.6 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 106.709 -1.589 . . . . 3.8799999999999999 106.709 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.698 ' O ' HG12 ' A' ' 51' ' ' ILE . 61.5 t60 -67.37 -67.64 0.44 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.494 -1.298 . . . . 1.6799999999999999 107.494 177.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.499 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 32.0 p -40.75 -33.02 0.25 Allowed 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.657 -1.277 . . . . 1.1399999999999999 110.546 178.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.544 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.4 m-85 -70.96 -35.83 72.31 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 120.804 -1.185 . . . . 2.1000000000000001 109.352 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.698 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.1 pt -63.45 -29.19 46.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 C-N-CA 118.461 -1.295 . . . . 2.1099999999999999 108.508 176.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -81.0 -29.44 35.21 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 120.315 -1.491 . . . . 1.98 109.92 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.544 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 75.0 p -91.29 2.29 56.49 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.237 -0.914 . . . . 1.3799999999999999 112.181 -176.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 58.73 56.08 27.26 Favored Glycine 0 N--CA 1.486 2.033 0 N-CA-C 107.706 -2.157 . . . . 1.1799999999999999 107.706 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.484 ' CD ' ' HG1' ' A' ' 53' ' ' THR . 62.0 mt-10 -114.12 128.58 56.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.456 -1.026 . . . . 2.0099999999999998 109.943 -178.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 68' ' ' SER . 38.1 mttm -143.29 67.27 16.72 Favored Pre-proline 0 C--N 1.304 -1.372 0 N-CA-C 108.754 -0.832 . . . . 2.21 108.754 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.48 -11.71 14.75 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 122.29 1.993 . . . . 1.6899999999999999 112.532 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.533 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 94.5 m-70 -101.19 90.61 4.19 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.996 -1.113 . . . . 1.71 107.996 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 26.3 mtpt -91.99 125.82 36.83 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 121.799 0.809 . . . . 2.7400000000000002 110.778 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.661 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 1.7 t -43.48 -91.52 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.837 -0.539 . . . . 1.3799999999999999 110.718 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.661 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 6.6 mm-40 122.31 -20.9 0.01 OUTLIER 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 121.604 0.716 . . . . 2.6499999999999999 110.574 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.8 t -87.98 -43.26 15.42 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.136 0 CA-C-O 122.038 0.923 . . . . 1.8600000000000001 109.274 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 18.8 p -122.92 -6.15 8.48 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.675 -0.693 . . . . 2.2400000000000002 109.966 -178.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.49 29.58 32.52 Favored Glycine 0 N--CA 1.496 2.682 0 O-C-N 120.942 -1.099 . . . . 2.04 111.858 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 60' ' ' CYS . 6.6 tttp -101.29 157.22 16.95 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 105.558 -2.016 . . . . 2.7799999999999998 105.558 176.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -131.97 152.18 51.27 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.462 -1.399 . . . . 1.51 112.966 -176.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.597 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 60.6 m-85 -134.71 138.93 44.82 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 122.151 0.977 . . . . 1.72 112.369 -178.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.462 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 34.0 p -68.89 -26.38 65.08 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.738 -1.208 . . . . 2.0800000000000001 107.738 177.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -116.51 151.62 35.74 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 122.002 0.906 . . . . 2.8300000000000001 112.851 -176.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.627 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.9 OUTLIER -78.29 -47.27 18.21 Favored 'General case' 0 C--O 1.19 -2.037 0 N-CA-C 107.57 -1.27 . . . . 2.4100000000000001 107.57 175.399 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.577 ' C ' ' O ' ' A' ' 70' ' ' SER . 15.7 p -39.75 -41.4 1.09 Allowed 'General case' 0 C--N 1.301 -1.519 0 O-C-N 120.441 -1.412 . . . . 2.3900000000000001 107.782 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -79.79 -31.99 40.82 Favored 'General case' 0 C--N 1.291 -1.94 0 C-N-CA 119.65 -0.82 . . . . 2.4500000000000002 108.916 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.627 ' N ' ' O ' ' A' ' 70' ' ' SER . 30.7 tp -72.76 -40.78 65.73 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.601 -1.312 . . . . 1.95 108.553 177.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 97.2 mt -59.92 -52.19 64.04 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 O-C-N 120.937 -1.102 . . . . 2.3599999999999999 108.255 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.2 m -60.33 -47.32 86.56 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.866 -1.146 . . . . 2.8799999999999999 109.511 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.597 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 19.4 t60 -56.86 -39.95 75.25 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 122.419 1.104 . . . . 1.9099999999999999 108.191 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 53.4 p -71.51 -34.39 70.06 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.898 -1.127 . . . . 1.78 108.684 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -57.83 -32.67 67.83 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.428 -1.323 . . . . 3.27 107.428 178.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -69.16 -48.26 62.75 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.904 -1.147 . . . . 3.8999999999999999 107.904 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -58.39 -55.25 37.42 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 117.283 -1.767 . . . . 2.3399999999999999 109.247 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 60.6 m -56.98 -52.79 63.83 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.114 -1.034 . . . . 2.7799999999999998 108.895 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.63 -1.388 . . . . 3.71 109.63 179.55 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.31 0.576 . . . . 2.6200000000000001 109.828 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.622 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.2 m-85 -96.47 122.24 39.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.414 -0.804 . . . . 2.04 109.105 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.599 ' OD1' ' N ' ' A' ' 4' ' ' CYS . 45.5 t0 -107.25 133.38 51.9 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-O 123.013 1.387 . . . . 1.54 110.166 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.599 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 1.7 t -66.56 131.0 45.05 Favored 'General case' 0 C--N 1.288 -2.083 0 CA-C-N 113.682 -1.599 . . . . 1.01 110.327 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.33 32.11 1.82 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.409 -0.807 . . . . 3.1000000000000001 110.162 -178.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.0 mm -126.81 -71.17 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 120.871 -1.143 . . . . 1.9399999999999999 109.554 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.533 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 30.6 p -84.34 -50.67 7.61 Favored 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 119.325 -0.95 . . . . 2.0800000000000001 108.479 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.533 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 123.34 52.24 0.2 Allowed Glycine 0 N--CA 1.496 2.661 0 C-N-CA 120.83 -0.7 . . . . 1.8899999999999999 112.437 177.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -127.98 164.12 23.04 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.82 -1.4 . . . . 2.4900000000000002 109.623 178.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.4 t -112.81 159.09 19.35 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.686 1.232 . . . . 2.3300000000000001 113.198 -176.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 51.9 m-85 -139.16 125.36 20.13 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 114.968 -1.014 . . . . 1.75 109.784 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -68.29 -22.37 64.73 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 108.869 -0.789 . . . . 3.1099999999999999 108.869 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.665 HH21 ' N ' ' A' ' 15' ' ' SER . 0.0 OUTLIER -119.5 133.45 55.68 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.034 -0.728 . . . . 4.1600000000000001 109.034 -178.62 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.622 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 40.5 t -57.42 -33.36 67.81 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.004 -1.06 . . . . 2.27 108.259 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.665 ' N ' HH21 ' A' ' 13' ' ' ARG . 30.5 t -66.44 -39.41 88.88 Favored 'General case' 0 C--N 1.308 -1.213 0 O-C-N 121.626 -0.671 . . . . 2.23 110.301 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -34.35 77.89 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 106.473 -1.677 . . . . 2.2999999999999998 106.473 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.0 tp -70.6 -43.44 69.34 Favored 'General case' 0 C--O 1.202 -1.411 0 N-CA-C 106.256 -1.757 . . . . 1.3200000000000001 106.256 176.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.613 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 16.4 t -49.93 -62.62 1.46 Allowed 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.529 -1.357 . . . . 2.5099999999999998 109.451 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 88.0 m -54.19 -36.57 63.57 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 122.414 1.102 . . . . 1.78 108.757 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 49.9 t60 -65.47 -46.38 80.03 Favored 'General case' 0 C--N 1.284 -2.243 0 O-C-N 121.097 -1.002 . . . . 1.28 109.311 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 78.5 mt -60.91 -27.69 68.37 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 106.861 -1.533 . . . . 1.1599999999999999 106.861 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 18' ' ' SER . 27.4 mt -70.03 -27.35 64.59 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 107.253 -1.388 . . . . 1.47 107.253 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 95.3 mt -65.41 -39.96 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 O-C-N 120.507 -1.37 . . . . 1.45 108.111 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -73.22 -47.31 44.44 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 117.813 -1.555 . . . . 1.48 108.763 177.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.507 ' OG ' ' OG1' ' A' ' 27' ' ' THR . 25.7 p -73.89 -3.31 28.07 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 120.564 -1.335 . . . . 2.2799999999999998 110.033 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 44.4 63.51 1.63 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.575 -0.703 . . . . 1.8200000000000001 109.786 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.507 ' OG1' ' OG ' ' A' ' 25' ' ' SER . 1.3 m -101.27 111.86 24.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.968 -1.082 . . . . 1.3400000000000001 108.651 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 -126.0 71.98 69.59 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.432 -0.792 . . . . 1.79 109.989 -178.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -73.94 12.15 1.02 Allowed 'Trans proline' 0 C--N 1.308 -1.583 0 C-N-CA 121.954 1.769 . . . . 1.3400000000000001 113.789 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.407 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 61.6 m-85 -117.23 87.11 22.71 Favored Pre-proline 0 N--CA 1.501 2.108 0 N-CA-C 108.046 -1.094 . . . . 1.8899999999999999 108.046 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -84.96 131.12 4.29 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.642 2.228 . . . . 1.27 113.047 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.569 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 1.1 t -51.51 140.59 17.67 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 121.927 0.87 . . . . 0.96999999999999997 108.799 177.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.16 -17.32 52.79 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.861 -0.792 . . . . 3.7799999999999998 108.861 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.569 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 30.5 m-85 -110.58 -76.75 0.6 Allowed 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 119.101 -1.04 . . . . 1.45 112.424 -178.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.544 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 14.8 p -81.77 20.98 0.88 Allowed 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 122.406 1.098 . . . . 1.0800000000000001 110.714 -177.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.432 ' O ' ' C ' ' A' ' 37' ' ' LYS . . . 48.48 9.53 0.09 OUTLIER Glycine 0 N--CA 1.508 3.458 0 N-CA-C 115.513 0.965 . . . . 0.98999999999999999 115.513 176.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.556 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 13.1 mttp -54.35 174.95 0.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 122.503 3.152 . . . . 1.4099999999999999 107.802 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 83.8 mtm-85 -134.13 131.64 38.94 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.977 -1.077 . . . . 2.2999999999999998 109.853 -178.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -123.44 165.08 17.67 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.74 -0.837 . . . . 0.84999999999999998 108.74 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.638 ' H ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -108.96 12.76 25.13 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.772 -0.58 . . . . 1.1699999999999999 109.98 179.78 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -144.77 113.35 6.67 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.868 -1.145 . . . . 1.74 109.74 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.407 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 57.8 tttm -37.88 -72.2 0.06 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.324 -0.86 . . . . 3.3399999999999999 112.984 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 85.5 p -47.37 -34.98 7.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.367 -0.833 . . . . 1.7 111.205 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -67.92 -40.3 83.41 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 117.524 -1.67 . . . . 1.1699999999999999 107.395 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.678 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 11.1 tmm? -66.55 -47.15 73.75 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 120.711 -1.243 . . . . 1.97 107.974 176.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.508 ' O ' ' OG1' ' A' ' 49' ' ' THR . 6.0 tptp -54.07 -37.61 64.4 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.012 -1.055 . . . . 2.4199999999999999 108.531 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.506 ' CB ' ' NZ ' ' A' ' 47' ' ' LYS . 8.2 mtmp? -67.25 -29.19 68.74 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 106.14 -1.8 . . . . 2.7000000000000002 106.14 177.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.678 ' HB3' ' O ' ' A' ' 45' ' ' MET . 61.4 t60 -68.22 -66.31 0.58 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 106.776 -1.564 . . . . 0.53000000000000003 106.776 175.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 41.1 p -38.92 -33.04 0.1 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.732 -1.23 . . . . 1.1699999999999999 111.667 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.599 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.9 m-30 -75.16 -37.85 61.13 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.224 -0.658 . . . . 1.04 109.224 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 48' ' ' HIS . 14.9 pt -59.07 -24.1 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 105.017 -2.216 . . . . 0.82999999999999996 105.017 176.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.914 ' O ' ' N ' ' A' ' 54' ' ' GLY . 83.4 m-70 -80.11 -103.12 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 101.514 -3.513 . . . . 0.83999999999999997 101.514 170.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.599 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 72.7 p -8.68 -37.03 0.0 OUTLIER 'General case' 0 N--CA 1.518 2.927 0 C-N-CA 124.134 0.974 . . . . 1.3600000000000001 112.6 -175.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.914 ' N ' ' O ' ' A' ' 52' ' ' HIS . . . 98.99 21.18 16.31 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 110.591 -1.004 . . . . 0.57999999999999996 110.591 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.454 ' HB2' ' CG ' ' A' ' 50' ' ' PHE . 30.1 mt-10 -82.51 125.64 31.34 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.481 -1.011 . . . . 1.6000000000000001 112.673 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -134.71 73.92 66.09 Favored Pre-proline 0 N--CA 1.504 2.248 0 N-CA-C 108.493 -0.929 . . . . 3.0499999999999998 108.493 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -61.11 -11.13 17.37 Favored 'Trans proline' 0 N--CA 1.496 1.619 0 C-N-CA 124.131 3.221 . . . . 0.75 113.964 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -99.65 93.21 5.72 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 118.852 -1.139 . . . . 0.98999999999999999 109.603 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.51 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 48.9 mtmt -93.94 123.27 37.19 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.662 -0.815 . . . . 2.7799999999999998 111.752 -178.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.484 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -80.4 121.07 25.26 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 106.052 -1.833 . . . . 0.67000000000000004 106.052 176.478 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 7.1 mm-40 -85.58 14.83 5.15 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 120.761 -1.212 . . . . 1.71 108.194 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.484 ' HB ' ' SG ' ' A' ' 60' ' ' CYS . 21.2 t -93.77 -56.94 4.72 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.723 0 C-N-CA 120.083 -0.647 . . . . 1.03 110.136 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.0 p -121.24 25.65 9.39 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.273 -0.892 . . . . 1.1799999999999999 111.024 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 58.49 30.94 65.78 Favored Glycine 0 N--CA 1.494 2.524 0 O-C-N 120.856 -1.152 . . . . 1.1299999999999999 112.706 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -107.3 152.7 23.77 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-N 118.998 1.399 . . . . 2.0600000000000001 108.511 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -126.5 150.51 48.7 Favored 'General case' 0 N--CA 1.502 2.156 0 CA-C-O 121.807 0.813 . . . . 1.1000000000000001 111.738 -177.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.539 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 82.7 m-85 -134.34 153.41 51.9 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 122.425 1.107 . . . . 1.1200000000000001 113.404 -177.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.0 m -78.29 -41.1 34.88 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 115.47 -0.786 . . . . 1.75 108.907 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -103.78 144.75 31.07 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.926 0.869 . . . . 3.3599999999999999 110.56 -177.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.537 ' O ' ' N ' ' A' ' 73' ' ' LEU . 27.9 p -70.61 -45.66 64.85 Favored 'General case' 0 C--O 1.195 -1.804 0 N-CA-C 106.951 -1.5 . . . . 1.5900000000000001 106.951 178.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.58 ' OG ' ' N7 ' ' C' ' 210' ' ' ' DA' . 0.4 OUTLIER -47.01 -43.15 19.25 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.237 -1.023 . . . . 1.8999999999999999 108.237 179.164 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -69.66 -32.87 71.77 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 107.383 -1.34 . . . . 1.4399999999999999 107.383 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 70' ' ' SER . 16.2 tp -68.91 -57.54 5.37 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 106.436 -1.69 . . . . 0.69999999999999996 106.436 176.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.465 HD13 HG21 ' A' ' 74' ' ' ILE . 79.2 mt -42.9 -57.38 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 O-C-N 121.0 -1.062 . . . . 1.54 110.185 178.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.7 m -59.21 -41.82 89.48 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.015 -1.053 . . . . 1.55 108.659 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.539 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 22.7 t60 -59.93 -43.74 94.76 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 122.216 1.007 . . . . 0.94999999999999996 108.37 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.9 t -68.29 -36.4 79.32 Favored 'General case' 0 C--N 1.309 -1.164 0 O-C-N 120.875 -1.141 . . . . 1.1699999999999999 108.123 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 85.5 mtt-85 -54.75 -38.57 67.33 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 107.597 -1.26 . . . . 2.54 107.597 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 34.7 mttp -64.99 -43.88 91.12 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 118.714 -1.195 . . . . 2.6299999999999999 107.98 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 49.9 m-70 -62.15 -44.37 96.77 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 117.186 -1.806 . . . . 0.97999999999999998 108.713 177.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.1 m -51.64 -57.08 10.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.625 -0.672 . . . . 1.4399999999999999 109.564 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 109.513 -1.435 . . . . 1.8700000000000001 109.513 179.876 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.956 0 O4'-C4'-C3' 107.262 1.662 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.858 0 O4'-C4'-C3' 107.122 1.522 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' ' DT' . . . . . 0.462 ' O4 ' ' N6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.732 0 C1'-O4'-C4' 106.19 -2.507 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' ' DA' . . . . . 0.577 ' C6 ' ' C5 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.031 0 O4'-C4'-C3' 107.083 1.483 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' ' DA' . . . . . 0.577 ' C5 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.221 0 C1'-O4'-C4' 107.584 -1.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.562 ' C4 ' ' C2 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.925 0 P-O3'-C3' 122.493 2.328 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.54 2.219 0 C1'-O4'-C4' 106.364 -2.383 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' ' DC' . . . . . 0.57 ' O2 ' ' H2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.79 0 O4'-C4'-C3' 107.154 1.554 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' ' DA' . . . . . 0.596 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.515 0 C1'-O4'-C4' 107.524 -1.554 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' ' DC' . . . . . 0.596 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.038 0 P-O3'-C3' 121.986 1.905 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.538 1.977 0 C1'-O4'-C4' 107.41 -1.636 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' ' DG' . . . . . 0.51 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.777 0 O4'-C4'-C3' 107.392 1.792 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.51 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.991 0 O4'-C4'-C3' 107.049 1.449 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.906 0 C4'-C3'-C2' 104.936 1.736 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.815 0 C4'-C3'-C2' 104.826 1.626 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.953 0 O4'-C4'-C3' 107.272 1.672 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.835 0 O4'-C4'-C3' 107.225 1.625 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.828 0 C4'-C3'-C2' 104.862 1.662 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.9 0 C1'-O4'-C4' 107.194 -1.79 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.988 0 C1'-O4'-C4' 107.451 -1.607 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.751 0 C4'-C3'-C2' 104.794 1.594 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.888 0 O4'-C4'-C3' 107.392 1.792 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.959 0 O4'-C4'-C3' 107.292 1.692 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.005 0 C1'-O4'-C4' 106.846 -2.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 209' ' ' ' DG' . . . . . 0.57 ' N2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.535 1.698 0 C4'-C3'-C2' 104.881 1.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 210' ' ' ' DA' . . . . . 0.595 ' C2 ' ' C2 ' ' C' ' 211' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.531 1.307 0 O4'-C4'-C3' 107.319 1.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 211' ' ' ' DT' . . . . . 0.595 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.425 -1.937 0 C1'-O4'-C4' 106.278 -2.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 212' ' ' ' DT' . . . . . 0.439 ' C2 ' ' C6 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.534 1.59 0 C1'-O4'-C4' 106.685 -2.153 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 213' ' ' ' DT' . . . . . 0.455 ' O4 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.75 0 C1'-O4'-C4' 107.089 -1.865 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 214' ' ' ' DA' . . . . . 0.455 ' N6 ' ' O4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.139 0 O4'-C4'-C3' 107.169 1.569 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 215' ' ' ' DT' . . . . . 0.409 ' C4 ' ' C5 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.023 0 C1'-O4'-C4' 107.195 -1.789 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.024 0 O4'-C4'-C3' 107.287 1.687 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 78.1 p . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.352 -0.611 . . . . 2.0 109.352 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.62 ' CE1' ' N ' ' A' ' 14' ' ' SER . 4.2 m-85 -85.88 128.42 34.82 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.183 -0.948 . . . . 1.29 108.723 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.618 ' OD1' ' N ' ' A' ' 4' ' ' CYS . 61.3 t0 -108.19 136.55 47.66 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.816 1.294 . . . . 1.3799999999999999 110.85 -179.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.618 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 1.7 t -68.54 126.57 30.08 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 114.589 -1.187 . . . . 0.5 109.386 178.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.458 ' HD2' ' H ' ' A' ' 5' ' ' LYS . 2.3 mptt -92.59 26.69 2.56 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.359 -0.838 . . . . 2.0699999999999998 109.308 -178.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 74.7 mt -125.27 -72.04 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.37 -0.831 . . . . 1.8799999999999999 111.247 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 29.7 p -86.54 -45.73 10.81 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.694 -1.254 . . . . 0.87 110.899 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.401 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 126.17 45.5 0.23 Allowed Glycine 0 N--CA 1.5 2.905 0 O-C-N 121.1 -1.0 . . . . 0.59999999999999998 112.267 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -127.28 156.0 42.62 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.972 -1.311 . . . . 1.8400000000000001 108.918 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.433 ' C ' ' CD1' ' A' ' 11' ' ' PHE . 54.4 m -113.32 165.15 12.71 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.64 -1.288 . . . . 1.3600000000000001 112.579 -176.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.553 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 46.4 m-85 -142.12 124.81 15.91 Favored 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 121.665 0.745 . . . . 0.93000000000000005 110.72 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -62.44 -24.57 67.5 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.775 -0.824 . . . . 2.5 108.775 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.431 ' NH2' ' O6 ' ' C' ' 204' ' ' ' DG' . 2.9 mmm180 -119.64 138.39 53.28 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.182 -0.673 . . . . 3.4199999999999999 109.182 -179.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.62 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 1.0 OUTLIER -64.44 -37.79 88.77 Favored 'General case' 0 C--N 1.301 -1.504 0 C-N-CA 118.991 -1.084 . . . . 1.3700000000000001 108.834 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.473 ' O ' ' OG ' ' A' ' 18' ' ' SER . 77.4 p -55.81 -48.89 74.62 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 107.799 -1.186 . . . . 1.6100000000000001 107.799 178.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.419 ' H ' ' HG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -56.91 -36.53 70.27 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 107.671 -1.233 . . . . 1.4299999999999999 107.671 178.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 tp -70.95 -34.85 71.87 Favored 'General case' 0 C--O 1.201 -1.472 0 N-CA-C 107.312 -1.366 . . . . 0.85999999999999999 107.312 177.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.573 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 18.5 p -58.98 -60.6 3.61 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.038 -1.038 . . . . 1.6200000000000001 108.888 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.481 ' N ' ' OG ' ' A' ' 18' ' ' SER . 68.3 m -52.8 -34.39 53.31 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 122.063 0.935 . . . . 1.0700000000000001 108.518 179.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.553 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 63.1 t60 -68.39 -45.81 71.71 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-O 122.809 1.29 . . . . 0.75 108.323 178.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 38.1 mt -58.05 -35.82 71.89 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 106.753 -1.573 . . . . 0.77000000000000002 106.753 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 18' ' ' SER . 13.3 mt -62.86 -35.63 80.61 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.466 -0.939 . . . . 0.83999999999999997 108.466 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 67.9 mt -57.58 -34.93 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 O-C-N 120.322 -1.486 . . . . 1.1599999999999999 108.548 177.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -81.15 -36.08 30.69 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.431 -1.308 . . . . 1.1499999999999999 111.497 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.637 ' O ' ' CG ' ' A' ' 26' ' ' ASP . 1.3 m -83.56 -59.86 2.31 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.421 -1.424 . . . . 1.6499999999999999 108.649 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.637 ' CG ' ' O ' ' A' ' 25' ' ' SER . 3.3 p-10 97.66 54.63 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.966 0 CA-C-O 122.039 0.923 . . . . 2.3300000000000001 110.19 178.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.464 ' O ' ' C ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -63.84 -46.83 83.28 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.3 -0.875 . . . . 1.1799999999999999 108.944 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.499 ' NH1' ' ND1' ' A' ' 40' ' ' HIS . 0.4 OUTLIER 36.33 65.83 2.05 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.558 -0.714 . . . . 1.1699999999999999 110.374 179.586 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -88.94 12.29 2.78 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.595 2.197 . . . . 0.70999999999999996 113.752 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.408 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 69.8 m-85 -117.45 86.15 21.88 Favored Pre-proline 0 N--CA 1.498 1.973 0 O-C-N 121.009 -1.057 . . . . 0.93000000000000005 109.354 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -84.99 130.96 4.22 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 123.043 2.495 . . . . 0.92000000000000004 114.063 -178.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.53 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -53.04 139.43 28.16 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 122.1 0.952 . . . . 0.82999999999999996 110.376 179.025 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.587 ' NE2' ' H ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -81.64 -20.96 38.56 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.485 -0.779 . . . . 1.4099999999999999 110.201 179.711 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.53 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 22.4 m-85 -103.95 -73.38 0.67 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.632 -1.292 . . . . 1.01 111.993 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.465 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 20.4 p -78.83 -19.48 51.94 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.849 -1.157 . . . . 1.04 112.139 -177.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.27 -7.67 58.51 Favored Glycine 0 N--CA 1.509 3.562 0 O-C-N 120.405 -1.434 . . . . 0.97999999999999998 115.18 175.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -51.15 168.42 0.06 Allowed 'General case' 0 N--CA 1.502 2.155 0 CA-C-N 121.126 2.463 . . . . 2.8300000000000001 109.522 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.463 ' N ' ' NE ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -125.8 133.21 52.09 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.719 -1.238 . . . . 1.8200000000000001 109.08 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -118.95 166.53 12.73 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.482 -0.761 . . . . 0.55000000000000004 109.885 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.521 ' N ' ' ND1' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -102.81 2.71 35.87 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.796 -0.565 . . . . 0.97999999999999998 111.036 -179.601 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' A' ' 42' ' ' LYS . 38.8 mt-30 -146.62 118.08 7.96 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.467 -1.395 . . . . 1.6699999999999999 111.055 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 41' ' ' GLN . 37.4 tttm -37.08 -69.46 0.11 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.458 -0.776 . . . . 2.5499999999999998 111.895 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.1 m -48.07 -27.79 2.5 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.843 -1.16 . . . . 1.8999999999999999 110.682 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -74.75 -40.18 61.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.994 -1.066 . . . . 0.82999999999999996 108.172 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.658 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 4.8 tmm? -68.6 -47.44 66.69 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.379 -1.451 . . . . 1.0900000000000001 107.472 176.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -52.56 -37.55 58.09 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.416 -1.327 . . . . 2.2000000000000002 107.416 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.52 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.5 mtpt -63.13 -32.84 74.32 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 105.351 -2.092 . . . . 1.45 105.351 176.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.658 ' HB3' ' O ' ' A' ' 45' ' ' MET . 65.0 t60 -69.54 -63.83 1.0 Allowed 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 107.813 -1.18 . . . . 0.68999999999999995 107.813 177.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.469 ' C ' ' O ' ' A' ' 48' ' ' HIS . 70.5 p -39.9 -38.31 0.67 Allowed 'General case' 0 N--CA 1.482 1.154 0 O-C-N 120.4 -1.438 . . . . 1.1000000000000001 110.249 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.613 ' CE1' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-85 -70.26 -35.17 73.6 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.166 -0.959 . . . . 0.71999999999999997 109.503 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' A' ' 48' ' ' HIS . 4.4 pt -57.45 -21.25 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 C-N-CA 118.158 -1.417 . . . . 0.78000000000000003 107.392 176.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . 0.286 77.9 m-70 -94.22 -35.86 12.28 Favored 'General case' 0 N--CA 1.53 3.556 0 O-C-N 120.917 -1.115 . . . . 0.82999999999999996 112.998 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.448 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 68.6 p -74.67 -17.67 60.64 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.748 0.785 . . . . 1.28 109.094 -176.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.63 7.6 68.8 Favored Glycine 0 C--N 1.292 -1.876 0 N-CA-C 107.941 -2.064 . . . . 0.60999999999999999 107.941 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.613 ' OE1' ' CE1' ' A' ' 50' ' ' PHE . 91.8 mt-10 -73.48 115.41 12.83 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 122.313 1.054 . . . . 1.53 112.409 -177.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.0 mttm -125.2 68.77 58.46 Favored Pre-proline 0 N--CA 1.495 1.818 0 N-CA-C 108.597 -0.89 . . . . 2.2400000000000002 108.597 177.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HD3' ' C ' ' A' ' 55' ' ' GLU . 31.6 Cg_exo -56.69 -10.55 5.45 Favored 'Trans proline' 0 N--CA 1.503 2.074 0 C-N-CA 123.425 2.75 . . . . 0.85999999999999999 114.487 -179.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.588 ' CE1' ' OG ' ' A' ' 70' ' ' SER . 98.7 m-70 -99.42 85.84 3.25 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.474 -1.391 . . . . 1.1299999999999999 109.288 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -84.41 124.76 31.67 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.368 -0.833 . . . . 3.0099999999999998 110.072 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.673 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 0.5 OUTLIER -54.41 -89.02 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.785 0 O-C-N 121.864 -0.523 . . . . 0.89000000000000001 110.02 179.24 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.673 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 3.9 mm-40 120.06 -10.17 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.372 0 CA-C-O 121.79 0.805 . . . . 2.1099999999999999 110.238 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.5 t -94.69 -53.21 8.6 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-O 122.006 0.908 . . . . 1.77 108.631 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 26.8 p -108.48 -8.67 15.5 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.913 -0.585 . . . . 1.48 110.135 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.68 33.39 16.21 Favored Glycine 0 N--CA 1.498 2.795 0 O-C-N 121.17 -0.956 . . . . 1.22 113.123 177.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.474 ' NZ ' ' OP1' ' B' ' 104' ' ' ' DA' . 11.1 tttm -109.32 174.53 5.82 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.356 -1.673 . . . . 3.04 108.117 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -137.41 156.36 48.29 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.398 -1.439 . . . . 1.24 111.79 -177.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -137.75 147.77 45.01 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 122.522 1.153 . . . . 1.21 113.758 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.0 m -81.21 -27.15 35.41 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 115.023 -0.99 . . . . 1.5700000000000001 109.428 178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -120.67 144.15 48.34 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 118.916 -1.114 . . . . 3.3999999999999999 111.0 -178.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.588 ' OG ' ' CE1' ' A' ' 58' ' ' HIS . 17.1 m -65.12 -42.6 93.77 Favored 'General case' 0 C--O 1.197 -1.674 0 C-N-CA 119.248 -0.981 . . . . 1.8999999999999999 108.831 178.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.8 m -50.34 -44.26 54.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.038 -1.039 . . . . 1.9099999999999999 108.524 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -69.04 -33.61 73.87 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 118.48 -1.288 . . . . 2.75 108.731 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.2 tp -73.05 -47.16 47.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.414 -1.429 . . . . 0.91000000000000003 108.907 177.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.452 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 67.8 mt -55.01 -52.68 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.544 -1.347 . . . . 2.1400000000000001 108.307 178.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 91.8 m -59.14 -47.96 83.37 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 118.878 -1.129 . . . . 1.6599999999999999 108.182 178.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.2 t60 -54.75 -49.23 71.36 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.752 0.787 . . . . 0.93999999999999995 109.84 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.0 t -67.89 -31.22 70.85 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.382 -1.449 . . . . 1.23 108.928 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 44.5 mtp180 -61.42 -31.63 71.57 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 106.805 -1.554 . . . . 3.2599999999999998 106.805 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.409 ' CD ' ' OP2' ' B' ' 103' ' ' ' DT' . 61.5 mttp -67.42 -46.32 73.51 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 107.255 -1.387 . . . . 3.1000000000000001 107.255 177.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -59.98 -65.94 0.6 Allowed 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 117.383 -1.727 . . . . 1.0 109.275 178.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.5 m -54.74 -55.25 31.92 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.714 -0.616 . . . . 1.4299999999999999 110.03 -178.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.518 0 N-CA-C 109.243 -1.543 . . . . 1.46 109.243 179.828 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.803 0 C4'-C3'-C2' 104.883 1.683 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' ' DA' . . . . . 0.498 ' N6 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.965 0 O4'-C4'-C3' 107.509 1.909 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' ' DT' . . . . . 0.544 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.747 0 C1'-O4'-C4' 105.801 -2.785 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' ' DA' . . . . . 0.544 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.97 0 C1'-O4'-C4' 107.577 -1.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' ' DA' . . . . . 0.429 ' C4 ' ' C2 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.116 0 O4'-C4'-C3' 107.151 1.551 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.585 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.72 0 O4'-C4'-C3' 107.1 1.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' ' DT' . . . . . 0.406 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.902 0 C1'-O4'-C4' 106.279 -2.444 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' ' DC' . . . . . 0.421 ' OP2' ' CE1' ' A' ' 40' ' ' HIS . . . . . . . . 0 C5'--C4' 1.526 1.891 0 C1'-O4'-C4' 107.334 -1.69 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' ' DA' . . . . . 0.565 ' C2 ' ' N2 ' ' C' ' 209' ' ' ' DG' . . . . . . . . 0 P--O5' 1.605 1.186 0 P-O3'-C3' 121.309 1.341 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' ' DC' . . . . . 0.555 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.823 0 O4'-C4'-C3' 107.174 1.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.971 0 C1'-O4'-C4' 106.619 -2.201 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' ' DG' . . . . . 0.477 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.994 0 O4'-C4'-C3' 107.468 1.868 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.477 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O4'-C4'-C3' 107.318 1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.877 0 C4'-C3'-C2' 104.783 1.583 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.766 0 O4'-C4'-C3' 107.26 1.66 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.085 0 O4'-C4'-C3' 107.277 1.677 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.828 0 O4'-C4'-C3' 107.176 1.576 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.964 0 C4'-C3'-C2' 104.848 1.648 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 203' ' ' ' DG' . . . . . 0.554 ' C2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.906 0 C4'-C3'-C2' 104.828 1.628 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 204' ' ' ' DG' . . . . . 0.554 ' C4 ' ' C2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.899 0 C4'-C3'-C2' 104.806 1.606 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.853 0 O4'-C4'-C3' 107.321 1.721 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.702 0 O4'-C4'-C3' 107.218 1.618 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.915 0 O4'-C4'-C3' 107.125 1.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.779 0 C4'-C3'-C2' 104.792 1.592 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 209' ' ' ' DG' . . . . . 0.565 ' N2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.701 0 C1'-O4'-C4' 107.549 -1.536 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 210' ' ' ' DA' . . . . . 0.585 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.754 0 O4'-C4'-C3' 107.498 1.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 211' ' ' ' DT' . . . . . 0.533 ' C4 ' ' C6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.423 -2.092 0 C1'-O4'-C4' 106.676 -2.16 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.869 0 C1'-O4'-C4' 106.927 -1.98 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 213' ' ' ' DT' . . . . . 0.43 ' O4 ' ' O4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.426 -1.799 0 C4'-C3'-C2' 104.968 1.768 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 214' ' ' ' DA' . . . . . 0.498 ' N6 ' ' N6 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.861 0 O4'-C4'-C3' 107.383 1.783 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.89 0 C1'-O4'-C4' 107.189 -1.793 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.936 0 O4'-C4'-C3' 107.252 1.652 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 94.8 p . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.464 0.65 . . . . 1.72 110.349 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.598 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.5 m-85 -94.23 126.98 39.81 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.711 -0.848 . . . . 0.93999999999999995 108.711 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.14 112.08 21.17 Favored 'General case' 0 N--CA 1.512 2.627 0 CA-C-O 122.797 1.284 . . . . 1.78 113.5 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.1 131.33 15.94 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-N 114.372 -1.286 . . . . 0.81999999999999995 111.478 179.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -90.61 -22.36 21.26 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.649 -0.657 . . . . 2.9500000000000002 112.003 -178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.711 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 1.1 mp -74.82 -69.29 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 O-C-N 120.253 -1.529 . . . . 1.46 111.479 -177.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.0 p -92.14 -18.77 23.05 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.727 -1.233 . . . . 0.87 110.018 -178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.86 51.59 2.8 Favored Glycine 0 N--CA 1.502 3.074 0 C-N-CA 119.999 -1.096 . . . . 0.89000000000000001 114.552 175.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -121.63 160.89 23.45 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 119.603 1.702 . . . . 1.8300000000000001 108.251 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 36.8 m -112.42 149.83 31.99 Favored 'General case' 0 N--CA 1.51 2.566 0 CA-C-O 122.51 1.148 . . . . 1.71 113.7 -175.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.543 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.6 m-85 -130.33 123.3 29.67 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.176 -0.92 . . . . 0.77000000000000002 110.484 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.496 ' CD ' ' N ' ' A' ' 12' ' ' LYS . 11.6 mptt -63.46 -20.64 65.75 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 109.091 -0.707 . . . . 3.6899999999999999 109.091 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.667 ' HB2' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -121.26 137.25 54.77 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.679 -0.638 . . . . 1.5600000000000001 109.625 -178.231 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.598 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 0.0 OUTLIER -61.36 -34.7 75.74 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 118.887 -1.125 . . . . 1.0900000000000001 107.99 179.575 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.715 ' HG ' ' H41' ' C' ' 205' ' ' ' DC' . 4.8 t -63.32 -44.58 94.56 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.682 -0.636 . . . . 1.47 110.139 -179.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.667 ' OG1' ' HB2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -62.27 -32.8 73.56 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 106.637 -1.616 . . . . 1.1000000000000001 106.637 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.9 tp -72.63 -35.87 67.91 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.527 -1.286 . . . . 0.73999999999999999 107.527 177.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.443 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 18.5 m -59.31 -59.13 5.95 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.802 -1.186 . . . . 1.0800000000000001 108.726 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 80.4 m -53.71 -35.73 61.47 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.102 -1.073 . . . . 1.04 108.102 178.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.543 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 55.1 t60 -66.34 -47.65 72.79 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 122.262 1.029 . . . . 0.45000000000000001 108.719 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 49.3 mt -58.42 -29.97 66.52 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 107.545 -1.28 . . . . 0.93999999999999995 107.545 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 18' ' ' SER . 86.7 mt -73.3 -27.76 61.72 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 107.724 -1.213 . . . . 0.66000000000000003 107.724 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.41 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 72.4 mt -63.02 -33.78 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 106.988 -1.486 . . . . 0.62 106.988 177.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -79.57 -44.08 21.76 Favored 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 119.805 -0.758 . . . . 0.71999999999999997 111.168 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.418 ' O ' ' C ' ' A' ' 26' ' ' ASP . 1.2 m -85.86 2.97 43.76 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.201 -1.562 . . . . 1.1799999999999999 108.57 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.418 ' C ' ' O ' ' A' ' 25' ' ' SER . 4.6 m-20 36.31 57.42 1.05 Allowed 'General case' 0 N--CA 1.498 1.975 0 CA-C-O 121.719 0.771 . . . . 1.3999999999999999 111.155 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 58.2 m -68.85 -52.25 31.79 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.794 -0.817 . . . . 1.1499999999999999 108.794 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.464 ' HD2' ' N ' ' A' ' 28' ' ' ARG . 5.5 mpt_? 43.12 61.1 10.1 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.318 -0.864 . . . . 0.90000000000000002 110.503 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.47 19.75 0.31 Allowed 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.085 1.856 . . . . 0.69999999999999996 113.731 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -126.8 88.92 53.37 Favored Pre-proline 0 N--CA 1.503 2.184 0 O-C-N 120.611 -1.306 . . . . 1.05 109.338 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.94 136.97 9.57 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.817 2.345 . . . . 0.70999999999999996 114.095 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.602 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -60.56 129.74 43.06 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.536 -0.913 . . . . 0.42999999999999999 108.536 179.399 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -74.06 -11.67 60.39 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-N 116.058 -0.519 . . . . 1.96 110.772 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.501 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 40.5 m-85 -113.86 -70.45 0.8 Allowed 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.507 -1.37 . . . . 0.89000000000000001 112.541 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.602 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 18.0 p -89.28 -7.54 55.21 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.893 -1.129 . . . . 0.34000000000000002 111.18 -178.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.485 ' C ' ' HB3' ' A' ' 32' ' ' CYS . . . 87.88 -3.78 85.85 Favored Glycine 0 N--CA 1.5 2.901 0 N-CA-C 115.821 1.088 . . . . 0.39000000000000001 115.821 175.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.536 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 19.4 mttm -48.08 148.07 1.9 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-N 121.795 2.797 . . . . 1.48 106.93 178.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -117.45 134.79 54.45 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.068 -1.645 . . . . 2.2999999999999998 109.449 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 17.9 m-85 -119.19 175.48 5.77 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.433 -0.792 . . . . 0.53000000000000003 109.016 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.492 ' H ' ' CD2' ' A' ' 40' ' ' HIS . 5.0 p80 -113.31 8.56 18.07 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.639 -0.663 . . . . 1.1000000000000001 111.362 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.507 ' O ' ' C ' ' A' ' 42' ' ' LYS . 28.1 mt-30 -143.1 111.51 6.24 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.453 -1.404 . . . . 2.0299999999999998 110.421 179.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' A' ' 45' ' ' MET . 49.4 tttm -30.95 -80.59 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.527 -0.733 . . . . 1.6399999999999999 111.05 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 42' ' ' LYS . 10.8 p -36.12 -31.15 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.144 -0.973 . . . . 1.1599999999999999 111.718 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -75.55 -40.9 56.18 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 118.359 -1.337 . . . . 0.81000000000000005 108.349 179.796 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.617 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.5 tmm? -65.28 -46.23 81.27 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.434 -1.691 . . . . 0.68999999999999995 106.434 177.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.563 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 52.9 mmtt -50.7 -36.83 38.07 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 107.476 -1.305 . . . . 2.0 107.476 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.407 ' O ' HG22 ' A' ' 51' ' ' ILE . 5.4 mtmp? -63.33 -32.09 73.41 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 106.395 -1.706 . . . . 2.54 106.395 177.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.623 ' O ' ' N ' ' A' ' 51' ' ' ILE . 66.3 t60 -72.6 -67.32 0.56 Allowed 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.273 -1.38 . . . . 0.37 107.273 177.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.563 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 41.7 p -40.68 -32.28 0.2 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 120.136 -1.602 . . . . 1.0600000000000001 109.61 177.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.553 ' CZ ' ' OE1' ' A' ' 55' ' ' GLU . 3.9 m-30 -70.41 -32.82 70.6 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 121.074 -1.016 . . . . 0.59999999999999998 108.955 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.623 ' N ' ' O ' ' A' ' 48' ' ' HIS . 15.6 pt -71.1 -16.75 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 C-N-CA 118.409 -1.316 . . . . 0.46999999999999997 109.264 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.447 ' NE2' ' HB2' ' A' ' 34' ' ' TYR . 67.1 m-70 -90.86 -30.68 16.81 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.403 -1.436 . . . . 0.32000000000000001 109.061 176.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.406 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 62.8 p -85.23 -11.2 55.43 Favored 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 112.608 0.596 . . . . 1.1899999999999999 112.608 -176.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 83.15 14.75 73.86 Favored Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.071 -1.612 . . . . 0.45000000000000001 109.071 -178.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.553 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 85.2 mt-10 -74.5 130.51 39.75 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.282 -1.128 . . . . 1.77 111.031 -177.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.1 mmtt -139.46 67.42 37.82 Favored Pre-proline 0 N--CA 1.487 1.418 0 N-CA-C 108.581 -0.896 . . . . 1.9199999999999999 108.581 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.55 -7.7 11.35 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.9 2.4 . . . . 0.53000000000000003 113.122 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -105.73 93.19 4.51 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.734 -1.229 . . . . 0.57999999999999996 109.019 179.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.464 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 91.5 mttt -94.31 123.72 37.88 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.068 -1.02 . . . . 1.76 110.761 -178.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.02 119.09 24.52 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.532 -1.284 . . . . 0.80000000000000004 107.532 177.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.464 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 38.6 mm-40 -74.79 -16.17 60.72 Favored 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 112.439 0.533 . . . . 1.75 112.439 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 40.7 t -69.54 -55.97 13.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.039 0 O-C-N 120.187 -1.571 . . . . 1.72 111.469 -178.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.8 p -112.11 -0.07 15.74 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 119.305 -0.958 . . . . 0.92000000000000004 110.83 -177.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.79 31.8 55.17 Favored Glycine 0 N--CA 1.498 2.803 0 C-N-CA 119.768 -1.206 . . . . 0.80000000000000004 112.516 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -102.16 168.72 9.18 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 106.203 -1.777 . . . . 2.3799999999999999 106.203 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -139.09 149.19 44.26 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.436 -1.415 . . . . 0.68000000000000005 110.836 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.419 ' HZ ' ' CE1' ' A' ' 76' ' ' HIS . 31.2 m-85 -133.46 151.53 51.8 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 122.061 0.934 . . . . 0.65000000000000002 112.905 -177.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 79.7 p -79.08 -27.39 43.02 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.717 -0.674 . . . . 1.1100000000000001 109.777 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -116.72 140.13 49.77 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.877 -1.139 . . . . 2.5099999999999998 111.189 -178.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.449 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -64.18 -45.28 89.05 Favored 'General case' 0 C--O 1.2 -1.538 0 N-CA-C 108.223 -1.028 . . . . 1.28 108.223 178.194 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.0 t -49.75 -35.87 23.85 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.299 -0.876 . . . . 1.01 108.923 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -74.96 -31.21 61.42 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.193 -1.41 . . . . 1.02 107.193 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' A' ' 70' ' ' SER . 43.7 tp -72.73 -54.52 8.72 Favored 'General case' 0 C--O 1.199 -1.582 0 N-CA-C 107.288 -1.375 . . . . 0.88 107.288 176.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.429 ' C ' ' O ' ' A' ' 73' ' ' LEU . 72.0 mt -45.34 -51.14 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 O-C-N 120.438 -1.414 . . . . 1.6499999999999999 108.549 178.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 57.2 m -62.43 -45.84 91.24 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 120.8 -1.188 . . . . 1.4399999999999999 109.313 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.419 ' CE1' ' HZ ' ' A' ' 67' ' ' PHE . 22.1 t60 -60.84 -43.34 98.43 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 122.141 0.972 . . . . 0.80000000000000004 109.593 -179.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -69.33 -32.55 71.71 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 120.779 -1.2 . . . . 1.8 108.283 178.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 82' ' ' GLY . 93.0 mtt180 -62.83 -31.88 72.98 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 106.673 -1.602 . . . . 2.8399999999999999 106.673 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.03 -43.55 87.27 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 118.134 -1.426 . . . . 2.1200000000000001 107.29 178.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 68.3 m-70 -66.12 -33.41 75.72 Favored 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 118.099 -1.44 . . . . 1.1200000000000001 109.506 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 17.5 p -103.0 16.79 25.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.303 -0.873 . . . . 1.98 111.265 -177.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.488 2.129 0 C-N-CA 119.237 -1.459 . . . . 2.1499999999999999 109.686 179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.729 0 O4'-C4'-C3' 107.223 1.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' ' DA' . . . . . 0.537 ' N6 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.825 0 O4'-C4'-C3' 107.204 1.604 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' ' DT' . . . . . 0.519 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.774 0 C1'-O4'-C4' 106.243 -2.469 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' ' DA' . . . . . 0.519 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.868 0 C1'-O4'-C4' 107.542 -1.541 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.039 0 O4'-C4'-C3' 107.139 1.539 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.601 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.086 0 C1'-O4'-C4' 107.216 -1.775 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' ' DT' . . . . . 0.449 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.142 0 C1'-O4'-C4' 106.628 -2.195 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.074 0 O4'-C4'-C3' 107.407 1.807 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' ' DA' . . . . . 0.625 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.556 0 N19-C1'-C2' 116.768 1.605 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' ' DC' . . . . . 0.625 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.931 0 P-O3'-C3' 121.853 1.794 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.034 0 C1'-O4'-C4' 107.09 -1.864 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' ' DG' . . . . . 0.51 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.023 0 O4'-C4'-C3' 107.224 1.624 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.51 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.034 0 O4'-C4'-C3' 107.295 1.695 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' ' DC' . . . . . 0.444 ' O2 ' ' N2 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.423 -2.056 0 C4'-C3'-C2' 104.869 1.669 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.822 0 O4'-C4'-C3' 107.154 1.554 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.93 0 O4'-C4'-C3' 107.314 1.714 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.863 0 O4'-C4'-C3' 107.156 1.556 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.106 0 O4'-C4'-C3' 107.434 1.834 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 203' ' ' ' DG' . . . . . 0.555 ' C2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.966 0 C1'-O4'-C4' 107.488 -1.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 204' ' ' ' DG' . . . . . 0.555 ' C4 ' ' C2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.931 0 C1'-O4'-C4' 107.217 -1.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 205' ' ' ' DC' . . . . . 0.715 ' H41' ' HG ' ' A' ' 15' ' ' SER . . . . . . . . 0 C5'--C4' 1.527 2.051 0 C1'-O4'-C4' 107.411 -1.635 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 206' ' ' ' DA' . . . . . 0.417 ' N6 ' ' N4 ' ' C' ' 205' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.789 0 O4'-C4'-C3' 107.404 1.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.966 0 O4'-C4'-C3' 107.192 1.592 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.943 0 C4'-C3'-C2' 104.924 1.724 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 209' ' ' ' DG' . . . . . 0.58 ' C2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.895 0 O4'-C4'-C3' 107.29 1.69 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 210' ' ' ' DA' . . . . . 0.601 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.583 0 O4'-C4'-C3' 107.459 1.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 211' ' ' ' DT' . . . . . 0.552 ' C4 ' ' C6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.425 -1.924 0 C1'-O4'-C4' 106.542 -2.256 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.727 0 C1'-O4'-C4' 106.966 -1.953 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.732 0 C4'-C3'-C2' 104.85 1.65 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 214' ' ' ' DA' . . . . . 0.537 ' N6 ' ' N6 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O4'-C4'-C3' 107.115 1.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 215' ' ' ' DT' . . . . . 0.432 ' C4 ' ' C5 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.015 0 C1'-O4'-C4' 107.344 -1.683 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.131 0 O4'-C4'-C3' 107.281 1.681 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.519 ' HG ' ' N ' ' A' ' 2' ' ' PHE . 30.0 t . . . . . 0 N--CA 1.495 1.816 0 CA-C-O 121.815 0.816 . . . . 65.129999999999995 110.719 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.621 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.2 m-85 -101.12 128.65 47.1 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.113 -0.699 . . . . 70.069999999999993 109.113 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -113.72 120.79 42.04 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 122.526 1.155 . . . . 83.590000000000003 112.414 -177.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.486 ' O ' ' HA2' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -52.62 126.61 20.27 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 108.377 -0.972 . . . . 50.890000000000001 108.377 177.257 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.31 -17.33 34.87 Favored 'General case' 0 C--N 1.289 -2.053 0 O-C-N 120.846 -1.159 . . . . 99.159999999999997 111.939 -177.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.422 HG21 HD11 ' A' ' 6' ' ' ILE . 7.9 mm -77.91 -72.75 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 120.822 -1.174 . . . . 112.28 112.592 -177.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.5 p -87.3 -32.0 19.91 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 106.516 -1.661 . . . . 82.079999999999998 106.516 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.486 ' HA2' ' O ' ' A' ' 4' ' ' CYS . . . 95.94 53.77 1.47 Allowed Glycine 0 N--CA 1.496 2.652 0 C-N-CA 118.513 -1.803 . . . . 195.93000000000001 114.54 174.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -115.71 164.56 14.18 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 104.438 -2.43 . . . . 114.22 104.438 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 90.2 p -115.7 149.19 38.8 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 119.826 -1.796 . . . . 78.049999999999997 113.847 -175.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 17.3 m-85 -129.21 129.69 45.36 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.682 0.753 . . . . 54.659999999999997 110.453 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.3 mtpt -73.31 -22.2 60.4 Favored 'General case' 0 N--CA 1.497 1.894 0 CA-C-O 121.785 0.803 . . . . 101.13 109.562 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.479 ' CB ' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -113.63 131.03 56.28 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.693 -0.855 . . . . 74.890000000000001 108.693 -177.516 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.621 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 98.3 p -58.63 -32.44 69.04 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.771 -1.206 . . . . 25.870000000000001 107.899 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 76.0 p -64.68 -41.48 96.02 Favored 'General case' 0 N--CA 1.485 1.315 0 O-C-N 121.541 -0.724 . . . . 23.449999999999999 110.337 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.479 ' OG1' ' CB ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -65.38 -33.5 76.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.078 -1.452 . . . . 32.270000000000003 107.078 179.816 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 tp -72.83 -36.36 67.49 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 107.509 -1.293 . . . . 97.780000000000001 107.509 177.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.575 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 20.7 t -57.84 -60.44 3.71 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.067 -1.021 . . . . 34.229999999999997 108.794 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 58.3 m -52.36 -40.55 62.15 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 122.526 1.155 . . . . 30.690000000000001 109.32 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 61.8 t60 -63.31 -46.05 88.5 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 108.116 -1.068 . . . . 81.829999999999998 108.116 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.7 mt -58.44 -31.4 67.73 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 106.638 -1.616 . . . . 156.93000000000001 106.638 178.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 18' ' ' SER . 35.7 mt -70.02 -24.49 63.29 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 115.278 -0.874 . . . . 64.069999999999993 108.685 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 86.9 mt -68.32 -33.3 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 107.13 -1.433 . . . . 150.09999999999999 107.13 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.5 m-70 -80.71 -38.31 29.09 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.434 -1.307 . . . . 55.939999999999998 109.744 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 m -84.78 -3.63 58.7 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 120.596 -1.315 . . . . 89.099999999999994 108.846 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 22' ' ' LEU . 53.7 m-20 47.94 51.3 14.62 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 121.385 0.612 . . . . 62.890000000000001 110.248 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -91.55 130.67 37.34 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.354 -0.841 . . . . 115.68000000000001 109.509 179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.0 mtt-85 -144.84 76.06 14.07 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 120.98 -1.075 . . . . 115.33 109.374 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.46 10.23 1.3 Allowed 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 121.843 1.695 . . . . 90.269999999999996 113.385 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.467 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 73.5 m-85 -115.19 81.72 8.33 Favored Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 120.985 -1.072 . . . . 131.19 108.434 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.81 126.07 7.06 Favored 'Trans proline' 0 C--N 1.312 -1.342 0 C-N-CA 122.509 2.139 . . . . 108.54000000000001 112.746 -178.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.501 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.1 OUTLIER -48.32 142.88 5.14 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.174 0.988 . . . . 43.399999999999999 110.08 178.204 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -83.36 -11.79 57.26 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.691 -0.631 . . . . 113.04000000000001 110.831 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.501 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 52.6 m-85 -117.67 -73.42 0.64 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.242 -1.536 . . . . 118.47 112.187 -178.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 18.3 p -79.21 -27.32 42.53 Favored 'General case' 0 N--CA 1.504 2.242 0 C-N-CA 119.088 -1.045 . . . . 56.060000000000002 110.634 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 104.94 1.46 42.23 Favored Glycine 0 N--CA 1.488 2.125 0 C-N-CA 119.405 -1.379 . . . . 19.149999999999999 114.218 175.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.483 ' NZ ' ' P ' ' B' ' 107' ' ' ' DT' . 2.8 mttm -54.73 153.32 6.09 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 121.12 2.46 . . . . 73.469999999999999 106.023 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -117.28 138.94 51.41 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.305 -1.497 . . . . 160.56 109.681 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.446 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 51.6 m-85 -120.18 160.53 22.73 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.078 -1.014 . . . . 72.450000000000003 110.153 -179.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.6 ' H ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -99.91 -7.67 24.96 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 116.234 -0.439 . . . . 97.769999999999996 110.542 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.517 ' O ' ' C ' ' A' ' 42' ' ' LYS . 88.3 mt-30 -130.3 109.24 10.61 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.885 -1.135 . . . . 106.11 109.32 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.585 ' O ' ' N ' ' A' ' 45' ' ' MET . 85.5 tttt -29.74 -82.47 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.781 -0.574 . . . . 136.28999999999999 111.199 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 42' ' ' LYS . 2.1 m -37.71 -30.42 0.03 OUTLIER 'General case' 0 C--N 1.291 -1.938 0 O-C-N 121.204 -0.935 . . . . 65.219999999999999 111.879 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 41' ' ' GLN . 57.6 t0 -72.35 -36.31 68.75 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.108 -1.62 . . . . 40.659999999999997 107.314 178.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.597 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.1 tmm? -71.31 -47.3 57.54 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.326 -1.361 . . . . 31.66 107.326 176.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.517 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 7.7 tptp -50.54 -39.06 48.01 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.21 -1.404 . . . . 103.12 107.21 -179.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.458 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.8 mtmt -64.41 -34.97 79.42 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 106.178 -1.786 . . . . 48.509999999999998 106.178 176.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.639 ' O ' HG12 ' A' ' 51' ' ' ILE . 64.8 t60 -65.38 -65.49 0.67 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 107.426 -1.324 . . . . 65.659999999999997 107.426 176.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.517 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 31.9 p -42.2 -33.32 0.59 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.227 -1.545 . . . . 47.020000000000003 109.9 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.508 ' CE2' ' OE1' ' A' ' 55' ' ' GLU . 2.6 m-85 -71.69 -27.65 63.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.86 -1.15 . . . . 54.630000000000003 109.572 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.639 HG12 ' O ' ' A' ' 48' ' ' HIS . 15.0 pt -74.96 -17.55 16.23 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 121.058 -1.026 . . . . 99.090000000000003 109.149 176.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 59.2 m-70 -89.34 -30.27 18.53 Favored 'General case' 0 N--CA 1.516 2.847 0 C-N-CA 118.065 -1.454 . . . . 59.329999999999998 107.916 176.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.437 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 38.6 p -77.18 -23.16 51.56 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.654 0.74 . . . . 97.329999999999998 109.061 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.69 22.64 35.9 Favored Glycine 0 N--CA 1.485 1.966 0 N-CA-C 108.276 -1.93 . . . . 23.68 108.276 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.508 ' OE1' ' CE2' ' A' ' 50' ' ' PHE . 86.5 mt-10 -85.66 127.1 34.4 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 122.394 1.092 . . . . 47.259999999999998 112.026 -177.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -137.76 78.83 35.58 Favored Pre-proline 0 C--N 1.296 -1.731 0 N-CA-C 107.588 -1.264 . . . . 86.790000000000006 107.588 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -67.37 -13.02 37.91 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 C-N-CA 123.101 2.534 . . . . 151.44 112.782 -178.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -96.34 91.32 5.79 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 118.437 -1.305 . . . . 42.670000000000002 108.623 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.404 ' O ' ' OE1' ' A' ' 61' ' ' GLN . 91.5 mttt -93.0 122.07 34.98 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.214 -0.929 . . . . 72.959999999999994 110.014 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.426 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -72.93 121.66 20.41 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.006 -1.109 . . . . 38.909999999999997 108.006 178.592 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.404 ' OE1' ' O ' ' A' ' 59' ' ' LYS . 1.6 mm100 -84.25 7.99 17.37 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.297 -0.877 . . . . 124.0 109.855 -178.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.46 ' HB ' ' CD2' ' A' ' 80' ' ' HIS . 21.7 t -91.65 -59.66 2.83 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 C-N-CA 119.566 -0.854 . . . . 56.07 109.546 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.1 p -111.22 -12.63 14.09 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.285 0.846 . . . . 63.829999999999998 113.285 -178.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.47 12.4 51.25 Favored Glycine 0 N--CA 1.505 3.247 0 O-C-N 120.057 -1.652 . . . . 23.809999999999999 112.867 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -86.18 166.79 15.47 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.087 -1.82 . . . . 120.73999999999999 106.087 177.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -132.41 144.76 50.73 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.481 -1.387 . . . . 39.509999999999998 109.702 -178.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.459 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 82.3 m-85 -128.49 147.03 50.65 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 122.237 1.018 . . . . 62.57 112.183 -177.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.1 m -74.31 -36.79 63.73 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.631 -0.713 . . . . 84.840000000000003 109.089 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -116.19 141.62 47.91 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.403 1.097 . . . . 93.390000000000001 111.751 -178.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.547 ' HG ' ' N ' ' A' ' 71' ' ' SER . 32.4 p -59.6 -40.83 88.79 Favored 'General case' 0 C--O 1.197 -1.664 0 N-CA-C 107.842 -1.169 . . . . 67.340000000000003 107.842 178.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.547 ' N ' ' HG ' ' A' ' 70' ' ' SER . 2.2 t -48.18 -41.9 28.27 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.374 -0.829 . . . . 68.680000000000007 110.004 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 -76.19 -29.73 57.76 Favored 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 118.321 -1.351 . . . . 33.829999999999998 108.307 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' A' ' 74' ' ' ILE . 48.3 tp -70.44 -55.65 8.5 Favored 'General case' 0 C--O 1.195 -1.804 0 N-CA-C 107.517 -1.29 . . . . 75.650000000000006 107.517 176.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.403 ' C ' ' O ' ' A' ' 73' ' ' LEU . 79.9 mt -45.91 -52.23 3.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 O-C-N 120.666 -1.271 . . . . 27.719999999999999 108.985 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.3 m -61.45 -45.87 92.45 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.985 -1.072 . . . . 95.200000000000003 109.702 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.459 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 11.6 t60 -64.56 -38.07 89.73 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 122.496 1.141 . . . . 66.299999999999997 109.09 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.53 -31.93 70.45 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 107.332 -1.358 . . . . 87.230000000000004 107.332 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 82' ' ' GLY . 10.0 mmt85 -63.36 -38.9 92.94 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 107.709 -1.219 . . . . 73.269999999999996 107.709 177.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.4 ' CD ' ' OP2' ' B' ' 103' ' ' ' DT' . 47.0 mttm -60.41 -44.07 96.07 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 118.014 -1.474 . . . . 80.849999999999994 107.403 178.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.46 ' CD2' ' HB ' ' A' ' 62' ' ' VAL . 59.3 m-70 -61.3 -35.73 78.15 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 117.002 -1.879 . . . . 46.009999999999998 107.898 177.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.4 m -98.26 24.16 7.53 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 107.918 -1.142 . . . . 89.5 107.918 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 109.476 -1.45 . . . . 8.6500000000000004 109.476 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.013 0 O4'-C4'-C3' 107.249 1.649 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' ' DA' . . . . . 0.532 ' N6 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.861 0 O4'-C4'-C3' 107.196 1.596 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' ' DT' . . . . . 0.572 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.572 0 C1'-O4'-C4' 106.012 -2.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' ' DA' . . . . . 0.572 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.789 0 O4'-C4'-C3' 107.056 1.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.965 0 O4'-C4'-C3' 107.219 1.619 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.578 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.752 0 C1'-O4'-C4' 107.283 -1.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' ' DT' . . . . . 0.499 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.068 0 C1'-O4'-C4' 106.586 -2.224 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' ' DC' . . . . . 0.458 ' N4 ' ' N6 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O4'-C4'-C3' 107.249 1.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' ' DA' . . . . . 0.678 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.442 0 N19-C1'-C2' 116.582 1.489 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' ' DC' . . . . . 0.678 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.987 0 P-O3'-C3' 121.979 1.899 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.996 0 C1'-O4'-C4' 107.144 -1.826 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' ' DG' . . . . . 0.464 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.845 0 O4'-C4'-C3' 107.49 1.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.464 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.938 0 O4'-C4'-C3' 107.326 1.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' ' DC' . . . . . 0.451 ' O2 ' ' N2 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.722 0 C4'-C3'-C2' 104.897 1.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.775 0 O4'-C4'-C3' 107.392 1.792 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.923 0 O4'-C4'-C3' 107.036 1.436 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.963 0 C1'-O4'-C4' 107.427 -1.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.996 0 O4'-C4'-C3' 107.159 1.559 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 203' ' ' ' DG' . . . . . 0.551 ' C2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.991 0 C4'-C3'-C2' 104.873 1.673 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 204' ' ' ' DG' . . . . . 0.551 ' C4 ' ' C2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.779 0 C4'-C3'-C2' 104.781 1.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 205' ' ' ' DC' . . . . . 0.534 ' N4 ' ' N6 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.043 0 C1'-O4'-C4' 107.269 -1.737 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 206' ' ' ' DA' . . . . . 0.534 ' N6 ' ' N4 ' ' C' ' 205' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.794 0 O4'-C4'-C3' 107.1 1.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.854 0 O4'-C4'-C3' 107.112 1.512 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.948 0 C4'-C3'-C2' 104.776 1.576 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 209' ' ' ' DG' . . . . . 0.557 ' C2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.721 0 O4'-C4'-C3' 107.226 1.626 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 210' ' ' ' DA' . . . . . 0.578 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.523 1.501 0 O4'-C4'-C3' 107.487 1.887 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 211' ' ' ' DT' . . . . . 0.556 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -1.963 0 C1'-O4'-C4' 106.709 -2.136 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.864 0 C1'-O4'-C4' 106.748 -2.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.849 0 C4'-C3'-C2' 104.782 1.582 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 214' ' ' ' DA' . . . . . 0.532 ' N6 ' ' N6 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.082 0 O4'-C4'-C3' 107.066 1.466 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 215' ' ' ' DT' . . . . . 0.441 ' N3 ' ' C6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.963 0 C1'-O4'-C4' 106.935 -1.975 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.058 0 O4'-C4'-C3' 107.35 1.75 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.9 p . . . . . 0 N--CA 1.489 1.478 0 N-CA-C 109.456 -0.572 . . . . 65.129999999999995 109.456 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.666 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.6 m-85 -102.52 124.87 48.86 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.229 -0.919 . . . . 70.069999999999993 109.152 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.7 139.56 40.93 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 122.272 1.034 . . . . 83.590000000000003 110.844 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -72.53 130.24 40.18 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 122.046 0.927 . . . . 50.890000000000001 110.593 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -92.95 22.89 4.55 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 109.311 -0.626 . . . . 99.159999999999997 109.311 -177.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.3 mm -123.72 -58.24 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.055 -1.028 . . . . 112.28 113.603 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.9 p -103.79 -38.5 7.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.706 -1.246 . . . . 82.079999999999998 110.537 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 133.04 13.58 1.54 Allowed Glycine 0 N--CA 1.506 3.362 0 CA-C-O 118.727 -1.041 . . . . 195.93000000000001 114.463 177.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -104.01 164.11 11.92 Favored 'General case' 0 N--CA 1.516 2.837 0 CA-C-N 121.167 2.483 . . . . 114.22 113.805 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.5 t -117.36 160.06 21.75 Favored 'General case' 0 N--CA 1.511 2.593 0 CA-C-O 122.511 1.148 . . . . 78.049999999999997 113.195 -176.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.539 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.9 m-85 -140.06 127.9 21.95 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-N 115.455 -0.793 . . . . 54.659999999999997 110.401 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.442 ' H ' HH21 ' A' ' 13' ' ' ARG . 47.5 mttp -72.59 -23.63 60.98 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 122.612 1.196 . . . . 101.13 109.217 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.71 ' N ' ' HE ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -119.17 115.5 24.36 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 114.784 -1.098 . . . . 74.890000000000001 110.158 -177.275 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.666 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 1.3 t -50.39 -33.69 21.59 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 118.4 -1.32 . . . . 25.870000000000001 109.303 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 p -56.28 -39.96 73.5 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.262 -1.524 . . . . 23.449999999999999 109.304 -178.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.463 ' CG2' " C2'" ' B' ' 109' ' ' ' DA' . 23.1 m -72.64 -32.02 65.56 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.389 -0.967 . . . . 32.270000000000003 108.389 178.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.7 tp -72.73 -44.98 60.99 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 106.395 -1.706 . . . . 97.780000000000001 106.395 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.596 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 45.1 m -44.35 -53.96 6.28 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.84 -1.17 . . . . 34.229999999999997 107.84 178.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.7 m -59.63 -41.33 90.22 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.911 0.863 . . . . 30.690000000000001 109.008 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.539 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 56.6 t60 -63.18 -35.73 81.26 Favored 'General case' 0 C--N 1.291 -1.94 0 CA-C-O 122.423 1.106 . . . . 81.829999999999998 108.602 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.2 mt -70.73 -34.69 72.16 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.103 -1.814 . . . . 156.93000000000001 106.103 178.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 18' ' ' SER . 22.2 mt -65.4 -21.48 66.67 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.215 -1.402 . . . . 64.069999999999993 107.215 177.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 80.2 mt -74.89 -41.05 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 120.864 -1.148 . . . . 150.09999999999999 109.262 178.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -76.01 -27.71 57.48 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 118.027 -1.469 . . . . 55.939999999999998 108.865 178.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -86.91 -25.75 24.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.3 -0.875 . . . . 89.099999999999994 108.694 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 64.64 50.9 2.01 Favored 'General case' 0 C--N 1.29 -1.998 0 O-C-N 121.404 -0.81 . . . . 62.890000000000001 109.56 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.435 ' C ' HH11 ' A' ' 28' ' ' ARG . 2.3 m -98.23 127.46 44.17 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.445 -0.784 . . . . 115.68000000000001 109.261 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.435 HH11 ' C ' ' A' ' 27' ' ' THR . 1.7 mpt_? -136.36 80.04 40.81 Favored Pre-proline 0 N--CA 1.495 1.783 0 O-C-N 121.147 -0.971 . . . . 115.33 109.878 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -75.69 17.88 0.65 Allowed 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 122.296 1.997 . . . . 90.269999999999996 114.13 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.497 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 61.9 m-85 -124.1 82.73 56.4 Favored Pre-proline 0 N--CA 1.497 1.9 0 N-CA-C 107.657 -1.238 . . . . 131.19 107.657 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -79.41 147.49 20.23 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 C-N-CA 122.689 2.259 . . . . 108.54000000000001 114.396 -177.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.625 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.5 OUTLIER -71.78 137.29 47.54 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-O 121.674 0.75 . . . . 43.399999999999999 109.826 -179.029 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.56 -15.68 54.04 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 120.414 -0.515 . . . . 113.04000000000001 110.476 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.468 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 25.0 m-85 -119.09 -51.82 2.32 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 115.185 1.55 . . . . 118.47 115.185 -175.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.625 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.6 p -100.54 -18.62 16.55 Favored 'General case' 0 N--CA 1.517 2.917 0 O-C-N 120.414 -1.429 . . . . 56.060000000000002 113.843 -175.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 124.54 -32.58 4.04 Favored Glycine 0 N--CA 1.512 3.744 0 O-C-N 119.597 -1.94 . . . . 19.149999999999999 114.548 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -51.67 160.69 0.61 Allowed 'General case' 0 C--N 1.292 -1.915 0 O-C-N 120.895 -1.356 . . . . 73.469999999999999 112.698 -177.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -131.97 152.96 50.78 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 107.801 -1.185 . . . . 160.56 107.801 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.467 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 35.4 m-85 -135.02 162.18 33.19 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-O 121.979 0.895 . . . . 72.450000000000003 110.36 -178.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.492 ' N ' ' ND1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -94.17 -11.92 29.4 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 115.598 -0.728 . . . . 97.769999999999996 110.863 -178.796 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' C ' ' A' ' 42' ' ' LYS . 65.7 mt-30 -131.86 116.24 16.95 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.928 -1.107 . . . . 106.11 110.126 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.499 ' O ' ' N ' ' A' ' 45' ' ' MET . 81.9 tttt -34.32 -74.21 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.197 -0.939 . . . . 136.28999999999999 111.384 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -43.98 -34.43 1.7 Allowed 'General case' 0 C--N 1.295 -1.775 0 O-C-N 121.566 -0.709 . . . . 65.219999999999999 111.287 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -68.36 -40.74 81.39 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.332 -1.729 . . . . 40.659999999999997 106.332 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.647 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 9.1 tmm? -69.45 -47.61 63.46 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 119.965 -1.709 . . . . 31.66 108.05 176.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.556 ' O ' ' OG1' ' A' ' 49' ' ' THR . 31.7 ttmt -50.9 -35.97 35.75 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.681 -1.229 . . . . 103.12 107.681 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.454 ' O ' HG21 ' A' ' 51' ' ' ILE . 25.9 mtmm -67.9 -32.78 73.5 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 105.596 -2.002 . . . . 48.509999999999998 105.596 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.803 ' O ' HG12 ' A' ' 51' ' ' ILE . 73.9 t60 -64.67 -65.21 0.7 Allowed 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 106.121 -1.807 . . . . 65.659999999999997 106.121 174.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.556 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 41.0 p -40.79 -37.05 0.7 Allowed 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.934 -1.104 . . . . 47.020000000000003 110.521 178.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.489 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 4.0 m-30 -65.52 -36.99 85.46 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.034 -1.042 . . . . 54.630000000000003 109.082 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.803 HG12 ' O ' ' A' ' 48' ' ' HIS . 10.5 pt -59.91 -36.58 67.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 N-CA-C 106.857 -1.535 . . . . 99.090000000000003 106.857 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -74.4 -32.08 62.57 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.452 -1.405 . . . . 59.329999999999998 110.852 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.587 ' HG1' ' CG ' ' A' ' 55' ' ' GLU . 69.3 p -85.56 -8.7 58.14 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.551 -1.343 . . . . 97.329999999999998 111.626 -176.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 74.0 13.78 80.71 Favored Glycine 0 N--CA 1.49 2.284 0 O-C-N 120.761 -1.212 . . . . 23.68 110.082 -178.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.587 ' CG ' ' HG1' ' A' ' 53' ' ' THR . 98.0 mt-10 -75.82 107.78 8.23 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.98 0.895 . . . . 47.259999999999998 110.657 -178.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -115.49 79.66 7.32 Favored Pre-proline 0 C--N 1.292 -1.912 0 N-CA-C 108.241 -1.022 . . . . 86.790000000000006 108.241 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -75.06 -13.31 21.33 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.488 2.126 . . . . 151.44 114.125 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -90.73 82.08 5.77 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 120.267 -1.521 . . . . 42.670000000000002 109.421 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -77.31 140.03 39.92 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 122.003 0.906 . . . . 72.959999999999994 111.404 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.473 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -103.11 115.4 30.52 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.621 -1.992 . . . . 38.909999999999997 105.621 177.569 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -85.12 14.05 5.53 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.34 -1.475 . . . . 124.0 109.934 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.473 ' HB ' ' SG ' ' A' ' 60' ' ' CYS . 46.8 t -95.47 -38.93 9.22 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 O-C-N 121.255 -0.903 . . . . 56.07 110.439 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.7 p -131.3 -8.01 3.78 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 122.139 0.971 . . . . 63.829999999999998 108.877 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.16 31.94 33.2 Favored Glycine 0 C--N 1.29 -2.024 0 O-C-N 120.837 -1.164 . . . . 23.809999999999999 111.195 176.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -96.36 -172.4 2.52 Favored 'General case' 0 C--N 1.287 -2.127 0 N-CA-C 103.216 -2.883 . . . . 120.73999999999999 103.216 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -165.74 148.13 7.44 Favored 'General case' 0 C--N 1.265 -3.077 0 N-CA-C 105.739 -1.949 . . . . 39.509999999999998 105.739 -176.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.55 ' CZ ' ' CG ' ' A' ' 76' ' ' HIS . 2.7 m-85 -129.22 146.77 51.06 Favored 'General case' 0 C--N 1.28 -2.419 0 C-N-CA 117.79 -1.564 . . . . 62.57 113.401 -175.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.406 ' OG ' ' HG3' ' A' ' 69' ' ' GLN . 4.9 p -70.7 -8.03 49.06 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 115.277 -0.874 . . . . 84.840000000000003 108.993 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.406 ' HG3' ' OG ' ' A' ' 68' ' ' SER . 24.7 mt-30 -145.4 130.82 18.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.036 -1.04 . . . . 93.390000000000001 111.312 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.596 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -51.1 -48.9 61.59 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.767 -1.208 . . . . 67.340000000000003 109.3 177.224 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.436 ' C ' ' O ' ' A' ' 70' ' ' SER . 0.3 OUTLIER -44.6 -44.87 9.18 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.969 -1.082 . . . . 68.680000000000007 108.7 -179.304 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.407 ' O ' ' CB ' ' A' ' 76' ' ' HIS . 63.0 m-20 -70.66 -28.1 64.53 Favored 'General case' 0 C--N 1.291 -1.976 0 C-N-CA 118.187 -1.405 . . . . 33.829999999999998 108.145 178.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.596 ' N ' ' O ' ' A' ' 70' ' ' SER . 37.6 tp -70.19 -59.33 2.95 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 106.778 -1.564 . . . . 75.650000000000006 106.778 175.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 91.5 mt -46.78 -54.34 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.376 -1.452 . . . . 27.719999999999999 109.875 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.435 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 3.2 m -61.96 -43.27 99.19 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 119.631 -1.918 . . . . 95.200000000000003 109.004 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.55 ' CG ' ' CZ ' ' A' ' 67' ' ' PHE . 16.2 t60 -58.94 -45.65 89.91 Favored 'General case' 0 C--N 1.296 -1.76 0 O-C-N 121.12 -0.988 . . . . 66.299999999999997 109.39 -178.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.6 t -69.15 -33.78 73.95 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 120.244 -1.535 . . . . 87.230000000000004 107.997 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 75' ' ' THR . 4.3 mtt85 -50.83 -41.04 57.3 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 106.49 -1.67 . . . . 73.269999999999996 106.49 178.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -64.6 -45.02 88.75 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 118.252 -1.379 . . . . 80.849999999999994 108.582 178.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.422 ' CD2' ' HB ' ' A' ' 62' ' ' VAL . 63.7 m-70 -62.49 -35.28 78.85 Favored 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 116.52 -2.072 . . . . 46.009999999999998 108.52 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 50.6 p -96.09 19.1 12.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.085 -1.01 . . . . 89.5 109.786 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.552 0 N-CA-C 109.381 -1.487 . . . . 8.6500000000000004 109.381 178.971 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.797 0 O4'-C4'-C3' 107.158 1.558 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.758 0 C1'-O4'-C4' 107.427 -1.624 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' ' DT' . . . . . 0.563 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.745 0 C1'-O4'-C4' 105.973 -2.662 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' ' DA' . . . . . 0.563 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.03 0 O4'-C4'-C3' 107.16 1.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' ' DA' . . . . . 0.457 ' C6 ' ' C5 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.021 0 O4'-C4'-C3' 107.114 1.514 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.601 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.812 0 C1'-O4'-C4' 106.885 -2.01 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' ' DT' . . . . . 0.549 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.942 0 C1'-O4'-C4' 106.233 -2.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.919 0 C1'-O4'-C4' 107.019 -1.915 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' ' DA' . . . . . 0.559 ' C2 ' ' N2 ' ' C' ' 209' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.493 0 N19-C1'-C2' 117.421 2.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' ' DC' . . . . . 0.548 ' C4 ' ' C5 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.942 0 P-O3'-C3' 121.687 1.656 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.886 0 C1'-O4'-C4' 107.152 -1.82 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' ' DG' . . . . . 0.568 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.818 0 O4'-C4'-C3' 107.416 1.816 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.568 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.873 0 O4'-C4'-C3' 107.095 1.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' ' DC' . . . . . 0.441 ' O2 ' ' N2 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.952 0 C4'-C3'-C2' 104.755 1.555 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.788 0 C1'-O4'-C4' 107.655 -1.46 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.054 0 O4'-C4'-C3' 107.222 1.622 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 201' ' ' ' DT' . . . . . 0.535 ' C2 ' ' N7 ' ' C' ' 202' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.893 0 O4'-C4'-C3' 107.087 1.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 202' ' ' ' DA' . . . . . 0.535 ' N7 ' ' C2 ' ' C' ' 201' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.053 0 O4'-C4'-C3' 107.513 1.913 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 203' ' ' ' DG' . . . . . 0.553 ' N2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.944 0 C4'-C3'-C2' 104.78 1.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 204' ' ' ' DG' . . . . . 0.553 ' C4 ' ' N2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.002 0 C1'-O4'-C4' 107.502 -1.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.018 0 C1'-O4'-C4' 107.317 -1.702 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.856 0 O4'-C4'-C3' 107.417 1.817 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.909 0 C4'-C3'-C2' 104.756 1.556 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.93 0 C4'-C3'-C2' 104.737 1.537 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 209' ' ' ' DG' . . . . . 0.559 ' N2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.986 0 O4'-C4'-C3' 107.184 1.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 210' ' ' ' DA' . . . . . 0.601 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.702 0 O4'-C4'-C3' 107.252 1.652 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 211' ' ' ' DT' . . . . . 0.545 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -2.032 0 C1'-O4'-C4' 106.83 -2.05 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.536 1.838 0 C1'-O4'-C4' 106.951 -1.964 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 213' ' ' ' DT' . . . . . 0.408 ' O4 ' ' O4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.426 -1.795 0 C4'-C3'-C2' 104.908 1.708 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 214' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.859 0 O4'-C4'-C3' 107.166 1.566 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.874 0 C1'-O4'-C4' 106.989 -1.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.127 0 O4'-C4'-C3' 107.287 1.687 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 p . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 121.399 0.618 . . . . 65.129999999999995 109.452 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.576 ' CE2' ' N ' ' A' ' 14' ' ' SER . 3.7 m-85 -103.39 121.51 42.95 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.473 -0.767 . . . . 70.069999999999993 109.158 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.904 ' O ' ' O ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -108.68 103.24 12.29 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 122.009 0.909 . . . . 83.590000000000003 110.761 -178.558 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.904 ' O ' ' O ' ' A' ' 3' ' ' ASP . 19.4 t -13.88 157.21 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.214 0 CA-C-N 114.621 -1.172 . . . . 50.890000000000001 109.573 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.7 mttp -120.36 20.44 11.92 Favored 'General case' 0 N--CA 1.507 2.385 0 N-CA-C 106.474 -1.676 . . . . 99.159999999999997 106.474 174.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.527 ' HB ' ' NE2' ' A' ' 24' ' ' HIS . 6.3 mm -126.13 -80.35 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 CA-C-N 115.333 -0.848 . . . . 112.28 110.361 -178.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.8 p -81.45 -36.2 29.66 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.269 -1.519 . . . . 82.079999999999998 109.384 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.88 43.44 1.12 Allowed Glycine 0 N--CA 1.506 3.302 0 C-N-CA 119.696 -1.24 . . . . 195.93000000000001 113.521 177.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.474 ' HG2' ' N ' ' A' ' 10' ' ' SER . 49.5 tttm -112.19 160.39 17.64 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.503 -1.586 . . . . 114.22 107.856 178.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.474 ' N ' ' HG2' ' A' ' 9' ' ' LYS . 57.6 p -112.32 146.96 37.34 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 123.499 1.619 . . . . 78.049999999999997 114.708 -174.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.506 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 49.4 m-85 -130.22 125.69 35.52 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 113.35 -1.75 . . . . 54.659999999999997 110.047 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.1 mttp -70.82 -21.21 62.49 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 122.631 1.205 . . . . 101.13 108.507 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.516 ' NH2' ' H ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -114.68 136.82 52.64 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 114.893 -1.049 . . . . 74.890000000000001 110.19 -177.178 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.576 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 19.3 t -65.62 -36.4 83.6 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.041 -1.037 . . . . 25.870000000000001 108.978 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.436 ' O ' ' OG ' ' A' ' 18' ' ' SER . 0.1 OUTLIER -65.96 -38.99 90.01 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.186 -0.946 . . . . 23.449999999999999 110.293 -179.26 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.556 ' CG2' H2'' ' B' ' 109' ' ' ' DA' . 3.8 m -66.11 -31.31 72.1 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 105.854 -1.906 . . . . 32.270000000000003 105.854 178.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.9 tp -73.19 -35.14 66.33 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 106.712 -1.588 . . . . 97.780000000000001 106.712 176.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.62 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 40.3 p -57.91 -57.16 14.0 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.782 -1.199 . . . . 34.229999999999997 108.308 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.9 m -53.53 -41.17 66.12 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 122.439 1.114 . . . . 30.690000000000001 108.863 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.506 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 55.3 t60 -62.78 -47.47 83.35 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-O 122.511 1.148 . . . . 81.829999999999998 108.411 178.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 37.9 mt -58.19 -30.72 66.65 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.025 -1.472 . . . . 156.93000000000001 107.025 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 18' ' ' SER . 61.3 mt -72.41 -26.69 61.96 Favored 'General case' 0 C--O 1.205 -1.246 0 N-CA-C 107.967 -1.123 . . . . 64.069999999999993 107.967 178.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.408 HD12 ' P ' ' B' ' 109' ' ' ' DA' . 49.5 mt -64.07 -34.0 65.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 O-C-N 120.046 -1.659 . . . . 150.09999999999999 107.028 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.527 ' NE2' ' HB ' ' A' ' 6' ' ' ILE . 89.7 m-70 -81.21 -37.29 28.88 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 118.697 -1.201 . . . . 55.939999999999998 110.477 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.51 ' O ' ' C ' ' A' ' 26' ' ' ASP . 57.4 m -93.6 1.87 56.54 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.387 -1.446 . . . . 89.099999999999994 109.043 -179.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.51 ' C ' ' O ' ' A' ' 25' ' ' SER . 1.1 p30 32.47 59.86 0.38 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.436 0.636 . . . . 62.890000000000001 110.164 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 91.5 m -70.65 -54.54 11.53 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 108.077 -1.083 . . . . 115.68000000000001 108.077 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.408 ' HG2' HH11 ' A' ' 28' ' ' ARG . 23.3 mtt-85 40.69 67.64 2.76 Favored Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.731 -0.605 . . . . 115.33 110.843 179.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -89.1 26.24 0.57 Allowed 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.639 2.226 . . . . 90.269999999999996 113.847 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.535 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 63.9 m-85 -122.73 76.54 47.54 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 120.694 -1.254 . . . . 131.19 107.634 179.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.29 125.81 12.28 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 122.696 2.264 . . . . 108.54000000000001 114.507 -176.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.9 OUTLIER -52.92 135.24 36.8 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.636 -0.876 . . . . 43.399999999999999 108.636 177.914 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.7 -11.57 58.24 Favored 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.372 -0.931 . . . . 113.04000000000001 109.652 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.519 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 85.6 m-85 -104.71 -74.29 0.65 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.798 -1.189 . . . . 118.47 111.659 -178.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.555 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 28.4 p -85.98 -19.82 29.83 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 118.614 -1.234 . . . . 56.060000000000002 111.487 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.71 0.16 55.33 Favored Glycine 0 N--CA 1.498 2.771 0 O-C-N 120.409 -1.432 . . . . 19.149999999999999 114.867 175.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.5 mttp -54.57 164.84 0.66 Allowed 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 121.737 2.769 . . . . 73.469999999999999 107.42 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -123.85 107.56 11.52 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.454 -1.404 . . . . 160.56 109.132 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.596 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 31.6 m-85 -89.44 170.63 10.37 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.334 -0.854 . . . . 72.450000000000003 111.15 -178.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.776 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 0.3 OUTLIER -117.1 40.25 3.05 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 115.651 -0.704 . . . . 97.769999999999996 111.037 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.776 ' HG3' ' O ' ' A' ' 40' ' ' HIS . 12.9 mt-30 179.72 105.73 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 108.473 -0.936 . . . . 106.11 108.473 177.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.535 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 33.8 tttp -32.35 -65.37 0.15 Allowed 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 112.627 0.603 . . . . 136.28999999999999 112.627 -178.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.1 m -52.89 -39.15 62.46 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.502 -0.749 . . . . 65.219999999999999 111.11 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -64.74 -42.1 95.43 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.309 -1.367 . . . . 40.659999999999997 107.309 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.593 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 61.9 ttp -63.32 -44.9 93.62 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.33 -1.481 . . . . 31.66 107.22 177.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.64 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 22.9 mttm -51.41 -42.44 61.46 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 107.547 -1.279 . . . . 103.12 107.547 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -59.63 -30.99 69.11 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 106.361 -1.718 . . . . 48.509999999999998 106.361 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.596 ' ND1' ' HZ ' ' A' ' 39' ' ' PHE . 76.3 t60 -71.19 -65.14 0.78 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 107.419 -1.326 . . . . 65.659999999999997 107.419 176.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.64 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 19.4 p -43.99 -31.07 0.82 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.586 -1.321 . . . . 47.020000000000003 110.003 178.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -71.39 -34.02 70.02 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.457 -0.777 . . . . 54.630000000000003 109.198 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.596 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.0 pt -65.95 -36.64 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 C-N-CA 118.029 -1.468 . . . . 99.090000000000003 108.362 176.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.474 ' NE2' ' HB2' ' A' ' 34' ' ' TYR . 78.1 m-70 -69.48 -32.04 70.69 Favored 'General case' 0 N--CA 1.524 3.232 0 O-C-N 120.142 -1.599 . . . . 59.329999999999998 110.368 178.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 63.1 p -82.27 -17.48 45.76 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.506 -0.746 . . . . 97.329999999999998 109.599 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 84.13 17.38 65.08 Favored Glycine 0 N--CA 1.481 1.697 0 N-CA-C 107.359 -2.297 . . . . 23.68 107.359 -177.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -76.48 116.97 17.65 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 122.143 0.973 . . . . 47.259999999999998 110.348 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -125.72 78.47 69.03 Favored Pre-proline 0 N--CA 1.49 1.575 0 N-CA-C 108.76 -0.83 . . . . 86.790000000000006 108.76 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -65.0 -10.66 26.36 Favored 'Trans proline' 0 C--N 1.309 -1.548 0 C-N-CA 122.589 2.193 . . . . 151.44 112.804 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -112.34 95.79 5.65 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 117.762 -1.575 . . . . 42.670000000000002 109.434 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -97.96 129.49 44.86 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.22 -0.925 . . . . 72.959999999999994 110.219 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.84 120.55 17.59 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 107.147 -1.427 . . . . 38.909999999999997 107.147 178.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -88.2 9.7 22.01 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.275 -1.009 . . . . 124.0 108.275 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.2 t -94.56 -59.89 2.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 C-N-CA 119.929 -0.709 . . . . 56.07 111.026 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.4 p -114.56 -17.87 11.59 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 113.987 1.106 . . . . 63.829999999999998 113.987 -177.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.86 -11.75 7.37 Favored Glycine 0 N--CA 1.514 3.891 0 CA-C-N 122.112 2.233 . . . . 23.809999999999999 114.765 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.5 tttp -86.8 166.0 15.56 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.077 -1.837 . . . . 120.73999999999999 112.024 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.52 151.82 48.98 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.19 -0.944 . . . . 39.509999999999998 112.228 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.539 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 90.6 m-85 -132.49 144.18 50.27 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 122.264 1.03 . . . . 62.57 112.922 -177.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.9 t -78.47 -40.03 36.68 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.293 -1.003 . . . . 84.840000000000003 108.293 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -106.29 140.66 38.88 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.965 0.888 . . . . 93.390000000000001 110.747 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.503 ' HG ' ' N ' ' A' ' 71' ' ' SER . 75.2 p -62.33 -40.37 96.12 Favored 'General case' 0 C--O 1.195 -1.796 0 N-CA-C 107.86 -1.163 . . . . 67.340000000000003 107.86 178.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.621 ' OG ' ' N7 ' ' C' ' 210' ' ' ' DA' . 0.4 OUTLIER -51.66 -35.1 41.02 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.621 -0.674 . . . . 68.680000000000007 110.078 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -80.57 -32.77 36.5 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.012 -1.075 . . . . 33.829999999999998 108.581 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 77' ' ' SER . 13.6 tp -73.71 -35.21 65.1 Favored 'General case' 0 C--O 1.202 -1.402 0 N-CA-C 106.914 -1.513 . . . . 75.650000000000006 106.914 176.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.566 ' O ' ' OG ' ' A' ' 77' ' ' SER . 66.6 mt -59.25 -54.16 38.14 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 O-C-N 120.486 -1.384 . . . . 27.719999999999999 107.732 177.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.65 ' O ' ' N ' ' A' ' 78' ' ' ARG . 55.2 m -57.98 -61.76 2.31 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 122.705 1.24 . . . . 95.200000000000003 107.91 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.539 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 13.0 t60 -45.59 -40.7 9.13 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.079 -1.082 . . . . 66.299999999999997 108.079 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.566 ' OG ' ' O ' ' A' ' 74' ' ' ILE . 95.6 p -69.45 -32.07 70.77 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 107.207 -1.405 . . . . 87.230000000000004 107.207 177.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.65 ' N ' ' O ' ' A' ' 75' ' ' THR . 51.8 mtp85 -61.41 -39.76 91.9 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.071 -1.018 . . . . 73.269999999999996 108.915 178.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.525 ' NZ ' ' OP2' ' B' ' 103' ' ' ' DT' . 30.3 mttt -59.17 -45.72 90.27 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 105.622 -1.992 . . . . 80.849999999999994 105.622 178.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 47.7 m-70 -60.06 -43.13 95.62 Favored 'General case' 0 C--N 1.295 -1.78 0 C-N-CA 117.211 -1.796 . . . . 46.009999999999998 109.305 175.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.433 ' HG1' ' HA ' ' A' ' 78' ' ' ARG . 75.4 p -91.82 22.13 4.39 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.379 -1.45 . . . . 89.5 108.919 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.486 2.002 0 N-CA-C 109.875 -1.29 . . . . 8.6500000000000004 109.875 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.001 0 C1'-O4'-C4' 107.513 -1.562 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.896 0 C1'-O4'-C4' 107.574 -1.518 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' ' DT' . . . . . 0.525 ' OP2' ' NZ ' ' A' ' 79' ' ' LYS . . . . . . . . 0 O4'--C4' 1.425 -1.866 0 C1'-O4'-C4' 105.751 -2.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' ' DA' . . . . . 0.593 ' C6 ' ' C5 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.994 0 O4'-C4'-C3' 107.203 1.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' ' DA' . . . . . 0.602 ' C2 ' ' C4 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.179 0 O4'-C4'-C3' 107.078 1.478 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.602 ' C4 ' ' C2 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.844 0 P-O3'-C3' 123.102 2.835 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' ' DT' . . . . . 0.534 ' C4 ' ' C4 ' ' B' ' 108' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.537 1.944 0 C1'-O4'-C4' 106.427 -2.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' ' DC' . . . . . 0.534 ' C4 ' ' C4 ' ' B' ' 107' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.536 1.797 0 C1'-O4'-C4' 106.696 -2.146 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' ' DA' . . . . . 0.562 ' C5 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.436 1.236 0 N19-C1'-C2' 116.752 1.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' ' DC' . . . . . 0.562 ' C5 ' ' C5 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.136 0 P-O3'-C3' 122.084 1.987 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.856 0 C1'-O4'-C4' 107.434 -1.619 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' ' DG' . . . . . 0.551 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.832 0 O4'-C4'-C3' 107.195 1.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.551 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.059 0 O4'-C4'-C3' 107.049 1.449 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.001 0 O4'-C4'-C3' 107.058 1.458 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.847 0 C1'-O4'-C4' 107.633 -1.477 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' ' DA' . . . . . 0.527 ' C2 ' ' C2 ' ' C' ' 202' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O4'-C4'-C3' 107.36 1.76 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.821 0 O4'-C4'-C3' 107.291 1.691 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 202' ' ' ' DA' . . . . . 0.527 ' C2 ' ' C2 ' ' B' ' 116' ' ' ' DA' . . . . . . . . 0 P--O5' 1.611 1.847 0 O4'-C4'-C3' 107.107 1.507 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.902 0 C1'-O4'-C4' 107.064 -1.883 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.001 0 C1'-O4'-C4' 107.342 -1.685 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.966 0 O4'-C4'-C3' 107.362 1.762 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 206' ' ' ' DA' . . . . . 0.513 ' N1 ' ' C6 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 P--O5' 1.612 1.873 0 O4'-C4'-C3' 107.355 1.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 207' ' ' ' DG' . . . . . 0.513 ' C6 ' ' N1 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.063 0 O4'-C4'-C3' 107.28 1.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.771 0 C1'-O4'-C4' 107.015 -1.918 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 209' ' ' ' DG' . . . . . 0.579 ' N2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.716 0 C4'-C3'-C2' 104.83 1.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 210' ' ' ' DA' . . . . . 0.621 ' N7 ' ' OG ' ' A' ' 71' ' ' SER . . . . . . . . 0 C5'--C4' 1.524 1.684 0 O4'-C4'-C3' 107.428 1.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 211' ' ' ' DT' . . . . . 0.6 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -2.011 0 C1'-O4'-C4' 106.167 -2.523 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 212' ' ' ' DT' . . . . . 0.404 ' N3 ' ' C4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.523 1.561 0 C1'-O4'-C4' 106.835 -2.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 213' ' ' ' DT' . . . . . 0.554 ' C4 ' ' C6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.808 0 C1'-O4'-C4' 107.288 -1.723 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 214' ' ' ' DA' . . . . . 0.554 ' C6 ' ' C4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.276 0 O4'-C4'-C3' 107.203 1.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.125 0 C1'-O4'-C4' 106.887 -2.009 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.092 0 O4'-C4'-C3' 107.268 1.668 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.8 m . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.345 -0.613 . . . . 65.129999999999995 109.345 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.474 ' CE2' ' N ' ' A' ' 14' ' ' SER . 1.7 m-85 -96.79 120.8 37.79 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.44 -0.948 . . . . 70.069999999999993 108.44 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.5 p-10 -103.23 128.42 50.24 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 122.483 1.135 . . . . 83.590000000000003 110.341 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.34 123.88 19.41 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 108.123 -1.066 . . . . 50.890000000000001 108.123 178.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -83.43 -8.7 59.34 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.297 -0.877 . . . . 99.159999999999997 109.758 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.3 mm -83.14 -70.0 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.767 -1.208 . . . . 112.28 110.618 -179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 24.2 p -94.42 -23.9 17.56 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 120.816 -1.177 . . . . 82.079999999999998 111.215 -178.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 101.93 37.32 3.44 Favored Glycine 0 N--CA 1.504 3.226 0 C-N-CA 119.214 -1.47 . . . . 195.93000000000001 114.047 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -113.86 161.87 17.05 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.556 -1.556 . . . . 114.22 107.512 177.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.3 t -114.02 166.3 11.74 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.377 -1.452 . . . . 78.049999999999997 112.739 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.544 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 53.0 m-85 -143.18 127.94 18.22 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 114.643 -1.162 . . . . 54.659999999999997 109.775 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.632 ' NZ ' ' NH1' ' A' ' 13' ' ' ARG . 7.0 mtmp? -70.36 -24.45 62.97 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.609 0.719 . . . . 101.13 109.433 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.828 ' HE ' ' H ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -118.5 138.24 52.65 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.611 -0.681 . . . . 74.890000000000001 109.309 -178.642 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.474 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 22.9 t -59.87 -34.13 72.74 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 120.95 -1.094 . . . . 25.870000000000001 108.706 -179.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.405 ' O ' ' OG ' ' A' ' 18' ' ' SER . 1.0 OUTLIER -62.46 -44.18 97.03 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 121.245 -0.909 . . . . 23.449999999999999 109.004 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.576 ' HG1' ' HE ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -61.51 -32.72 72.77 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 106.977 -1.49 . . . . 32.270000000000003 106.977 179.675 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.5 tp -73.83 -37.64 64.79 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.112 -1.44 . . . . 97.780000000000001 107.112 177.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.628 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 31.9 p -57.6 -58.53 7.93 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.796 -1.19 . . . . 34.229999999999997 109.195 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.429 ' N ' ' OG ' ' A' ' 18' ' ' SER . 97.0 m -57.07 -34.96 68.81 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 122.026 0.917 . . . . 30.690000000000001 108.961 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 62.1 t60 -65.94 -49.55 67.52 Favored 'General case' 0 C--N 1.295 -1.761 0 O-C-N 121.003 -1.061 . . . . 81.829999999999998 108.488 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 71.1 mt -55.25 -30.27 59.71 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 106.743 -1.577 . . . . 156.93000000000001 106.743 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 18' ' ' SER . 26.0 mt -70.9 -29.2 65.2 Favored 'General case' 0 C--O 1.208 -1.088 0 N-CA-C 108.178 -1.045 . . . . 64.069999999999993 108.178 178.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.414 ' N ' ' O ' ' A' ' 20' ' ' HIS . 65.4 mt -62.14 -36.1 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 O-C-N 119.877 -1.764 . . . . 150.09999999999999 107.728 177.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -80.97 -31.15 34.92 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 118.765 -1.174 . . . . 55.939999999999998 111.192 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.8 m -92.98 -5.0 51.66 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.173 -1.579 . . . . 89.099999999999994 108.875 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 46.21 73.22 0.18 Allowed 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 109.245 -0.65 . . . . 62.890000000000001 109.245 -178.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.5 m -107.84 122.59 47.08 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.53 -0.915 . . . . 115.68000000000001 108.53 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -139.02 85.55 15.86 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.078 -1.014 . . . . 115.33 109.974 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -83.07 7.84 4.97 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 122.498 2.132 . . . . 90.269999999999996 113.388 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -112.27 93.94 24.38 Favored Pre-proline 0 N--CA 1.499 1.982 0 O-C-N 120.988 -1.07 . . . . 131.19 109.036 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.451 ' CB ' ' HE ' ' A' ' 38' ' ' ARG . 93.0 Cg_endo -85.78 129.29 3.5 Favored 'Trans proline' 0 N--CA 1.491 1.325 0 C-N-CA 122.636 2.224 . . . . 108.54000000000001 115.099 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.577 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -55.43 135.11 50.66 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.017 -1.105 . . . . 43.399999999999999 108.017 177.374 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -80.55 -16.27 54.62 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 121.826 -0.546 . . . . 113.04000000000001 110.954 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.48 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 13.9 m-85 -109.77 -66.61 1.05 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.603 -1.311 . . . . 118.47 112.333 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.577 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.9 p -91.01 12.72 18.84 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.602 -1.311 . . . . 56.060000000000002 112.209 -178.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 37' ' ' LYS . . . 69.79 -11.44 1.84 Allowed Glycine 0 N--CA 1.511 3.651 0 O-C-N 121.099 -1.001 . . . . 19.149999999999999 115.581 175.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.417 ' C ' ' O ' ' A' ' 36' ' ' GLY . 21.9 tttp -46.55 154.44 0.3 Allowed 'General case' 0 N--CA 1.507 2.411 0 CA-C-N 120.423 2.111 . . . . 73.469999999999999 108.717 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.451 ' HE ' ' CB ' ' A' ' 31' ' ' PRO . 1.1 mmt85 -120.23 147.6 44.74 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 120.081 -1.637 . . . . 160.56 109.785 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.532 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 77.5 m-85 -128.7 171.86 11.79 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.537 -0.727 . . . . 72.450000000000003 109.373 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.592 ' N ' ' ND1' ' A' ' 40' ' ' HIS . 2.8 p-80 -109.58 -8.43 14.99 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.828 -0.545 . . . . 97.769999999999996 111.108 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -128.52 123.13 32.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.745 -1.222 . . . . 106.11 109.708 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -43.88 -66.1 0.42 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.887 -1.133 . . . . 136.28999999999999 111.177 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 21.9 t -47.18 -33.28 5.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.356 -0.84 . . . . 65.219999999999999 111.094 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -69.09 -45.2 70.86 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.129 -1.029 . . . . 40.659999999999997 108.28 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.54 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 35.7 ttp -63.03 -46.18 88.8 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.215 -1.402 . . . . 31.66 107.215 177.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.55 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 3.9 mmpt? -52.04 -40.74 61.54 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.33 -0.989 . . . . 103.12 108.33 -179.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 42.6 mtmt -63.14 -32.83 74.31 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 107.272 -1.381 . . . . 48.509999999999998 107.272 178.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.54 ' HB3' ' O ' ' A' ' 45' ' ' MET . 53.6 t60 -69.4 -65.82 0.66 Allowed 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 106.753 -1.573 . . . . 65.659999999999997 106.753 177.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.55 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 25.6 p -42.38 -30.43 0.33 Allowed 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.832 -1.168 . . . . 47.020000000000003 109.936 177.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.56 ' CD1' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-30 -73.46 -34.99 65.66 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.301 -0.875 . . . . 54.630000000000003 110.283 -179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 48' ' ' HIS . 19.2 pt -69.13 -22.28 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 C-N-CA 118.191 -1.404 . . . . 99.090000000000003 107.583 177.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.436 ' CE1' ' HB2' ' A' ' 34' ' ' TYR . 45.0 m-70 -79.72 -32.48 41.2 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.022 -1.048 . . . . 59.329999999999998 108.86 176.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.462 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 76.3 p -87.88 -11.98 46.13 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.709 -0.62 . . . . 97.329999999999998 112.175 -177.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.57 19.58 65.83 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 107.87 -2.092 . . . . 23.68 107.87 -177.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.56 ' OE1' ' CD1' ' A' ' 50' ' ' PHE . 32.3 mt-10 -79.14 130.24 35.29 Favored 'General case' 0 C--N 1.306 -1.3 0 O-C-N 121.379 -1.071 . . . . 47.259999999999998 110.922 -177.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -145.85 62.47 8.41 Favored Pre-proline 0 N--CA 1.49 1.567 0 N-CA-C 109.065 -0.717 . . . . 86.790000000000006 109.065 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -53.1 -15.47 5.09 Favored 'Trans proline' 0 N--CA 1.501 1.962 0 C-N-CA 123.132 2.554 . . . . 151.44 113.314 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.596 ' CE1' ' OG ' ' A' ' 70' ' ' SER . 95.9 m-70 -94.54 96.16 9.28 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.85 -1.156 . . . . 42.670000000000002 108.86 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.444 ' O ' ' C ' ' A' ' 60' ' ' CYS . 95.9 mttt -93.6 120.46 33.9 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.035 -1.041 . . . . 72.959999999999994 110.615 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.664 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 3.9 t -38.47 -86.68 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.728 -0.607 . . . . 38.909999999999997 109.765 179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.664 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 8.7 mm100 117.1 -16.51 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.732 0 CA-C-O 122.173 0.987 . . . . 124.0 108.804 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.403 ' N ' ' SG ' ' A' ' 60' ' ' CYS . 5.6 t -95.86 -63.04 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 CA-C-O 121.776 0.798 . . . . 56.07 109.994 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 23.8 p -101.42 -14.05 17.72 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.856 -0.528 . . . . 63.829999999999998 111.647 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.71 27.43 9.04 Favored Glycine 0 N--CA 1.504 3.207 0 O-C-N 120.372 -1.455 . . . . 23.809999999999999 111.709 178.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -105.37 164.0 12.19 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.514 -1.58 . . . . 120.73999999999999 107.41 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.444 ' C ' ' CD2' ' A' ' 67' ' ' PHE . . . -134.27 163.22 30.11 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.897 -1.127 . . . . 39.509999999999998 111.518 -177.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.444 ' CD2' ' C ' ' A' ' 66' ' ' ALA . 66.2 m-85 -145.5 147.18 31.87 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 122.569 1.176 . . . . 62.57 113.548 -177.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 78.6 p -81.6 -10.72 59.36 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 115.266 -0.879 . . . . 84.840000000000003 109.193 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -133.63 145.06 49.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.214 -0.928 . . . . 93.390000000000001 110.646 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.596 ' OG ' ' CE1' ' A' ' 58' ' ' HIS . 10.0 m -71.2 -47.44 57.42 Favored 'General case' 0 C--O 1.197 -1.685 0 C-N-CA 119.45 -0.9 . . . . 67.340000000000003 109.135 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.551 ' OG ' ' N7 ' ' C' ' 210' ' ' ' DA' . 0.6 OUTLIER -50.45 -33.22 20.26 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.193 -0.942 . . . . 68.680000000000007 108.58 179.675 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -77.37 -34.09 55.12 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.976 -1.078 . . . . 33.829999999999998 108.347 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.0 tp -73.28 -39.41 65.39 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.105 -1.072 . . . . 75.650000000000006 108.105 177.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.428 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 93.0 mt -57.86 -53.79 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 O-C-N 120.768 -1.207 . . . . 27.719999999999999 108.666 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.439 ' HA ' ' HE ' ' A' ' 78' ' ' ARG . 97.4 m -59.08 -43.86 91.83 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.865 -1.147 . . . . 95.200000000000003 108.372 179.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.409 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 31.8 t60 -58.54 -43.34 89.22 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 122.563 1.173 . . . . 66.299999999999997 108.149 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 36.4 t -68.38 -34.51 76.18 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.173 -0.955 . . . . 87.230000000000004 109.279 178.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' A' ' 75' ' ' THR . 28.1 mtm180 -61.38 -33.68 74.07 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 107.948 -1.13 . . . . 73.269999999999996 107.948 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.517 ' NZ ' ' OP2' ' B' ' 103' ' ' ' DT' . 0.0 OUTLIER -64.34 -47.9 77.59 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 107.19 -1.411 . . . . 80.849999999999994 107.19 178.339 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 53.3 m-70 -61.05 -44.96 96.61 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 117.834 -1.547 . . . . 46.009999999999998 109.077 178.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 33.8 m -50.31 -54.8 18.85 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.442 -0.786 . . . . 89.5 110.383 -177.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.65 -1.38 . . . . 8.6500000000000004 109.65 179.995 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.946 0 C4'-C3'-C2' 104.737 1.537 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.794 0 O4'-C4'-C3' 107.212 1.612 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' ' DT' . . . . . 0.517 ' OP2' ' NZ ' ' A' ' 79' ' ' LYS . . . . . . . . 0 C5'--C4' 1.526 1.848 0 C1'-O4'-C4' 106.506 -2.281 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' ' DA' . . . . . 0.562 ' C6 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.861 0 O4'-C4'-C3' 107.212 1.612 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' ' DA' . . . . . 0.58 ' C2 ' ' C4 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.12 0 O4'-C4'-C3' 107.163 1.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.58 ' C4 ' ' C2 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.93 0 O4'-C4'-C3' 107.551 1.951 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.539 2.059 0 C1'-O4'-C4' 106.547 -2.252 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.821 0 C1'-O4'-C4' 106.708 -2.137 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.252 0 O4'-C4'-C3' 107.04 1.44 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' ' DC' . . . . . 0.429 ' OP2' ' NH2' ' A' ' 13' ' ' ARG . . . . . . . . 0 C5'--C4' 1.526 1.888 0 O4'-C4'-C3' 107.109 1.509 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' ' DT' . . . . . 0.472 ' O2 ' ' C2 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.988 0 C1'-O4'-C4' 106.874 -2.018 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' ' DG' . . . . . 0.545 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.78 0 O4'-C4'-C3' 107.3 1.7 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.545 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.096 0 C1'-O4'-C4' 107.656 -1.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.825 0 C1'-O4'-C4' 107.162 -1.813 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.909 0 C4'-C3'-C2' 104.751 1.551 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.937 0 O4'-C4'-C3' 107.385 1.785 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.94 0 O4'-C4'-C3' 107.074 1.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.976 0 C1'-O4'-C4' 107.34 -1.685 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.933 0 C1'-O4'-C4' 106.831 -2.05 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.051 0 C1'-O4'-C4' 107.362 -1.67 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.657 0 O4'-C4'-C3' 107.418 1.818 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 206' ' ' ' DA' . . . . . 0.524 ' C2 ' ' C5 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.809 0 O4'-C4'-C3' 107.352 1.752 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 207' ' ' ' DG' . . . . . 0.524 ' C5 ' ' C2 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.913 0 O4'-C4'-C3' 107.149 1.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.823 0 C1'-O4'-C4' 107.243 -1.755 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 209' ' ' ' DG' . . . . . 0.546 ' N2 ' ' N3 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.807 0 O4'-C4'-C3' 107.415 1.815 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 210' ' ' ' DA' . . . . . 0.584 ' C2 ' ' C2 ' ' C' ' 211' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.523 1.555 0 O4'-C4'-C3' 107.476 1.876 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 211' ' ' ' DT' . . . . . 0.584 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -1.984 0 C1'-O4'-C4' 106.714 -2.133 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.686 0 C1'-O4'-C4' 106.703 -2.141 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 213' ' ' ' DT' . . . . . 0.514 ' C4 ' ' C6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.883 0 C1'-O4'-C4' 107.133 -1.833 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 214' ' ' ' DA' . . . . . 0.514 ' C6 ' ' C4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.238 0 O4'-C4'-C3' 107.275 1.675 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.968 0 C1'-O4'-C4' 107.006 -1.924 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.983 0 O4'-C4'-C3' 107.122 1.522 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.6 t . . . . . 0 N--CA 1.491 1.617 0 N-CA-C 109.089 -0.708 . . . . 65.129999999999995 109.089 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.548 ' CE1' ' N ' ' A' ' 14' ' ' SER . 13.7 m-85 -119.13 126.9 52.7 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.222 -0.924 . . . . 70.069999999999993 108.834 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -104.96 137.36 42.83 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 122.287 1.041 . . . . 83.590000000000003 112.016 -178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.57 130.26 38.52 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-N 115.199 -0.91 . . . . 50.890000000000001 110.34 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -98.82 32.12 2.72 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 121.216 0.532 . . . . 99.159999999999997 109.617 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.426 ' HB ' ' NE2' ' A' ' 24' ' ' HIS . 5.2 mm -126.92 -78.38 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.293 -0.879 . . . . 112.28 108.82 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.54 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 31.7 p -83.26 -52.07 6.9 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.559 -1.645 . . . . 82.079999999999998 106.559 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.54 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 121.46 62.77 0.23 Allowed Glycine 0 N--CA 1.496 2.659 0 C-N-CA 119.761 -1.209 . . . . 195.93000000000001 113.401 176.6 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -131.11 161.6 31.73 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 106.357 -1.72 . . . . 114.22 106.357 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.3 p -115.37 167.91 10.44 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.094 -1.629 . . . . 78.049999999999997 112.466 -176.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.508 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 55.3 m-85 -145.43 131.95 19.79 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 115.078 -0.965 . . . . 54.659999999999997 110.966 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -19.57 63.07 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 115.788 -0.642 . . . . 101.13 110.035 -179.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.429 ' O ' ' OG1' ' A' ' 16' ' ' THR . 0.1 OUTLIER -124.9 136.81 54.12 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.32 -0.863 . . . . 74.890000000000001 109.975 -178.32 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.548 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 30.5 t -56.07 -33.12 64.72 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 118.975 -1.09 . . . . 25.870000000000001 108.337 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.5 p -65.22 -42.06 93.81 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.039 -0.726 . . . . 23.449999999999999 109.039 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.429 ' OG1' ' O ' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -63.44 -33.25 75.14 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.336 -1.357 . . . . 32.270000000000003 107.336 179.555 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.7 tp -72.37 -46.32 55.91 Favored 'General case' 0 C--O 1.199 -1.59 0 N-CA-C 106.009 -1.848 . . . . 97.780000000000001 106.009 177.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.623 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 19.1 t -48.74 -58.84 4.16 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.162 -0.961 . . . . 34.229999999999997 108.505 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.4 m -54.61 -36.49 64.51 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.06 0.933 . . . . 30.690000000000001 109.163 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.508 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 64.4 t60 -68.21 -47.08 68.85 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-O 122.5 1.143 . . . . 81.829999999999998 108.269 179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.9 mt -59.97 -34.35 73.18 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 106.448 -1.686 . . . . 156.93000000000001 106.448 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 18' ' ' SER . 7.0 mt -62.36 -31.18 71.79 Favored 'General case' 0 C--O 1.205 -1.246 0 N-CA-C 107.237 -1.394 . . . . 64.069999999999993 107.237 178.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.415 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 65.1 mt -63.01 -34.88 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.38 -1.45 . . . . 150.09999999999999 108.112 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.426 ' NE2' ' HB ' ' A' ' 6' ' ' ILE . 97.2 m-70 -85.59 -14.39 45.89 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.248 -0.981 . . . . 55.939999999999998 109.434 178.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.537 ' O ' ' C ' ' A' ' 26' ' ' ASP . 4.9 p -108.62 0.24 20.59 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.945 -1.097 . . . . 89.099999999999994 109.457 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.537 ' C ' ' O ' ' A' ' 25' ' ' SER . 9.9 m-20 27.88 51.5 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.323 0.582 . . . . 62.890000000000001 109.845 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.498 HG22 ' H ' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -66.53 -47.09 74.01 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.882 -0.784 . . . . 115.68000000000001 108.882 179.601 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.498 ' H ' HG22 ' A' ' 27' ' ' THR . 9.6 mpt_? 37.33 65.76 2.42 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.694 -0.629 . . . . 115.33 111.354 178.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -83.07 31.58 0.52 Allowed 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.998 2.465 . . . . 90.269999999999996 113.378 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -136.13 76.23 51.79 Favored Pre-proline 0 N--CA 1.5 2.066 0 O-C-N 120.795 -1.191 . . . . 131.19 108.605 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.415 ' HB3' ' HE ' ' A' ' 38' ' ' ARG . 18.5 Cg_exo -66.09 160.4 44.84 Favored 'Trans proline' 0 N--CA 1.502 2.028 0 C-N-CA 123.331 2.688 . . . . 108.54000000000001 114.681 -178.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.565 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -83.79 136.53 34.11 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 122.058 0.932 . . . . 43.399999999999999 108.633 178.215 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -79.23 -16.92 55.77 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 115.842 -0.617 . . . . 113.04000000000001 109.772 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.538 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 18.1 m-85 -111.89 -71.02 0.78 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.779 -1.201 . . . . 118.47 112.634 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.565 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 20.1 p -83.03 -18.72 38.73 Favored 'General case' 0 N--CA 1.517 2.883 0 O-C-N 120.331 -1.481 . . . . 56.060000000000002 113.7 -177.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.567 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 114.05 -35.01 4.68 Favored Glycine 0 N--CA 1.511 3.65 0 O-C-N 120.189 -1.569 . . . . 19.149999999999999 113.518 176.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.567 ' O ' ' O ' ' A' ' 36' ' ' GLY . 5.8 mtpm? -26.57 149.34 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.862 0 O-C-N 121.075 -1.25 . . . . 73.469999999999999 110.772 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.433 ' NH2' ' O ' ' A' ' 36' ' ' GLY . 3.2 mmp_? -116.89 136.61 52.81 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.823 -1.176 . . . . 160.56 107.823 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.424 ' CZ ' ' CG ' ' A' ' 48' ' ' HIS . 34.1 m-85 -124.91 176.78 6.41 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.311 -0.996 . . . . 72.450000000000003 108.311 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.63 ' CD2' ' O ' ' A' ' 40' ' ' HIS . 1.5 t-80 -113.34 -19.38 11.76 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.73 -0.788 . . . . 97.769999999999996 111.563 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' A' ' 44' ' ' ASP . 67.5 mt-30 -121.88 128.43 51.59 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.728 -1.232 . . . . 106.11 111.635 -178.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.42 ' C ' ' O ' ' A' ' 41' ' ' GLN . 35.1 tptt -41.98 -71.05 0.09 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.227 -0.921 . . . . 136.28999999999999 110.109 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.411 ' C ' ' O ' ' A' ' 42' ' ' LYS . 26.0 p -43.5 -29.26 0.44 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.909 -1.12 . . . . 65.219999999999999 110.619 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 41' ' ' GLN . 4.8 m-20 -70.57 -47.59 59.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.377 -1.452 . . . . 40.659999999999997 107.822 178.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.497 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.0 tmm? -63.98 -48.01 78.12 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.425 -1.422 . . . . 31.66 107.796 178.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.589 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 90.2 mttt -51.1 -36.02 38.25 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.041 -1.096 . . . . 103.12 108.041 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.58 ' O ' HG23 ' A' ' 51' ' ' ILE . 30.3 mtpt -68.49 -34.52 76.06 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.106 -1.442 . . . . 48.509999999999998 107.106 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.793 ' O ' HG12 ' A' ' 51' ' ' ILE . 66.3 t60 -70.94 -64.49 0.89 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 106.9 -1.518 . . . . 65.659999999999997 106.9 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.589 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 16.9 p -42.66 -33.6 0.75 Allowed 'General case' 0 C--N 1.31 -1.148 0 O-C-N 120.414 -1.429 . . . . 47.020000000000003 108.775 177.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.514 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.1 m-85 -69.54 -28.06 65.69 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.057 -1.027 . . . . 54.630000000000003 108.233 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.793 HG12 ' O ' ' A' ' 48' ' ' HIS . 12.6 pt -73.34 -19.12 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 120.74 -1.225 . . . . 99.090000000000003 109.32 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.429 ' CD2' ' HB2' ' A' ' 34' ' ' TYR . 69.4 m-70 -89.9 -31.49 17.27 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.367 -1.458 . . . . 59.329999999999998 108.754 177.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.514 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 41.3 p -84.65 -20.73 30.84 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-N 115.345 -0.843 . . . . 97.329999999999998 109.329 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 71.72 49.06 25.41 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 108.606 -1.798 . . . . 23.68 108.606 -177.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.42 110.49 22.5 Favored 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.515 -0.991 . . . . 47.259999999999998 109.025 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -117.86 70.75 7.51 Favored Pre-proline 0 N--CA 1.494 1.725 0 O-C-N 121.5 -0.75 . . . . 86.790000000000006 110.556 -178.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -60.76 -8.2 8.91 Favored 'Trans proline' 0 N--CA 1.505 2.163 0 C-N-CA 123.841 3.027 . . . . 151.44 114.082 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.411 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 96.7 m-70 -101.83 93.0 5.07 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.549 -1.345 . . . . 42.670000000000002 108.315 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.457 ' CB ' ' NZ ' ' A' ' 59' ' ' LYS . 7.3 mtpm? -94.78 128.12 41.27 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.281 -0.887 . . . . 72.959999999999994 110.151 -178.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.419 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -79.43 124.64 28.64 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.702 0.763 . . . . 38.909999999999997 109.586 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -85.66 11.26 11.23 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.254 -0.904 . . . . 124.0 110.046 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.528 ' HB ' ' CD2' ' A' ' 80' ' ' HIS . 22.3 t -98.81 -58.1 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 120.865 -1.147 . . . . 56.07 111.049 -178.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 31.8 p -107.15 -25.5 11.52 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.157 -0.964 . . . . 63.829999999999998 109.76 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 109.39 10.85 22.96 Favored Glycine 0 N--CA 1.5 2.94 0 O-C-N 120.901 -1.125 . . . . 23.809999999999999 111.687 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 tttm -88.81 174.54 7.92 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.446 -1.62 . . . . 120.73999999999999 108.765 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -137.65 150.38 47.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.761 -1.212 . . . . 39.509999999999998 111.419 -177.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.508 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 63.8 m-85 -132.09 147.68 52.45 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 122.167 0.984 . . . . 62.57 111.534 -178.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.8 m -83.55 -19.6 35.33 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 108.934 -0.765 . . . . 84.840000000000003 108.934 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -122.53 146.1 47.71 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.121 -1.032 . . . . 93.390000000000001 111.697 -177.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 10.6 m -65.45 -40.82 93.69 Favored 'General case' 0 C--O 1.199 -1.571 0 N-CA-C 106.794 -1.558 . . . . 67.340000000000003 106.794 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.5 t -50.24 -45.69 54.23 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.479 -0.763 . . . . 68.680000000000007 109.356 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -73.25 -30.99 63.84 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 118.72 -1.192 . . . . 33.829999999999998 109.459 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 18.2 tp -74.4 -39.76 62.47 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.869 -1.144 . . . . 75.650000000000006 108.987 177.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.406 ' O ' ' CG ' ' A' ' 78' ' ' ARG . 97.3 mt -63.6 -50.4 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 120.254 -1.529 . . . . 27.719999999999999 107.67 177.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.7 m -57.98 -49.8 75.58 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 122.286 1.041 . . . . 95.200000000000003 108.64 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.508 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 28.3 t60 -58.64 -48.7 80.15 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.783 0.801 . . . . 66.299999999999997 110.717 -178.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.1 t -70.09 -34.29 72.97 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 120.136 -1.602 . . . . 87.230000000000004 108.656 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.406 ' CG ' ' O ' ' A' ' 74' ' ' ILE . 19.8 mmt180 -55.9 -32.13 63.46 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 107.083 -1.451 . . . . 73.269999999999996 107.083 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.408 ' HZ1' ' P ' ' B' ' 103' ' ' ' DT' . 4.0 mtpm? -69.29 -47.9 63.21 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.946 -1.131 . . . . 80.849999999999994 107.946 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.528 ' CD2' ' HB ' ' A' ' 62' ' ' VAL . 60.1 m-70 -56.98 -58.04 9.9 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 117.078 -1.849 . . . . 46.009999999999998 107.9 178.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 49.5 m -49.12 -52.27 27.11 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.102 -1.073 . . . . 89.5 108.102 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 109.392 -1.483 . . . . 8.6500000000000004 109.392 179.928 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.973 0 C1'-O4'-C4' 107.391 -1.649 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.134 0 C4'-C3'-C2' 104.962 1.762 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' ' DT' . . . . . 0.408 ' P ' ' HZ1' ' A' ' 79' ' ' LYS . . . . . . . . 0 C5'--C4' 1.524 1.679 0 C1'-O4'-C4' 106.599 -2.215 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' ' DA' . . . . . 0.555 ' C6 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.064 0 O4'-C4'-C3' 107.009 1.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' ' DA' . . . . . 0.578 ' C6 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.935 0 C1'-O4'-C4' 107.362 -1.67 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.578 ' C6 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.431 -1.353 0 O4'-C4'-C3' 107.638 2.038 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.044 0 C1'-O4'-C4' 106.305 -2.425 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.135 0 C1'-O4'-C4' 106.721 -2.128 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' ' DA' . . . . . 0.533 ' C2 ' ' C2 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.441 0 O4'-C4'-C3' 107.067 1.467 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' ' DC' . . . . . 0.533 ' C2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.062 0 O4'-C4'-C3' 107.169 1.569 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' ' DT' . . . . . 0.496 ' C4 ' ' C4 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.844 0 C1'-O4'-C4' 107.213 -1.777 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' ' DG' . . . . . 0.606 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.835 0 O4'-C4'-C3' 106.795 1.195 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.606 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.984 0 O4'-C4'-C3' 107.074 1.474 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.046 0 C1'-O4'-C4' 107.399 -1.644 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.989 0 C1'-O4'-C4' 107.273 -1.733 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.99 0 O4'-C4'-C3' 107.344 1.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.01 0 C4'-C3'-C2' 104.738 1.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.859 0 O4'-C4'-C3' 107.178 1.578 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.009 0 C1'-O4'-C4' 107.095 -1.86 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.085 0 C1'-O4'-C4' 107.309 -1.708 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.846 0 O4'-C4'-C3' 107.124 1.524 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.757 0 O4'-C4'-C3' 107.311 1.711 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 207' ' ' ' DG' . . . . . 0.438 ' N2 ' ' O2 ' ' B' ' 111' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.865 0 O4'-C4'-C3' 107.319 1.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 208' ' ' ' DT' . . . . . 0.419 ' C2 ' ' C2 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.987 0 C1'-O4'-C4' 107.153 -1.819 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 209' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.924 0 O4'-C4'-C3' 107.153 1.553 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 210' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.892 0 O4'-C4'-C3' 107.399 1.799 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 211' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.864 0 C1'-O4'-C4' 106.378 -2.373 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.765 0 C1'-O4'-C4' 106.472 -2.306 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.912 0 C1'-O4'-C4' 106.895 -2.003 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 214' ' ' ' DA' . . . . . 0.451 ' C5 ' ' C4 ' ' C' ' 215' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.996 0 O4'-C4'-C3' 107.362 1.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 215' ' ' ' DT' . . . . . 0.451 ' C4 ' ' C5 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -2.044 0 C1'-O4'-C4' 107.227 -1.766 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.915 0 O4'-C4'-C3' 107.028 1.428 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.568 ' HG ' ' N ' ' A' ' 2' ' ' PHE . 28.2 t . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.397 -0.594 . . . . 2.5699999999999998 109.397 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.574 ' N ' ' CD1' ' A' ' 2' ' ' PHE . 0.4 OUTLIER -111.55 127.88 55.86 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 107.51 -1.293 . . . . 1.52 107.51 178.872 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.573 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 0.5 OUTLIER -110.63 132.99 53.71 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 122.532 1.158 . . . . 1.6699999999999999 110.95 -178.755 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.29 129.82 41.88 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 113.886 -1.506 . . . . 0.92000000000000004 111.037 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -103.64 30.6 4.93 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.276 -0.89 . . . . 2.9399999999999999 109.315 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.481 HG21 HD13 ' A' ' 6' ' ' ILE . 29.0 mt -121.45 -29.59 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 119.754 -0.778 . . . . 1.51 111.0 -178.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.5 p -142.07 -27.75 0.63 Allowed 'General case' 0 C--N 1.298 -1.667 0 C-N-CA 118.995 -1.082 . . . . 1.51 109.784 -179.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 112.06 61.58 0.46 Allowed Glycine 0 N--CA 1.498 2.792 0 C-N-CA 119.489 -1.338 . . . . 1.4299999999999999 114.1 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.413 ' HZ1' ' HG2' ' A' ' 9' ' ' LYS . 52.0 tttm -142.83 150.95 40.6 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.543 -1.563 . . . . 1.8799999999999999 107.817 175.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.6 p -109.86 158.8 17.8 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.731 -1.231 . . . . 1.26 111.911 -176.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.629 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 63.1 m-85 -136.68 128.17 28.55 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 115.275 -0.875 . . . . 0.69999999999999996 111.335 -178.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -69.99 -21.1 63.26 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 115.447 -0.797 . . . . 3.04 108.96 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.82 140.82 51.8 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 122.123 0.964 . . . . 2.4900000000000002 109.976 -177.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.5 t -59.49 -33.36 71.24 Favored 'General case' 0 C--N 1.289 -2.029 0 O-C-N 120.48 -1.388 . . . . 1.4299999999999999 107.411 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.695 ' HG ' ' H ' ' A' ' 16' ' ' THR . 66.1 p -61.55 -52.0 66.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 119.94 -0.704 . . . . 1.5700000000000001 109.462 -178.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.695 ' H ' ' HG ' ' A' ' 15' ' ' SER . 0.0 OUTLIER -58.2 -36.02 72.5 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.184 -1.043 . . . . 1.51 108.184 -179.865 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.8 tp -69.62 -40.51 76.55 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 107.128 -1.434 . . . . 0.75 107.128 177.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.656 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.5 t -53.12 -50.25 64.88 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.283 -0.886 . . . . 0.93999999999999995 109.389 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 74.9 m -65.09 -38.26 90.17 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.948 -1.095 . . . . 1.6299999999999999 108.816 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.629 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 43.8 t60 -61.27 -41.95 97.8 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.218 -1.03 . . . . 0.89000000000000001 108.218 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 54.2 mt -62.51 -35.34 79.08 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 106.969 -1.493 . . . . 0.92000000000000004 106.969 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.656 ' HG ' ' O ' ' A' ' 18' ' ' SER . 31.9 mt -65.5 -30.05 70.77 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.643 -1.243 . . . . 1.1699999999999999 107.643 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.465 ' CD1' ' OP2' ' B' ' 109' ' ' ' DA' . 67.8 mt -59.87 -40.11 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 O-C-N 120.102 -1.624 . . . . 1.49 106.64 177.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.407 ' CG ' HG21 ' A' ' 6' ' ' ILE . 77.7 m-70 -72.76 -60.88 2.02 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 118.432 -1.307 . . . . 1.4199999999999999 109.44 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.424 ' O ' ' C ' ' A' ' 26' ' ' ASP . 20.2 m -62.11 -5.7 2.45 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.835 -1.165 . . . . 2.0800000000000001 112.148 -178.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 25' ' ' SER . 65.3 m-20 43.73 63.18 1.66 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.844 -1.16 . . . . 1.45 109.132 -177.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.528 ' C ' HH11 ' A' ' 28' ' ' ARG . 1.8 m -99.4 111.26 23.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.424 -0.797 . . . . 1.45 109.294 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.528 HH11 ' C ' ' A' ' 27' ' ' THR . 1.7 mpt_? -125.45 79.22 67.25 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.47 -0.769 . . . . 1.3700000000000001 110.225 -179.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -78.54 9.08 3.33 Favored 'Trans proline' 0 C--N 1.313 -1.314 0 C-N-CA 122.682 2.255 . . . . 1.2 112.437 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.505 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 60.0 m-85 -117.92 84.94 21.98 Favored Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 121.303 -0.873 . . . . 1.3400000000000001 109.435 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -83.43 143.03 10.85 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.321 2.014 . . . . 1.0700000000000001 112.943 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.478 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -67.15 149.72 50.11 Favored 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 119.298 -0.961 . . . . 0.51000000000000001 109.796 -179.307 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -87.42 -23.54 24.48 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.93 -0.708 . . . . 1.9299999999999999 111.633 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.491 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 5.2 m-85 -102.91 -69.78 0.78 Allowed 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 117.364 -1.734 . . . . 1.23 111.289 -179.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 15.3 p -81.15 -23.34 38.34 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.559 -1.338 . . . . 0.51000000000000001 111.728 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.609 ' O ' ' NH1' ' A' ' 38' ' ' ARG . . . 102.72 -4.33 50.05 Favored Glycine 0 N--CA 1.514 3.855 0 O-C-N 120.201 -1.562 . . . . 0.56000000000000005 116.441 174.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.5 ' C ' ' O ' ' A' ' 36' ' ' GLY . 36.0 mttp -47.14 156.91 0.2 Allowed 'General case' 0 N--CA 1.509 2.489 0 CA-C-N 122.39 3.095 . . . . 1.9199999999999999 108.649 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.609 ' NH1' ' O ' ' A' ' 36' ' ' GLY . 9.6 mmt-85 -111.09 123.54 50.4 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 107.465 -1.309 . . . . 2.9100000000000001 107.465 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.449 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 82.9 m-85 -113.85 164.62 13.52 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.712 -1.242 . . . . 0.68999999999999995 109.889 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.552 ' N ' ' ND1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -103.19 -6.64 21.94 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 116.243 -0.435 . . . . 1.1499999999999999 111.073 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.537 ' N ' ' HD1' ' A' ' 40' ' ' HIS . 85.1 mt-30 -133.33 119.67 20.03 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.538 -1.351 . . . . 1.21 110.201 -179.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.505 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 71.8 tttt -41.61 -61.32 1.1 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.521 -0.737 . . . . 1.24 110.895 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.4 p -53.7 -30.14 42.28 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.254 -0.904 . . . . 1.9199999999999999 111.971 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -76.67 -39.71 51.3 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 117.385 -1.726 . . . . 1.48 107.588 178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.646 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 7.6 tmm? -60.81 -46.72 89.44 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 105.728 -1.953 . . . . 1.0600000000000001 105.728 176.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.511 ' O ' ' OG1' ' A' ' 49' ' ' THR . 59.8 tttp -54.2 -38.0 65.16 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.105 -1.072 . . . . 3.0800000000000001 108.105 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.467 ' O ' HG21 ' A' ' 51' ' ' ILE . 47.5 mtpt -66.47 -32.65 74.14 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 106.582 -1.636 . . . . 1.8 106.582 177.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.674 ' O ' HG12 ' A' ' 51' ' ' ILE . 71.0 t60 -64.74 -60.12 3.47 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 107.016 -1.476 . . . . 0.47999999999999998 107.016 176.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.511 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 54.2 p -47.46 -36.67 10.39 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 120.944 -1.098 . . . . 0.84999999999999998 111.154 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.66 ' HA ' ' HG1' ' A' ' 53' ' ' THR . 3.2 m-85 -69.3 -31.77 70.46 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.633 -1.292 . . . . 0.87 109.666 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 48' ' ' HIS . 3.0 pt -65.21 -32.49 58.49 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.236 0 C-N-CA 118.423 -1.311 . . . . 0.76000000000000001 108.159 177.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.427 ' CE1' ' HB2' ' A' ' 34' ' ' TYR 0.251 60.6 m-70 -77.07 -33.88 57.08 Favored 'General case' 0 N--CA 1.537 3.879 0 O-C-N 120.492 -1.38 . . . . 0.83999999999999997 111.054 177.48 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.66 ' HG1' ' HA ' ' A' ' 50' ' ' PHE . 73.9 p -79.66 -16.68 55.31 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 106.17 -1.789 . . . . 1.3100000000000001 106.17 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 67.58 68.98 1.48 Allowed Glycine 0 C--O 1.203 -1.831 0 N-CA-C 104.396 -3.481 . . . . 1.0900000000000001 104.396 -174.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.443 ' OE1' ' CD1' ' A' ' 50' ' ' PHE . 50.1 mt-10 -120.91 128.48 52.82 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.449 -0.945 . . . . 1.9199999999999999 108.449 -179.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.9 mmtm -133.36 79.03 61.9 Favored Pre-proline 0 C--N 1.297 -1.702 0 C-N-CA 119.938 -0.705 . . . . 1.8400000000000001 109.335 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.87 0.9 5.05 Favored 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 122.158 1.905 . . . . 0.82999999999999996 112.801 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.501 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 97.1 m-70 -112.85 89.86 3.19 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.101 -1.0 . . . . 0.81000000000000005 108.851 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.434 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 62.3 mttp -94.5 133.43 38.12 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.092 -1.005 . . . . 2.2799999999999998 112.268 -177.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.35 117.81 21.44 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 106.821 -1.548 . . . . 0.39000000000000001 106.821 176.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.434 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 22.0 mm-40 -84.19 12.64 6.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.56 -0.713 . . . . 2.8599999999999999 109.221 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.7 t -98.03 -65.67 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.888 0 C-N-CA 120.044 -0.662 . . . . 0.95999999999999996 111.088 -179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.2 p -107.26 -7.62 16.68 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.504 -0.878 . . . . 0.58999999999999997 113.179 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 111.25 -11.78 28.76 Favored Glycine 0 N--CA 1.515 3.963 0 C-N-CA 118.437 -1.84 . . . . 0.56999999999999995 113.884 176.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -78.58 169.11 18.77 Favored 'General case' 0 N--CA 1.509 2.515 0 CA-C-N 120.171 1.986 . . . . 1.3999999999999999 111.526 -177.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -138.42 150.67 46.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.374 -0.829 . . . . 1.1200000000000001 109.487 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.56 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 35.9 m-85 -133.31 152.38 51.92 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 122.482 1.134 . . . . 0.56999999999999995 112.794 -177.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.9 p -81.62 -29.94 33.04 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 115.055 -0.975 . . . . 2.1099999999999999 108.537 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -117.28 146.91 43.0 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 122.114 0.959 . . . . 1.7 111.604 -178.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.45 ' O ' HG13 ' A' ' 74' ' ' ILE . 6.1 m -65.96 -44.07 86.06 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 118.792 -1.163 . . . . 1.6399999999999999 107.937 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 t -49.13 -42.49 39.52 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.149 -0.969 . . . . 2.3700000000000001 109.136 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.8 m-20 -71.48 -33.71 69.53 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 117.673 -1.611 . . . . 0.84999999999999998 108.096 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.1 tp -64.62 -52.43 57.51 Favored 'General case' 0 N--CA 1.504 2.23 0 N-CA-C 106.182 -1.784 . . . . 1.1200000000000001 106.182 175.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 70' ' ' SER . 45.1 mt -52.13 -55.52 9.72 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 O-C-N 121.135 -0.978 . . . . 1.55 110.865 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.0 m -59.63 -41.52 90.63 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 119.778 -1.826 . . . . 1.23 107.725 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.56 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 42.0 t60 -62.04 -45.42 93.65 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.951 0.881 . . . . 0.41999999999999998 109.726 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 38.8 t -68.11 -32.89 73.51 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.003 -1.11 . . . . 1.04 108.003 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -61.04 -38.79 87.4 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.768 -1.197 . . . . 1.99 107.768 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -44.86 95.03 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 118.185 -1.406 . . . . 2.3799999999999999 107.331 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -57.83 -53.37 58.98 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 118.014 -1.474 . . . . 0.65000000000000002 109.273 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 56.5 p -58.85 -48.02 82.85 Favored 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 118.391 -1.323 . . . . 1.6299999999999999 108.999 -177.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.041 0 C-N-CA 118.948 -1.596 . . . . 1.8500000000000001 109.797 179.102 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.805 0 C4'-C3'-C2' 104.739 1.539 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' ' DA' . . . . . 0.546 ' C2 ' ' C2 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.424 -1.998 0 C4'-C3'-C2' 104.847 1.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' ' DT' . . . . . 0.546 ' C2 ' ' C2 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.833 0 C1'-O4'-C4' 106.48 -2.3 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' ' DA' . . . . . 0.584 ' C6 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.174 0 O4'-C4'-C3' 107.26 1.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' ' DA' . . . . . 0.584 ' C6 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.072 0 C1'-O4'-C4' 107.569 -1.522 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.558 ' C6 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.653 0 O4'-C4'-C3' 107.737 2.137 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.071 0 C1'-O4'-C4' 106.28 -2.443 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.943 0 C1'-O4'-C4' 107.308 -1.709 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' ' DA' . . . . . 0.539 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.532 1.42 0 N19-C1'-C2' 117.193 1.87 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' ' DC' . . . . . 0.539 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.953 0 P-O3'-C3' 121.761 1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' ' DT' . . . . . 0.478 ' O2 ' ' N2 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.19 0 C4'-C3'-C2' 104.809 1.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' ' DG' . . . . . 0.521 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.853 0 O4'-C4'-C3' 107.02 1.42 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.521 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.145 0 O4'-C4'-C3' 107.297 1.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.008 0 C1'-O4'-C4' 107.58 -1.514 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.812 0 C1'-O4'-C4' 107.156 -1.817 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.95 0 O4'-C4'-C3' 107.402 1.802 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.852 0 O4'-C4'-C3' 107.143 1.543 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.778 0 C4'-C3'-C2' 104.89 1.69 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.018 0 C1'-O4'-C4' 107.254 -1.747 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.992 0 C1'-O4'-C4' 107.071 -1.878 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.692 0 O4'-C4'-C3' 107.351 1.751 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.926 0 O4'-C4'-C3' 107.259 1.659 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 207' ' ' ' DG' . . . . . 0.478 ' N2 ' ' O2 ' ' B' ' 111' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.901 0 O4'-C4'-C3' 107.286 1.686 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.202 0 C1'-O4'-C4' 107.384 -1.654 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 209' ' ' ' DG' . . . . . 0.45 ' OP2' ' CB ' ' A' ' 70' ' ' SER . . . . . . . . 0 C5'--C4' 1.525 1.771 0 O4'-C4'-C3' 107.558 1.958 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 210' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.789 0 O4'-C4'-C3' 107.302 1.702 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 211' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.801 0 C1'-O4'-C4' 106.074 -2.59 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.896 0 C1'-O4'-C4' 106.578 -2.23 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.014 0 C1'-O4'-C4' 106.861 -2.028 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 214' ' ' ' DA' . . . . . 0.519 ' C2 ' ' C2 ' ' C' ' 215' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.91 0 O4'-C4'-C3' 107.191 1.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 215' ' ' ' DT' . . . . . 0.519 ' C2 ' ' C2 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.02 0 C1'-O4'-C4' 107.294 -1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.944 0 O4'-C4'-C3' 107.172 1.572 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.5 t . . . . . 0 N--CA 1.488 1.471 0 N-CA-C 109.323 -0.621 . . . . 3.0699999999999998 109.323 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -109.97 125.51 52.94 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.188 -0.945 . . . . 1.97 109.633 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -109.18 144.91 36.64 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 122.474 1.13 . . . . 2.6000000000000001 111.579 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -84.69 127.93 34.35 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.03 -0.986 . . . . 2.3700000000000001 109.998 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.8 mttp -94.97 37.24 1.16 Allowed 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.207 -0.933 . . . . 2.6400000000000001 109.455 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.524 ' HB ' ' CD2' ' A' ' 24' ' ' HIS . 12.8 mm -131.5 -26.75 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.488 -1.382 . . . . 2.8199999999999998 112.345 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.4 p -136.78 -35.6 0.71 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.6 -1.312 . . . . 3.0299999999999998 110.233 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.04 46.08 0.39 Allowed Glycine 0 N--CA 1.509 3.504 0 O-C-N 120.553 -1.342 . . . . 3.1000000000000001 113.549 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -136.89 159.62 41.33 Favored 'General case' 0 N--CA 1.511 2.618 0 CA-C-N 119.286 1.543 . . . . 3.52 110.611 177.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.9 p -116.76 154.5 30.54 Favored 'General case' 0 N--CA 1.512 2.671 0 N-CA-C 113.913 1.079 . . . . 3.1400000000000001 113.913 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -131.81 131.75 43.15 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-O 122.144 0.973 . . . . 2.3799999999999999 111.746 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.643 ' H ' ' NH1' ' A' ' 13' ' ' ARG . 37.2 mmtm -74.61 -22.56 58.88 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 122.187 0.994 . . . . 4.2699999999999996 109.259 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.643 ' NH1' ' H ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -118.21 136.12 53.84 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 115.172 -0.922 . . . . 3.48 111.39 -177.239 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 t -65.2 -34.34 78.15 Favored 'General case' 0 C--O 1.195 -1.809 0 C-N-CA 118.379 -1.328 . . . . 1.53 108.917 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 p -59.37 -37.48 78.0 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.318 -1.489 . . . . 1.8200000000000001 109.718 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.513 HG21 ' OP2' ' B' ' 110' ' ' ' DC' . 29.8 m -73.77 -29.83 62.43 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.622 -1.298 . . . . 2.1699999999999999 107.612 178.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.1 tp -72.45 -50.39 26.53 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 106.239 -1.764 . . . . 1.5600000000000001 106.239 176.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.663 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 75.8 m -49.04 -61.27 2.16 Favored 'General case' 0 C--N 1.289 -2.044 0 O-C-N 120.835 -1.166 . . . . 1.8500000000000001 109.071 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 27.3 m -52.78 -36.38 58.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.039 -1.038 . . . . 1.52 109.094 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -68.16 -44.76 75.25 Favored 'General case' 0 C--N 1.294 -1.807 0 O-C-N 121.303 -0.873 . . . . 2.1800000000000002 109.17 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.0 mt -60.71 -29.25 69.23 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 105.532 -2.025 . . . . 2.0800000000000001 105.532 177.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 18' ' ' SER . 27.3 mt -71.22 -27.34 63.41 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.745 -1.205 . . . . 1.1599999999999999 107.745 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.546 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 66.8 mt -62.57 -44.4 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 120.086 -1.634 . . . . 2.1499999999999999 108.268 178.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.524 ' CD2' ' HB ' ' A' ' 6' ' ' ILE . 77.2 m-70 -69.84 -59.35 2.99 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.455 -1.298 . . . . 2.4199999999999999 108.99 177.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.4 m -58.5 -12.39 3.92 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.664 -1.272 . . . . 2.1099999999999999 110.783 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.546 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 5.0 m-20 50.19 57.94 6.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.652 -0.655 . . . . 1.5800000000000001 109.614 -178.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.8 m -90.42 105.66 17.97 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.31 -0.869 . . . . 2.9700000000000002 109.596 179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -122.74 80.56 48.78 Favored Pre-proline 0 N--CA 1.497 1.918 0 O-C-N 121.256 -0.902 . . . . 3.46 109.63 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -84.0 15.76 2.07 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 123.114 2.543 . . . . 1.71 114.361 -179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.493 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 85.8 m-85 -118.86 86.53 30.98 Favored Pre-proline 0 N--CA 1.501 2.114 0 O-C-N 120.963 -1.086 . . . . 1.6599999999999999 108.476 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -82.93 128.85 5.24 Favored 'Trans proline' 0 C--N 1.31 -1.469 0 C-N-CA 122.739 2.293 . . . . 1.3100000000000001 112.844 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.586 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 0.4 OUTLIER -47.94 142.6 4.84 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 122.426 1.108 . . . . 1.0 109.722 178.879 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.439 ' CD ' ' N ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.9 -11.83 57.87 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.549 -0.751 . . . . 2.2999999999999998 109.925 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.572 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 22.9 m-85 -118.13 -73.88 0.63 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.429 -1.42 . . . . 1.3300000000000001 111.168 -179.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.575 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 14.2 p -84.02 19.48 1.76 Allowed 'General case' 0 N--CA 1.515 2.813 0 CA-C-O 121.889 0.852 . . . . 1.04 110.242 -179.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.482 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 42.87 10.42 0.01 OUTLIER Glycine 0 N--CA 1.503 3.123 0 CA-C-N 114.095 -1.411 . . . . 1.1699999999999999 114.407 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.586 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 69.6 tttt -52.42 172.84 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 121.977 2.888 . . . . 2.6899999999999999 105.698 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.5 mtp85 -131.03 142.1 50.28 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 119.427 -2.046 . . . . 2.7400000000000002 110.683 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.489 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 60.0 m-85 -126.6 167.47 15.62 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.748 -0.834 . . . . 1.1599999999999999 108.748 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.623 ' O ' ' ND1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -100.59 -24.2 14.5 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.859 -0.526 . . . . 1.95 111.239 -178.764 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.456 ' O ' ' C ' ' A' ' 42' ' ' LYS . 46.8 mt-30 -118.02 116.8 27.62 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.277 -1.515 . . . . 2.3700000000000001 111.607 -178.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.658 ' HZ3' ' NZ ' ' A' ' 46' ' ' LYS . 62.6 tttm -34.02 -66.2 0.17 Allowed 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.058 -1.026 . . . . 2.79 112.32 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 93.4 p -48.62 -31.2 6.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.971 -1.081 . . . . 1.7 110.366 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.449 ' N ' ' O ' ' A' ' 41' ' ' GLN . 96.7 m-20 -70.09 -44.07 69.81 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.66 -1.275 . . . . 1.3100000000000001 107.652 177.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.549 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 18.9 ttp -64.98 -46.16 82.63 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 120.696 -1.252 . . . . 1.6299999999999999 107.976 177.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.658 ' NZ ' ' HZ3' ' A' ' 42' ' ' LYS . 5.3 tppt? -53.31 -37.96 62.72 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.367 -1.346 . . . . 2.9199999999999999 107.367 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.569 ' O ' HG22 ' A' ' 51' ' ' ILE . 9.4 mtpt -64.25 -33.18 75.23 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 106.25 -1.759 . . . . 3.2200000000000002 106.25 177.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.694 ' O ' HG12 ' A' ' 51' ' ' ILE . 58.7 t60 -69.06 -62.61 1.31 Allowed 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 107.702 -1.221 . . . . 0.90000000000000002 107.702 177.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.431 ' C ' ' O ' ' A' ' 48' ' ' HIS . 75.8 p -43.61 -36.05 1.98 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 120.639 -1.288 . . . . 1.3899999999999999 110.329 178.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.619 ' CZ ' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-30 -68.59 -32.45 72.36 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 108.416 -0.957 . . . . 1.21 108.416 179.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.694 HG12 ' O ' ' A' ' 48' ' ' HIS . 7.1 pt -64.6 -31.81 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 C-N-CA 118.058 -1.457 . . . . 0.93999999999999995 108.846 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 -77.74 -33.47 52.91 Favored 'General case' 0 N--CA 1.521 3.079 0 O-C-N 120.729 -1.232 . . . . 0.84999999999999998 110.404 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.5 p -87.54 -6.98 58.1 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.92 0.867 . . . . 1.47 109.66 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 52.71 69.84 1.08 Allowed Glycine 0 C--N 1.292 -1.881 0 N-CA-C 106.139 -2.784 . . . . 0.66000000000000003 106.139 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.619 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 33.0 mt-10 -115.24 130.1 56.82 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 105.319 -2.104 . . . . 1.97 105.319 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.7 mttm -138.74 80.98 23.99 Favored Pre-proline 0 C--N 1.304 -1.373 0 O-C-N 120.911 -1.118 . . . . 2.8100000000000001 110.467 -177.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -73.31 13.7 0.66 Allowed 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.863 2.375 . . . . 0.92000000000000004 112.615 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -116.2 83.44 1.95 Allowed 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.045 -1.035 . . . . 1.3899999999999999 110.064 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -87.18 138.41 31.51 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.122 -0.986 . . . . 2.2200000000000002 111.434 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.572 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -99.27 120.05 38.92 Favored 'General case' 0 C--N 1.289 -2.053 0 N-CA-C 107.383 -1.34 . . . . 1.03 107.383 177.537 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -85.36 16.46 3.69 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 108.619 -0.882 . . . . 2.73 108.619 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.572 ' HB ' ' SG ' ' A' ' 60' ' ' CYS . 20.1 t -95.25 -57.16 4.58 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.746 0 CA-C-O 121.622 0.725 . . . . 1.6200000000000001 109.151 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.8 p -115.16 -7.65 12.42 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.495 -0.753 . . . . 0.97999999999999998 111.775 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.4 -3.42 56.51 Favored Glycine 0 N--CA 1.509 3.503 0 O-C-N 120.143 -1.598 . . . . 0.71999999999999997 112.779 177.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.7 tttp -84.26 153.44 23.57 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.266 -1.726 . . . . 2.8100000000000001 111.885 -177.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -121.03 145.09 48.14 Favored 'General case' 0 N--CA 1.514 2.768 0 O-C-N 121.753 -0.592 . . . . 1.29 110.935 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.434 ' HZ ' ' CE1' ' A' ' 76' ' ' HIS . 31.3 m-85 -128.05 161.85 28.22 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 122.128 0.966 . . . . 1.8899999999999999 112.689 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.9 t -84.86 -35.7 22.05 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 115.536 -0.756 . . . . 2.0299999999999998 110.239 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -113.87 141.69 47.02 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 120.929 -1.107 . . . . 2.8500000000000001 110.746 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.5 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.4 OUTLIER -63.04 -46.23 88.53 Favored 'General case' 0 C--O 1.202 -1.414 0 N-CA-C 108.03 -1.1 . . . . 2.9399999999999999 108.03 178.219 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.457 ' C ' ' O ' ' A' ' 70' ' ' SER . 91.9 p -44.16 -39.59 4.43 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.023 -1.048 . . . . 2.8799999999999999 108.695 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -76.29 -32.97 59.07 Favored 'General case' 0 C--N 1.293 -1.856 0 C-N-CA 118.783 -1.167 . . . . 2.4199999999999999 108.721 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.5 ' N ' ' O ' ' A' ' 70' ' ' SER . 26.4 tp -70.33 -53.36 17.02 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 106.491 -1.67 . . . . 2.0299999999999998 106.491 175.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.506 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 86.9 mt -46.97 -54.58 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 O-C-N 121.029 -1.045 . . . . 3.1699999999999999 109.065 177.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.512 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 21.1 m -60.06 -46.64 88.89 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-O 122.539 1.161 . . . . 3.5499999999999998 108.97 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.434 ' CE1' ' HZ ' ' A' ' 67' ' ' PHE . 26.4 t60 -56.02 -48.07 76.62 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.655 -0.702 . . . . 2.3500000000000001 109.613 -179.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -33.02 73.56 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 119.932 -1.73 . . . . 2.4399999999999999 107.621 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.512 ' HB2' ' O ' ' A' ' 75' ' ' THR . 35.0 mtp85 -54.34 -31.32 54.1 Favored 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 105.985 -1.857 . . . . 5.4500000000000002 105.985 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -73.46 -49.89 24.48 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.223 -0.991 . . . . 3.5499999999999998 108.765 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 61.5 m-70 -56.23 -61.67 2.23 Favored 'General case' 0 N--CA 1.501 2.08 0 C-N-CA 116.841 -1.943 . . . . 2.4700000000000002 108.785 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 31.7 m -57.57 -53.1 61.99 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.264 -1.013 . . . . 3.48 108.264 -179.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.514 0 N-CA-C 109.363 -1.495 . . . . 3.75 109.363 179.862 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.773 0 C4'-C3'-C2' 104.834 1.634 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.077 0 C4'-C3'-C2' 104.823 1.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' ' DT' . . . . . 0.424 ' O4 ' ' O4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.678 0 C1'-O4'-C4' 105.899 -2.715 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' ' DA' . . . . . 0.509 ' C2 ' ' C4 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.919 0 C1'-O4'-C4' 107.581 -1.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' ' DA' . . . . . 0.509 ' C4 ' ' C2 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 P--O5' 1.612 1.93 0 O4'-C4'-C3' 107.177 1.577 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.54 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.745 0 C1'-O4'-C4' 107.039 -1.901 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' ' DT' . . . . . 0.442 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.099 0 C1'-O4'-C4' 106.012 -2.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.912 0 O4'-C4'-C3' 107.113 1.513 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' ' DA' . . . . . 0.571 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.576 0 C3'-C2'-C1' 99.961 -1.956 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' ' DC' . . . . . 0.571 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.657 0 P-O3'-C3' 122.011 1.926 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.536 1.812 0 C1'-O4'-C4' 107.16 -1.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' ' DG' . . . . . 0.608 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.723 0 O4'-C4'-C3' 107.454 1.854 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.608 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.814 0 C4'-C3'-C2' 104.787 1.587 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 C4'-C3'-C2' 105.09 1.89 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.744 0 O4'-C4'-C3' 107.222 1.622 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.06 0 O4'-C4'-C3' 107.449 1.849 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 201' ' ' ' DT' . . . . . 0.531 ' C2 ' ' N7 ' ' C' ' 202' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.85 0 O4'-C4'-C3' 107.217 1.617 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 202' ' ' ' DA' . . . . . 0.531 ' N7 ' ' C2 ' ' C' ' 201' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.087 0 O4'-C4'-C3' 107.433 1.833 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 203' ' ' ' DG' . . . . . 0.513 ' N2 ' ' N3 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.794 0 C4'-C3'-C2' 104.871 1.671 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 204' ' ' ' DG' . . . . . 0.513 ' N3 ' ' N2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.777 0 C1'-O4'-C4' 107.019 -1.915 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.992 0 C4'-C3'-C2' 104.904 1.704 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.824 0 O4'-C4'-C3' 107.47 1.87 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 207' ' ' ' DG' . . . . . 0.404 ' O6 ' ' N6 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.732 0 C4'-C3'-C2' 104.774 1.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.199 0 C4'-C3'-C2' 104.885 1.685 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 209' ' ' ' DG' . . . . . 0.445 ' C6 ' ' C6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.96 0 O4'-C4'-C3' 107.067 1.467 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 210' ' ' ' DA' . . . . . 0.54 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.71 0 O4'-C4'-C3' 107.314 1.714 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 211' ' ' ' DT' . . . . . 0.41 ' C4 ' ' C6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.425 -1.868 0 C1'-O4'-C4' 106.085 -2.582 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.934 0 C1'-O4'-C4' 107.147 -1.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 213' ' ' ' DT' . . . . . 0.424 ' O4 ' ' O4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.588 0 C4'-C3'-C2' 104.779 1.579 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 214' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.863 0 O4'-C4'-C3' 107.299 1.699 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.052 0 C1'-O4'-C4' 107.111 -1.849 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.926 0 O4'-C4'-C3' 107.272 1.672 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.8 m . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 109.484 -0.562 . . . . 3.1200000000000001 109.484 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.538 ' CE1' ' N ' ' A' ' 14' ' ' SER . 0.9 OUTLIER -99.29 125.09 44.85 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.011 -1.056 . . . . 2.25 108.517 179.627 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -107.53 135.61 48.7 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 122.539 1.161 . . . . 2.25 112.33 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.676 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 4.1 t -60.5 121.35 11.91 Favored 'General case' 0 N--CA 1.499 2.021 0 CA-C-N 114.625 -1.171 . . . . 1.74 109.432 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.7 mttp -94.8 28.5 2.67 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.204 -0.935 . . . . 2.7799999999999998 108.828 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.3 mm -128.86 -63.38 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 N-CA-C 107.538 -1.282 . . . . 2.4700000000000002 107.538 -178.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.636 ' N ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -126.4 45.98 2.55 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 124.015 1.864 . . . . 2.54 110.0 179.29 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 20.45 60.73 0.01 OUTLIER Glycine 0 CA--C 1.568 3.403 0 N-CA-C 121.525 3.37 . . . . 2.5600000000000001 121.525 172.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.676 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 9.9 ttmm -115.07 139.89 49.5 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 105.663 -1.977 . . . . 2.79 105.663 171.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.3 t -93.52 145.05 24.8 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-O 122.438 1.113 . . . . 2.9500000000000002 112.715 -177.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.49 ' HZ ' ' ND1' ' A' ' 20' ' ' HIS . 77.3 m-85 -127.16 130.27 49.46 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.912 0.863 . . . . 2.1400000000000001 110.204 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -68.92 -27.93 66.21 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.948 -0.76 . . . . 3.8399999999999999 108.948 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 13' ' ' ARG . 0.4 OUTLIER -121.65 140.51 52.18 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 121.699 0.762 . . . . 3.7799999999999998 109.624 -178.928 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.538 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 0.6 OUTLIER -60.2 -32.73 71.37 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 118.042 -1.463 . . . . 2.1800000000000002 108.088 179.202 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.506 ' HG ' ' H ' ' A' ' 16' ' ' THR . 97.5 p -55.7 -60.95 2.72 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.192 -0.942 . . . . 2.73 109.069 -178.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.506 ' H ' ' HG ' ' A' ' 15' ' ' SER . 23.0 m -53.36 -32.12 47.82 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.517 -0.92 . . . . 2.7200000000000002 108.517 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 tp -72.08 -39.72 68.76 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 118.077 -1.449 . . . . 1.52 107.657 177.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.709 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 58.6 m -53.01 -50.86 63.36 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.965 -1.084 . . . . 1.7 108.479 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.3 m -59.57 -36.63 76.58 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.975 0.893 . . . . 2.6800000000000002 108.876 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.49 ' ND1' ' HZ ' ' A' ' 11' ' ' PHE . 23.4 t60 -69.01 -38.38 79.2 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 107.552 -1.277 . . . . 1.1499999999999999 107.552 179.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.423 ' O ' ' N ' ' A' ' 24' ' ' HIS . 87.3 mt -67.41 -38.4 84.54 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 119.853 -1.78 . . . . 1.51 106.397 177.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.709 ' HG ' ' O ' ' A' ' 18' ' ' SER . 28.9 mt -56.17 -35.35 67.12 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 105.953 -1.869 . . . . 2.3599999999999999 105.953 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.464 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 82.3 mt -61.07 -31.41 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 N-CA-C 107.256 -1.387 . . . . 1.1799999999999999 107.256 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.423 ' N ' ' O ' ' A' ' 21' ' ' LEU . 87.8 m-70 -88.4 -19.51 26.49 Favored 'General case' 0 N--CA 1.514 2.774 0 C-N-CA 118.472 -1.291 . . . . 2.0699999999999998 111.231 179.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.417 ' O ' ' C ' ' A' ' 26' ' ' ASP . 61.1 m -101.16 3.76 41.41 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 107.441 -1.318 . . . . 2.8100000000000001 107.441 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.576 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 0.1 OUTLIER 41.03 53.97 3.31 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.875 -0.787 . . . . 1.96 108.875 -179.218 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.426 ' O ' ' HD3' ' A' ' 28' ' ' ARG . 1.3 m -97.3 110.74 23.23 Favored 'General case' 0 N--CA 1.485 1.285 0 O-C-N 121.528 -0.732 . . . . 2.77 109.393 -179.123 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.426 ' HD3' ' O ' ' A' ' 27' ' ' THR . 19.2 mmt180 -129.51 63.33 67.47 Favored Pre-proline 0 N--CA 1.49 1.538 0 N-CA-C 107.996 -1.113 . . . . 3.1400000000000001 107.996 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -72.56 17.63 0.36 Allowed 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 121.803 1.669 . . . . 1.55 113.973 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -113.72 80.85 5.28 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 120.876 -1.14 . . . . 1.3500000000000001 108.991 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.34 131.54 8.66 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 C-N-CA 122.109 1.873 . . . . 2.2799999999999998 113.888 -178.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.429 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -58.94 149.29 27.58 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 121.696 0.76 . . . . 2.29 109.868 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -82.34 -15.44 52.85 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.77 -0.581 . . . . 4.2800000000000002 112.45 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.545 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 3.9 m-85 -113.95 -50.67 2.81 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.224 -1.548 . . . . 2.8799999999999999 113.37 -178.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 16.1 p -103.72 7.09 37.25 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.487 -1.383 . . . . 3.0299999999999998 111.16 -177.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.542 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 73.85 -1.6 45.7 Favored Glycine 0 N--CA 1.492 2.427 0 O-C-N 121.29 -0.881 . . . . 2.8700000000000001 114.312 176.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.542 ' O ' ' O ' ' A' ' 36' ' ' GLY . 11.8 mttp -41.89 166.0 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.212 0 CA-C-N 120.679 2.24 . . . . 3.4199999999999999 108.85 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.404 ' HE ' ' N ' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -128.81 133.13 47.93 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.401 -0.963 . . . . 3.7799999999999998 108.401 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -126.71 174.34 8.81 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.34 -0.85 . . . . 1.6100000000000001 109.255 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.573 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -115.36 -7.26 12.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 122.0 -0.437 . . . . 2.0699999999999998 110.505 -179.383 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.416 ' O ' ' C ' ' A' ' 42' ' ' LYS . 85.0 mt-30 -132.13 124.0 28.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.694 -1.254 . . . . 2.6200000000000001 109.358 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.416 ' C ' ' O ' ' A' ' 41' ' ' GLN . 84.6 tttt -42.05 -65.15 0.49 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.129 -0.982 . . . . 2.5299999999999998 110.257 -178.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.8 p -49.2 -32.98 11.39 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.733 -0.604 . . . . 1.3400000000000001 111.101 -178.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.2 -48.63 70.01 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.752 -1.217 . . . . 1.8999999999999999 107.744 177.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.533 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 10.8 tmm? -62.84 -46.84 86.05 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.472 -1.392 . . . . 1.5700000000000001 108.617 177.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.499 ' O ' ' OG1' ' A' ' 49' ' ' THR . 35.1 mmtt -53.34 -41.21 65.53 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 120.87 -1.144 . . . . 2.4700000000000002 108.711 -178.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -63.51 -32.82 74.38 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.168 -1.419 . . . . 2.0 107.168 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.691 ' O ' HG12 ' A' ' 51' ' ' ILE . 47.0 t60 -68.66 -61.25 1.9 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.896 -1.52 . . . . 2.0099999999999998 106.896 176.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.507 ' O ' HG21 ' A' ' 53' ' ' THR . 24.1 p -41.9 -34.77 0.72 Allowed 'General case' 0 N--CA 1.486 1.35 0 O-C-N 120.323 -1.485 . . . . 1.26 109.281 178.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.586 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 5.2 m-30 -69.26 -32.27 71.35 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.806 -1.184 . . . . 0.97999999999999998 108.918 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.691 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.0 pt -61.85 -34.16 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 C-N-CA 118.318 -1.353 . . . . 2.1099999999999999 107.72 175.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -75.07 -27.72 60.06 Favored 'General case' 0 N--CA 1.51 2.548 0 C-N-CA 117.775 -1.57 . . . . 2.4199999999999999 109.309 176.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.586 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 68.1 p -91.53 -2.06 57.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.16 -0.962 . . . . 1.9399999999999999 110.279 -177.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.36 17.89 2.07 Favored Glycine 0 N--CA 1.502 3.038 0 N-CA-C 109.944 -1.262 . . . . 1.2 109.944 -177.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.611 ' O ' ' C ' ' A' ' 56' ' ' LYS . 77.4 mt-10 -75.74 20.27 0.18 Allowed 'General case' 0 N--CA 1.506 2.339 0 N-CA-C 115.836 1.791 . . . . 1.27 115.836 -176.092 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.611 ' C ' ' O ' ' A' ' 55' ' ' GLU . 3.0 mptp? -24.57 96.81 0.06 OUTLIER Pre-proline 0 N--CA 1.508 2.457 0 O-C-N 121.058 -1.026 . . . . 1.77 110.867 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.448 ' N ' ' O ' ' A' ' 55' ' ' GLU . 2.4 Cg_endo -78.86 -19.84 10.75 Favored 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 122.971 2.447 . . . . 0.81999999999999995 112.431 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -81.65 102.65 10.82 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.908 -1.145 . . . . 0.83999999999999997 107.908 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.672 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 86.5 mttt -104.55 118.02 35.55 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.915 -1.115 . . . . 1.54 111.595 -177.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 26.8 t -83.71 125.37 31.81 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.229 -0.919 . . . . 1.1100000000000001 108.739 178.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.672 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 1.1 mm-40 -96.92 13.82 27.52 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.212 -0.93 . . . . 2.5499999999999998 111.26 -177.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.467 ' HB ' ' CD2' ' A' ' 80' ' ' HIS . 97.1 t -87.13 -34.88 7.85 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.086 0 N-CA-C 106.338 -1.727 . . . . 1.8100000000000001 106.338 178.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 26.6 p -123.58 -30.13 3.66 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 114.846 -1.07 . . . . 1.5900000000000001 108.261 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.02 13.51 31.33 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 111.16 -0.776 . . . . 1.26 111.16 178.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -97.33 132.77 42.75 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.283 -1.716 . . . . 2.6000000000000001 111.206 -177.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.19 148.24 23.07 Favored 'General case' 0 N--CA 1.508 2.456 0 CA-C-O 122.227 1.013 . . . . 1.24 113.685 -177.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.442 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 88.5 m-85 -128.92 151.13 49.98 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.992 0.901 . . . . 0.84999999999999998 111.534 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.421 ' OG ' ' HG3' ' A' ' 69' ' ' GLN . 16.9 p -86.63 -10.35 54.04 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 115.798 -0.637 . . . . 1.3400000000000001 109.768 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.556 ' NE2' ' N7 ' ' B' ' 105' ' ' ' DA' . 56.5 mt-30 -132.31 142.97 49.56 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.249 -0.907 . . . . 1.75 111.146 -177.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.664 ' HG ' ' N ' ' A' ' 71' ' ' SER . 51.7 p -66.51 -44.48 82.42 Favored 'General case' 0 C--O 1.198 -1.638 0 N-CA-C 107.174 -1.417 . . . . 1.4099999999999999 107.174 177.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.664 ' N ' ' HG ' ' A' ' 70' ' ' SER . 23.2 t -52.41 -42.59 64.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.231 -0.918 . . . . 1.8899999999999999 109.915 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.415 ' O ' ' HB3' ' A' ' 76' ' ' HIS . 2.9 m-20 -70.16 -30.29 67.4 Favored 'General case' 0 C--N 1.298 -1.674 0 C-N-CA 118.084 -1.446 . . . . 1.3500000000000001 107.913 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.9 tp -73.49 -42.1 62.27 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.941 -1.133 . . . . 0.89000000000000001 107.941 177.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 90.7 mt -59.67 -53.63 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 O-C-N 120.826 -1.171 . . . . 1.76 109.111 179.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 2.5 m -63.97 -48.98 74.33 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 122.374 1.083 . . . . 1.3999999999999999 108.746 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.442 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 15.8 t60 -51.65 -45.47 63.38 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 123.079 1.418 . . . . 1.0600000000000001 107.852 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 44.8 t -67.23 -35.61 79.93 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 120.581 -1.324 . . . . 1.8300000000000001 108.288 178.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 82' ' ' GLY . 2.2 mmm180 -55.81 -35.14 66.0 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 106.986 -1.487 . . . . 2.7999999999999998 106.986 178.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -63.98 -44.37 92.9 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.193 -1.403 . . . . 1.7 108.061 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.467 ' CD2' ' HB ' ' A' ' 62' ' ' VAL . 68.5 m-70 -57.44 -62.61 1.65 Allowed 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 116.139 -2.225 . . . . 1.52 108.304 178.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.446 ' O ' ' C ' ' A' ' 82' ' ' GLY . 29.4 p -80.19 21.48 0.59 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.516 -0.74 . . . . 1.6799999999999999 109.509 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.494 2.548 0 N-CA-C 109.796 -1.321 . . . . 2.6000000000000001 109.796 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.952 0 C4'-C3'-C2' 104.847 1.647 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' ' DA' . . . . . 0.523 ' N6 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.743 0 O4'-C4'-C3' 107.19 1.59 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' ' DT' . . . . . 0.532 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.777 0 C1'-O4'-C4' 106.553 -2.248 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' ' DA' . . . . . 0.532 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.922 0 O4'-C4'-C3' 107.109 1.509 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' ' DA' . . . . . 0.556 ' N7 ' ' NE2' ' A' ' 69' ' ' GLN . . . . . . . . 0 C5'--C4' 1.528 2.087 0 O4'-C4'-C3' 107.096 1.496 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.56 ' C6 ' ' C4 ' ' B' ' 107' ' ' ' DT' . . . . . . . . 0 P--O5' 1.61 1.749 0 C1'-O4'-C4' 106.975 -1.946 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' ' DT' . . . . . 0.56 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.878 0 C1'-O4'-C4' 106.034 -2.619 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.874 0 C1'-O4'-C4' 107.005 -1.925 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' ' DA' . . . . . 0.561 ' C2 ' ' N2 ' ' C' ' 209' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.459 0 N19-C1'-C2' 116.841 1.651 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' ' DC' . . . . . 0.515 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.059 0 C1'-O4'-C4' 107.453 -1.605 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.975 0 C1'-O4'-C4' 107.282 -1.727 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' ' DG' . . . . . 0.553 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.723 0 O4'-C4'-C3' 107.359 1.759 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.553 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.932 0 O4'-C4'-C3' 107.079 1.479 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.153 0 C1'-O4'-C4' 107.66 -1.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.991 0 C1'-O4'-C4' 107.374 -1.662 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.867 0 O4'-C4'-C3' 107.207 1.607 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.864 0 O4'-C4'-C3' 107.165 1.565 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.93 0 C4'-C3'-C2' 104.809 1.609 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.789 0 O4'-C4'-C3' 107.324 1.724 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.861 0 C1'-O4'-C4' 107.401 -1.642 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.976 0 C1'-O4'-C4' 107.549 -1.537 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.81 0 O4'-C4'-C3' 107.295 1.695 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.783 0 C1'-O4'-C4' 107.613 -1.491 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.772 0 C1'-O4'-C4' 107.426 -1.624 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 209' ' ' ' DG' . . . . . 0.561 ' N2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.74 0 O4'-C4'-C3' 107.242 1.642 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 210' ' ' ' DA' . . . . . 0.545 ' C2 ' ' C2 ' ' C' ' 211' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.728 0 O4'-C4'-C3' 107.274 1.674 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 211' ' ' ' DT' . . . . . 0.545 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.423 -2.124 0 C1'-O4'-C4' 106.344 -2.397 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.714 0 C1'-O4'-C4' 106.925 -1.982 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 213' ' ' ' DT' . . . . . 0.406 ' O4 ' ' O4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.883 0 O4'-C4'-C3' 107.199 1.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 214' ' ' ' DA' . . . . . 0.523 ' N6 ' ' N6 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.901 0 O4'-C4'-C3' 107.211 1.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 215' ' ' ' DT' . . . . . 0.48 ' C4 ' ' C5 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.983 0 C1'-O4'-C4' 107.035 -1.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.206 0 O4'-C4'-C3' 107.314 1.714 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 98.2 p . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 109.333 -0.617 . . . . 1.8899999999999999 109.333 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.408 ' CE2' ' N ' ' A' ' 14' ' ' SER . 0.5 OUTLIER -117.91 124.63 48.75 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.259 -0.901 . . . . 1.3700000000000001 109.569 -179.677 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.505 ' OD2' ' N ' ' A' ' 5' ' ' LYS . 8.5 t70 -108.61 142.99 38.26 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 121.998 0.904 . . . . 2.3700000000000001 110.269 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER -66.67 -36.48 82.63 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.142 -0.688 . . . . 2.2000000000000002 109.142 179.212 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.524 ' HB2' ' O ' ' A' ' 4' ' ' CYS . 73.6 mttt 75.06 -23.81 0.23 Allowed 'General case' 0 N--CA 1.498 1.956 0 CA-C-O 121.037 0.446 . . . . 2.8100000000000001 110.159 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.573 ' HB ' ' CD2' ' A' ' 24' ' ' HIS . 12.7 mm -67.84 -66.95 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 O-C-N 120.932 -1.105 . . . . 2.96 109.746 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.9 p -94.31 -24.5 17.39 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.275 -0.89 . . . . 3.1400000000000001 109.95 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.94 38.51 1.69 Allowed Glycine 0 N--CA 1.496 2.695 0 C-N-CA 120.081 -1.057 . . . . 2.9300000000000002 112.404 177.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.413 ' O ' ' OD1' ' A' ' 3' ' ' ASP . 19.0 ttmm -115.08 154.37 29.02 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.482 -1.599 . . . . 3.48 108.49 178.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.54 ' C ' ' CD1' ' A' ' 11' ' ' PHE . 44.8 m -112.04 163.7 13.98 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 122.112 0.958 . . . . 2.0699999999999998 111.985 -177.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.636 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.2 m-85 -141.46 124.71 16.47 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 122.226 1.012 . . . . 1.4399999999999999 110.738 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -68.67 -30.56 69.26 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 122.175 0.988 . . . . 2.4900000000000002 109.158 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.95 132.79 56.37 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-N 115.646 -0.707 . . . . 3.0800000000000001 109.296 -178.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.408 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 7.2 t -59.21 -30.41 68.21 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 118.741 -1.184 . . . . 1.8899999999999999 109.903 -178.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.3 t -63.37 -47.53 81.71 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 120.278 -1.514 . . . . 2.6400000000000001 109.365 -179.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.426 ' CG2' H2'' ' B' ' 109' ' ' ' DA' . 23.9 m -61.81 -30.73 71.01 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.312 -1.366 . . . . 1.6200000000000001 107.312 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.481 ' HB2' ' HB2' ' A' ' 11' ' ' PHE . 11.5 tp -74.2 -35.84 63.95 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 107.022 -1.473 . . . . 1.4299999999999999 107.022 177.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.576 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 32.7 t -56.42 -58.9 6.04 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.718 -1.239 . . . . 1.6899999999999999 108.223 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.496 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 55.1 m -55.87 -38.77 70.57 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.726 0.774 . . . . 1.9399999999999999 109.83 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.636 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 45.3 t60 -66.65 -44.37 82.07 Favored 'General case' 0 C--N 1.294 -1.843 0 O-C-N 120.742 -1.224 . . . . 1.9299999999999999 108.247 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.7 mt -61.46 -29.75 70.16 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 106.363 -1.717 . . . . 2.02 106.363 178.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 18' ' ' SER . 21.9 mt -66.16 -29.9 70.27 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 106.621 -1.622 . . . . 1.0900000000000001 106.621 177.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.432 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 88.4 mt -65.33 -36.58 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 O-C-N 120.577 -1.327 . . . . 2.4199999999999999 108.304 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.573 ' CD2' ' HB ' ' A' ' 6' ' ' ILE . 72.1 m-70 -82.06 -28.99 32.11 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 118.149 -1.42 . . . . 2.3799999999999999 110.563 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.453 ' OG ' ' OG1' ' A' ' 27' ' ' THR . 35.0 p -92.42 -1.82 56.74 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.681 -1.262 . . . . 1.3600000000000001 108.22 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 48.4 m-20 44.5 65.35 1.08 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 115.95 -0.568 . . . . 1.04 110.134 -179.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.453 ' OG1' ' OG ' ' A' ' 25' ' ' SER . 0.6 OUTLIER -104.65 112.2 25.2 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.425 -0.954 . . . . 1.3 108.425 179.262 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.572 HH21 ' CG ' ' A' ' 40' ' ' HIS . 0.4 OUTLIER -124.16 72.7 56.53 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.311 -0.868 . . . . 2.9100000000000001 108.81 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -74.43 9.77 1.74 Allowed 'Trans proline' 0 C--N 1.312 -1.38 0 C-N-CA 122.037 1.825 . . . . 1.6599999999999999 113.514 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -114.49 81.73 7.11 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.005 -1.06 . . . . 2.1299999999999999 108.656 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -75.93 137.98 20.33 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.253 1.968 . . . . 1.99 113.037 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.57 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -64.79 137.27 57.68 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 107.893 -1.151 . . . . 1.9099999999999999 107.893 179.223 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.464 ' CD ' ' N ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -78.1 -15.04 59.23 Favored 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.497 -0.752 . . . . 2.7799999999999998 110.663 -178.834 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.449 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 40.4 m-85 -110.97 -72.88 0.7 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.613 -1.304 . . . . 2.4900000000000002 111.747 -178.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.554 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.9 p -85.16 2.04 45.38 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.071 -1.018 . . . . 2.6899999999999999 111.472 -178.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.445 ' C ' ' HB3' ' A' ' 32' ' ' CYS . . . 80.84 -12.49 35.47 Favored Glycine 0 N--CA 1.504 3.19 0 O-C-N 120.94 -1.1 . . . . 2.5 114.289 175.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.57 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 1.8 mttm -47.58 119.39 2.71 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 119.561 1.68 . . . . 3.0299999999999998 109.247 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -98.77 135.69 39.87 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.945 -1.097 . . . . 3.0299999999999998 110.976 -178.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.516 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 28.2 m-85 -115.23 174.47 5.98 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.416 -0.803 . . . . 1.3400000000000001 110.147 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.892 ' H ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -107.05 -19.68 13.54 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 116.306 -0.407 . . . . 1.95 110.751 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.53 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 48.8 mt-30 -114.46 110.48 19.91 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 120.718 -1.239 . . . . 2.8300000000000001 110.032 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.491 ' C ' ' O ' ' A' ' 41' ' ' GLN . 44.6 tttp -34.33 -57.11 0.5 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.232 -0.917 . . . . 3.3300000000000001 110.892 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.06 -33.79 63.03 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.408 -0.808 . . . . 2.8199999999999998 111.073 -178.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.734 ' OD1' ' N ' ' A' ' 45' ' ' MET . 35.2 p30 -71.18 -37.5 72.15 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.181 -1.408 . . . . 2.2000000000000002 108.072 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.734 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 9.9 ttp -67.71 -47.42 69.43 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 120.319 -1.488 . . . . 2.1200000000000001 108.061 177.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.499 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 36.6 mttm -50.2 -41.23 49.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.636 -1.29 . . . . 3.3500000000000001 107.565 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -60.85 -35.06 75.6 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 106.709 -1.589 . . . . 3.8799999999999999 106.709 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.698 ' O ' HG12 ' A' ' 51' ' ' ILE . 61.5 t60 -67.37 -67.64 0.44 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.494 -1.298 . . . . 1.6799999999999999 107.494 177.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.499 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 32.0 p -40.75 -33.02 0.25 Allowed 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.657 -1.277 . . . . 1.1399999999999999 110.546 178.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.544 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.4 m-85 -70.96 -35.83 72.31 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 120.804 -1.185 . . . . 2.1000000000000001 109.352 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.698 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.1 pt -63.45 -29.19 46.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 C-N-CA 118.461 -1.295 . . . . 2.1099999999999999 108.508 176.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -81.0 -29.44 35.21 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 120.315 -1.491 . . . . 1.98 109.92 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.544 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 75.0 p -91.29 2.29 56.49 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.237 -0.914 . . . . 1.3799999999999999 112.181 -176.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 58.73 56.08 27.26 Favored Glycine 0 N--CA 1.486 2.033 0 N-CA-C 107.706 -2.157 . . . . 1.1799999999999999 107.706 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.484 ' CD ' ' HG1' ' A' ' 53' ' ' THR . 62.0 mt-10 -114.12 128.58 56.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.456 -1.026 . . . . 2.0099999999999998 109.943 -178.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 68' ' ' SER . 38.1 mttm -143.29 67.27 16.72 Favored Pre-proline 0 C--N 1.304 -1.372 0 N-CA-C 108.754 -0.832 . . . . 2.21 108.754 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.48 -11.71 14.75 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 122.29 1.993 . . . . 1.6899999999999999 112.532 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.533 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 94.5 m-70 -101.19 90.61 4.19 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.996 -1.113 . . . . 1.71 107.996 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 26.3 mtpt -91.99 125.82 36.83 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 121.799 0.809 . . . . 2.7400000000000002 110.778 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.661 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 1.7 t -43.48 -91.52 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.837 -0.539 . . . . 1.3799999999999999 110.718 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.661 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 6.6 mm-40 122.31 -20.9 0.01 OUTLIER 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 121.604 0.716 . . . . 2.6499999999999999 110.574 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.8 t -87.98 -43.26 15.42 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.136 0 CA-C-O 122.038 0.923 . . . . 1.8600000000000001 109.274 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 18.8 p -122.92 -6.15 8.48 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.675 -0.693 . . . . 2.2400000000000002 109.966 -178.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.49 29.58 32.52 Favored Glycine 0 N--CA 1.496 2.682 0 O-C-N 120.942 -1.099 . . . . 2.04 111.858 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 60' ' ' CYS . 6.6 tttp -101.29 157.22 16.95 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 105.558 -2.016 . . . . 2.7799999999999998 105.558 176.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -131.97 152.18 51.27 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.462 -1.399 . . . . 1.51 112.966 -176.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.597 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 60.6 m-85 -134.71 138.93 44.82 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 122.151 0.977 . . . . 1.72 112.369 -178.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.462 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 34.0 p -68.89 -26.38 65.08 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.738 -1.208 . . . . 2.0800000000000001 107.738 177.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -116.51 151.62 35.74 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 122.002 0.906 . . . . 2.8300000000000001 112.851 -176.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.627 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.9 OUTLIER -78.29 -47.27 18.21 Favored 'General case' 0 C--O 1.19 -2.037 0 N-CA-C 107.57 -1.27 . . . . 2.4100000000000001 107.57 175.399 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.577 ' C ' ' O ' ' A' ' 70' ' ' SER . 15.7 p -39.75 -41.4 1.09 Allowed 'General case' 0 C--N 1.301 -1.519 0 O-C-N 120.441 -1.412 . . . . 2.3900000000000001 107.782 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -79.79 -31.99 40.82 Favored 'General case' 0 C--N 1.291 -1.94 0 C-N-CA 119.65 -0.82 . . . . 2.4500000000000002 108.916 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.627 ' N ' ' O ' ' A' ' 70' ' ' SER . 30.7 tp -72.76 -40.78 65.73 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.601 -1.312 . . . . 1.95 108.553 177.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 97.2 mt -59.92 -52.19 64.04 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 O-C-N 120.937 -1.102 . . . . 2.3599999999999999 108.255 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.2 m -60.33 -47.32 86.56 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.866 -1.146 . . . . 2.8799999999999999 109.511 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.597 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 19.4 t60 -56.86 -39.95 75.25 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 122.419 1.104 . . . . 1.9099999999999999 108.191 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 53.4 p -71.51 -34.39 70.06 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.898 -1.127 . . . . 1.78 108.684 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -57.83 -32.67 67.83 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.428 -1.323 . . . . 3.27 107.428 178.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.444 ' CD ' ' OP2' ' B' ' 103' ' ' ' DT' . 20.5 mttm -69.16 -48.26 62.75 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.904 -1.147 . . . . 3.8999999999999999 107.904 178.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -58.39 -55.25 37.42 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 117.283 -1.767 . . . . 2.3399999999999999 109.247 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 60.6 m -56.98 -52.79 63.83 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.114 -1.034 . . . . 2.7799999999999998 108.895 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.63 -1.388 . . . . 3.71 109.63 179.55 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.851 0 C4'-C3'-C2' 104.78 1.58 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.839 0 C4'-C3'-C2' 104.717 1.517 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' ' DT' . . . . . 0.541 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.625 0 C1'-O4'-C4' 105.634 -2.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' ' DA' . . . . . 0.541 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.878 0 O4'-C4'-C3' 107.115 1.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' ' DA' . . . . . 0.406 ' C6 ' ' C5 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.085 0 O4'-C4'-C3' 107.177 1.577 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.543 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.428 -1.659 0 C1'-O4'-C4' 106.376 -2.374 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' ' DT' . . . . . 0.534 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.888 0 C1'-O4'-C4' 106.114 -2.562 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.886 0 O4'-C4'-C3' 107.121 1.521 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' ' DA' . . . . . 0.551 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 P--O5' 1.607 1.405 0 N19-C1'-C2' 117.475 2.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' ' DC' . . . . . 0.551 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.018 0 P-O3'-C3' 121.73 1.692 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.833 0 C1'-O4'-C4' 107.405 -1.64 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' ' DG' . . . . . 0.561 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.916 0 O4'-C4'-C3' 107.436 1.836 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.561 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.786 0 O4'-C4'-C3' 107.145 1.545 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 114' ' ' ' DC' . . . . . 0.472 ' O2 ' ' N2 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.032 0 C1'-O4'-C4' 107.473 -1.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.841 0 O4'-C4'-C3' 107.239 1.639 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.03 0 O4'-C4'-C3' 107.371 1.771 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 201' ' ' ' DT' . . . . . 0.438 ' O2 ' ' N7 ' ' C' ' 202' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.935 0 O4'-C4'-C3' 107.181 1.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 202' ' ' ' DA' . . . . . 0.438 ' N7 ' ' O2 ' ' C' ' 201' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.92 0 O4'-C1'-C2' 107.645 1.405 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 203' ' ' ' DG' . . . . . 0.54 ' C2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.944 0 C4'-C3'-C2' 104.801 1.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 204' ' ' ' DG' . . . . . 0.54 ' C4 ' ' C2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.8 0 C1'-O4'-C4' 107.184 -1.797 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 205' ' ' ' DC' . . . . . 0.541 ' N4 ' ' N6 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.885 0 C4'-C3'-C2' 104.768 1.568 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 206' ' ' ' DA' . . . . . 0.541 ' N6 ' ' N4 ' ' C' ' 205' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.809 0 O4'-C4'-C3' 107.348 1.748 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.742 0 C1'-O4'-C4' 107.174 -1.804 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.737 0 O4'-C4'-C3' 107.157 1.557 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 209' ' ' ' DG' . . . . . 0.539 ' C2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.74 0 O4'-C4'-C3' 107.178 1.578 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 210' ' ' ' DA' . . . . . 0.543 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.523 1.535 0 O4'-C4'-C3' 107.425 1.825 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 211' ' ' ' DT' . . . . . 0.537 ' C4 ' ' C5 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.423 -2.059 0 C1'-O4'-C4' 106.555 -2.247 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.806 0 C1'-O4'-C4' 106.818 -2.059 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.753 0 C4'-C3'-C2' 104.869 1.669 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 214' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.866 0 O4'-C4'-C3' 107.293 1.693 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.937 0 C1'-O4'-C4' 107.16 -1.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.987 0 O4'-C4'-C3' 107.212 1.612 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.622 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.2 m-85 . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.105 -0.702 . . . . 1.84 109.105 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.599 ' OD1' ' N ' ' A' ' 4' ' ' CYS . 45.5 t0 -107.25 133.38 51.9 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-O 123.013 1.387 . . . . 1.54 110.166 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.599 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 1.7 t -66.56 131.0 45.05 Favored 'General case' 0 C--N 1.288 -2.083 0 CA-C-N 113.682 -1.599 . . . . 1.01 110.327 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.33 32.11 1.82 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.409 -0.807 . . . . 2.54 110.162 -178.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.0 mm -126.81 -71.17 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 120.871 -1.143 . . . . 1.84 109.554 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.533 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 30.6 p -84.34 -50.67 7.61 Favored 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 119.325 -0.95 . . . . 2.08 108.479 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.533 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 123.34 52.24 0.2 Allowed Glycine 0 N--CA 1.496 2.661 0 C-N-CA 120.83 -0.7 . . . . 1.69 112.437 177.588 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -127.98 164.12 23.04 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.82 -1.4 . . . . 1.94 109.623 178.151 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.4 t -112.81 159.09 19.35 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.686 1.232 . . . . 2.02 113.198 -176.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 51.9 m-85 -139.16 125.36 20.13 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 114.968 -1.014 . . . . 1.73 109.784 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -68.29 -22.37 64.73 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 108.869 -0.789 . . . . 2.69 108.869 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.683 HH21 ' N ' ' A' ' 15' ' ' SER . 0.0 OUTLIER -119.5 133.45 55.68 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.034 -0.728 . . . . 3.61 109.034 -178.62 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.622 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 40.5 t -57.42 -33.36 67.81 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.004 -1.06 . . . . 1.87 108.259 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.683 ' N ' HH21 ' A' ' 13' ' ' ARG . 30.5 t -66.44 -39.41 88.88 Favored 'General case' 0 C--N 1.308 -1.213 0 O-C-N 121.626 -0.671 . . . . 2.18 110.301 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -34.35 77.89 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 106.473 -1.677 . . . . 2.02 106.473 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.0 tp -70.6 -43.44 69.34 Favored 'General case' 0 C--O 1.202 -1.411 0 N-CA-C 106.256 -1.757 . . . . 1.19 106.256 176.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.635 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 16.4 t -49.93 -62.62 1.46 Allowed 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.529 -1.357 . . . . 2.24 109.451 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 88.0 m -54.19 -36.57 63.57 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 122.414 1.102 . . . . 1.49 108.757 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 49.9 t60 -65.47 -46.38 80.03 Favored 'General case' 0 C--N 1.284 -2.243 0 O-C-N 121.097 -1.002 . . . . 1.09 109.311 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 78.5 mt -60.91 -27.69 68.37 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 106.861 -1.533 . . . . 0.52 106.861 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 18' ' ' SER . 27.4 mt -70.03 -27.35 64.59 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 107.253 -1.388 . . . . 1.01 107.253 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 95.3 mt -65.41 -39.96 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 O-C-N 120.507 -1.37 . . . . 1.22 108.111 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -73.22 -47.31 44.44 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 117.813 -1.555 . . . . 1.29 108.763 177.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.506 ' OG ' ' OG1' ' A' ' 27' ' ' THR . 25.7 p -73.89 -3.31 28.07 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 120.564 -1.335 . . . . 1.71 110.033 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 44.4 63.51 1.63 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.575 -0.703 . . . . 1.82 109.786 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.506 ' OG1' ' OG ' ' A' ' 25' ' ' SER . 1.3 m -101.27 111.86 24.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.968 -1.082 . . . . 1.02 108.651 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.423 ' HE ' ' HB3' ' A' ' 40' ' ' HIS . 4.6 mmt85 -126.0 71.98 69.59 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.432 -0.792 . . . . 1.31 109.989 -178.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -73.94 12.15 1.02 Allowed 'Trans proline' 0 C--N 1.308 -1.583 0 C-N-CA 121.954 1.769 . . . . 1.26 113.789 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.411 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 61.6 m-85 -117.23 87.11 22.71 Favored Pre-proline 0 N--CA 1.501 2.108 0 N-CA-C 108.046 -1.094 . . . . 1.57 108.046 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -84.96 131.12 4.29 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.642 2.228 . . . . 1.15 113.047 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.582 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 1.1 t -51.51 140.59 17.67 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 121.927 0.87 . . . . 0.97 108.799 177.636 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.476 HE21 HG21 ' A' ' 49' ' ' THR . 0.1 OUTLIER -80.16 -17.32 52.79 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.861 -0.792 . . . . 3.19 108.861 179.632 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.569 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 30.5 m-85 -110.58 -76.75 0.6 Allowed 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 119.101 -1.04 . . . . 1.15 112.424 -178.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.544 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 14.8 p -81.77 20.98 0.88 Allowed 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 122.406 1.098 . . . . 1.07 110.714 -177.532 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.432 ' O ' ' C ' ' A' ' 37' ' ' LYS . . . 48.48 9.53 0.09 OUTLIER Glycine 0 N--CA 1.508 3.458 0 N-CA-C 115.513 0.965 . . . . 0.9 115.513 176.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.582 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 13.1 mttp -54.35 174.95 0.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 122.503 3.152 . . . . 0.82 107.802 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 83.8 mtm-85 -134.13 131.64 38.94 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.977 -1.077 . . . . 1.77 109.853 -178.426 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.404 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 55.5 m-85 -123.44 165.08 17.67 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.74 -0.837 . . . . 0.85 108.74 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.611 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -108.96 12.76 25.13 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.772 -0.58 . . . . 1.17 109.98 179.78 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -144.77 113.35 6.67 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.868 -1.145 . . . . 1.74 109.74 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.411 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 57.8 tttm -37.88 -72.2 0.06 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.324 -0.86 . . . . 2.81 112.984 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 85.5 p -47.37 -34.98 7.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.367 -0.833 . . . . 1.45 111.205 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -67.92 -40.3 83.41 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 117.524 -1.67 . . . . 1.17 107.395 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.691 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 11.1 tmm? -66.55 -47.15 73.75 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 120.711 -1.243 . . . . 1.35 107.974 176.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.497 ' O ' ' OG1' ' A' ' 49' ' ' THR . 6.0 tptp -54.07 -37.61 64.4 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.012 -1.055 . . . . 1.6 108.531 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.506 ' NZ ' ' CB ' ' A' ' 47' ' ' LYS . 8.2 mtmp? -67.25 -29.19 68.74 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 106.14 -1.8 . . . . 2.17 106.14 177.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.691 ' HB3' ' O ' ' A' ' 45' ' ' MET . 61.4 t60 -68.22 -66.31 0.58 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 106.776 -1.564 . . . . 0.47 106.776 175.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 41.1 p -38.92 -33.04 0.1 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.732 -1.23 . . . . 0.78 111.667 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.602 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.9 m-30 -75.16 -37.85 61.13 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.224 -0.658 . . . . 0.89 109.224 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 48' ' ' HIS . 14.9 pt -59.07 -24.1 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 105.017 -2.216 . . . . 0.61 105.017 176.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.914 ' O ' ' N ' ' A' ' 54' ' ' GLY . 83.4 m-70 -80.11 -103.12 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 101.514 -3.513 . . . . 0.77 101.514 170.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.602 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 72.7 p -8.68 -37.03 0.0 OUTLIER 'General case' 0 N--CA 1.518 2.927 0 C-N-CA 124.134 0.974 . . . . 0.77 112.6 -175.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.914 ' N ' ' O ' ' A' ' 52' ' ' HIS . . . 98.99 21.18 16.31 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 110.591 -1.004 . . . . 0.51 110.591 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.483 ' HB2' ' CG ' ' A' ' 50' ' ' PHE . 30.1 mt-10 -82.51 125.64 31.34 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.481 -1.011 . . . . 1.6 112.673 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -134.71 73.92 66.09 Favored Pre-proline 0 N--CA 1.504 2.248 0 N-CA-C 108.493 -0.929 . . . . 2.61 108.493 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -61.11 -11.13 17.37 Favored 'Trans proline' 0 N--CA 1.496 1.619 0 C-N-CA 124.131 3.221 . . . . 0.64 113.964 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -99.65 93.21 5.72 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 118.852 -1.139 . . . . 0.85 109.603 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -93.94 123.27 37.19 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.662 -0.815 . . . . 2.29 111.752 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.502 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -80.4 121.07 25.26 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 106.052 -1.833 . . . . 0.67 106.052 176.478 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -85.58 14.83 5.15 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 120.761 -1.212 . . . . 1.71 108.194 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.691 HG11 ' CG ' ' A' ' 80' ' ' HIS . 21.2 t -93.77 -56.94 4.72 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.723 0 C-N-CA 120.083 -0.647 . . . . 1.03 110.136 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.0 p -121.24 25.65 9.39 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.273 -0.892 . . . . 1.14 111.024 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 58.49 30.94 65.78 Favored Glycine 0 N--CA 1.494 2.524 0 O-C-N 120.856 -1.152 . . . . 0.97 112.706 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -107.3 152.7 23.77 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-N 118.998 1.399 . . . . 1.46 108.511 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -126.5 150.51 48.7 Favored 'General case' 0 N--CA 1.502 2.156 0 CA-C-O 121.807 0.813 . . . . 0.69 111.738 -177.426 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.539 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 82.7 m-85 -134.34 153.41 51.9 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 122.425 1.107 . . . . 0.97 113.404 -177.402 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.0 m -78.29 -41.1 34.88 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 115.47 -0.786 . . . . 1.51 108.907 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -103.78 144.75 31.07 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.926 0.869 . . . . 2.75 110.56 -177.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.537 ' O ' ' N ' ' A' ' 73' ' ' LEU . 27.9 p -70.61 -45.66 64.85 Favored 'General case' 0 C--O 1.195 -1.804 0 N-CA-C 106.951 -1.5 . . . . 1.14 106.951 178.312 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.415 ' C ' ' O ' ' A' ' 70' ' ' SER . 0.4 OUTLIER -47.01 -43.15 19.25 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.237 -1.023 . . . . 1.47 108.237 179.164 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -69.66 -32.87 71.77 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 107.383 -1.34 . . . . 1.41 107.383 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 70' ' ' SER . 16.2 tp -68.91 -57.54 5.37 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 106.436 -1.69 . . . . 0.68 106.436 176.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.431 ' N ' ' O ' ' A' ' 70' ' ' SER . 79.2 mt -42.9 -57.38 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 O-C-N 121.0 -1.062 . . . . 1.05 110.185 178.236 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.7 m -59.21 -41.82 89.48 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.015 -1.053 . . . . 1.24 108.659 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.539 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 22.7 t60 -59.93 -43.74 94.76 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 122.216 1.007 . . . . 0.84 108.37 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.9 t -68.29 -36.4 79.32 Favored 'General case' 0 C--N 1.309 -1.164 0 O-C-N 120.875 -1.141 . . . . 0.59 108.123 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 85.5 mtt-85 -54.75 -38.57 67.33 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 107.597 -1.26 . . . . 1.98 107.597 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 34.7 mttp -64.99 -43.88 91.12 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 118.714 -1.195 . . . . 2.09 107.98 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.691 ' CG ' HG11 ' A' ' 62' ' ' VAL . 49.9 m-70 -62.15 -44.37 96.77 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 117.186 -1.806 . . . . 0.91 108.713 177.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.1 m -51.64 -57.08 10.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.625 -0.672 . . . . 0.95 109.564 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 109.513 -1.435 . . . . 1.87 109.513 179.876 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.62 ' CE1' ' N ' ' A' ' 14' ' ' SER . 4.2 m-85 . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 108.723 -0.843 . . . . 1.18 108.723 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.618 ' OD1' ' N ' ' A' ' 4' ' ' CYS . 61.3 t0 -108.19 136.55 47.66 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.816 1.294 . . . . 1.38 110.85 -179.269 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.618 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 1.7 t -68.54 126.57 30.08 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 114.589 -1.187 . . . . 0.5 109.386 178.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.524 ' HD2' ' H ' ' A' ' 5' ' ' LYS . 2.3 mptt -92.59 26.69 2.56 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.359 -0.838 . . . . 1.53 109.308 -178.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.438 HD12 ' CD2' ' A' ' 24' ' ' HIS . 74.7 mt -125.27 -72.04 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.37 -0.831 . . . . 1.05 111.247 -179.066 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 29.7 p -86.54 -45.73 10.81 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.694 -1.254 . . . . 0.83 110.899 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.401 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 126.17 45.5 0.23 Allowed Glycine 0 N--CA 1.5 2.905 0 O-C-N 121.1 -1.0 . . . . 0.54 112.267 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -127.28 156.0 42.62 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.972 -1.311 . . . . 1.25 108.918 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.433 ' C ' ' CD1' ' A' ' 11' ' ' PHE . 54.4 m -113.32 165.15 12.71 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.64 -1.288 . . . . 0.86 112.579 -176.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.553 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 46.4 m-85 -142.12 124.81 15.91 Favored 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 121.665 0.745 . . . . 0.93 110.72 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -62.44 -24.57 67.5 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.775 -0.824 . . . . 1.99 108.775 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.9 mmm180 -119.64 138.39 53.28 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.182 -0.673 . . . . 2.89 109.182 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.62 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 1.0 OUTLIER -64.44 -37.79 88.77 Favored 'General case' 0 C--N 1.301 -1.504 0 C-N-CA 118.991 -1.084 . . . . 1.09 108.834 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.4 p -55.81 -48.89 74.62 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 107.799 -1.186 . . . . 1.18 107.799 178.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -36.53 70.27 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 107.671 -1.233 . . . . 1.07 107.671 178.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 tp -70.95 -34.85 71.87 Favored 'General case' 0 C--O 1.201 -1.472 0 N-CA-C 107.312 -1.366 . . . . 0.63 107.312 177.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.588 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 18.5 p -58.98 -60.6 3.61 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.038 -1.038 . . . . 1.16 108.888 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.481 ' N ' ' OG ' ' A' ' 18' ' ' SER . 68.3 m -52.8 -34.39 53.31 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 122.063 0.935 . . . . 0.74 108.518 179.051 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.553 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 63.1 t60 -68.39 -45.81 71.71 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-O 122.809 1.29 . . . . 0.65 108.323 178.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 21' ' ' LEU . 38.1 mt -58.05 -35.82 71.89 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 106.753 -1.573 . . . . 0.65 106.753 178.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 18' ' ' SER . 13.3 mt -62.86 -35.63 80.61 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.466 -0.939 . . . . 0.84 108.466 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 67.9 mt -57.58 -34.93 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 O-C-N 120.322 -1.486 . . . . 1.05 108.548 177.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.438 ' CD2' HD12 ' A' ' 6' ' ' ILE . 88.9 m-70 -81.15 -36.08 30.69 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.431 -1.308 . . . . 1.15 111.497 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.637 ' O ' ' CG ' ' A' ' 26' ' ' ASP . 1.3 m -83.56 -59.86 2.31 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.421 -1.424 . . . . 1.22 108.649 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.637 ' CG ' ' O ' ' A' ' 25' ' ' SER . 3.3 p-10 97.66 54.63 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.966 0 CA-C-O 122.039 0.923 . . . . 2.33 110.19 178.651 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.583 HG21 HD13 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -63.84 -46.83 83.28 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.3 -0.875 . . . . 1.04 108.944 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.499 ' NH1' ' ND1' ' A' ' 40' ' ' HIS . 0.4 OUTLIER 36.33 65.83 2.05 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.558 -0.714 . . . . 0.94 110.374 179.586 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -88.94 12.29 2.78 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.595 2.197 . . . . 0.7 113.752 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.414 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 69.8 m-85 -117.45 86.15 21.88 Favored Pre-proline 0 N--CA 1.498 1.973 0 O-C-N 121.009 -1.057 . . . . 0.63 109.354 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -84.99 130.96 4.22 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 123.043 2.495 . . . . 0.85 114.063 -178.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.53 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -53.04 139.43 28.16 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 122.1 0.952 . . . . 0.83 110.376 179.025 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.433 ' CD ' ' N ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -81.64 -20.96 38.56 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.485 -0.779 . . . . 1.13 110.201 179.711 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.53 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 22.4 m-85 -103.95 -73.38 0.67 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.632 -1.292 . . . . 0.99 111.993 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.465 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 20.4 p -78.83 -19.48 51.94 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.849 -1.157 . . . . 1.04 112.139 -177.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.27 -7.67 58.51 Favored Glycine 0 N--CA 1.509 3.562 0 O-C-N 120.405 -1.434 . . . . 0.91 115.18 175.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -51.15 168.42 0.06 Allowed 'General case' 0 N--CA 1.502 2.155 0 CA-C-N 121.126 2.463 . . . . 2.38 109.522 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.463 ' N ' ' NE ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -125.8 133.21 52.09 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.719 -1.238 . . . . 1.47 109.08 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -118.95 166.53 12.73 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.482 -0.761 . . . . 0.51 109.885 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.521 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -102.81 2.71 35.87 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.796 -0.565 . . . . 0.79 111.036 -179.601 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' A' ' 42' ' ' LYS . 38.8 mt-30 -146.62 118.08 7.96 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.467 -1.395 . . . . 1.15 111.055 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 41' ' ' GLN . 37.4 tttm -37.08 -69.46 0.11 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.458 -0.776 . . . . 2.07 111.895 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.1 m -48.07 -27.79 2.5 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.843 -1.16 . . . . 1.35 110.682 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -74.75 -40.18 61.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.994 -1.066 . . . . 0.83 108.172 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.672 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 4.8 tmm? -68.6 -47.44 66.69 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.379 -1.451 . . . . 0.64 107.472 176.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -52.56 -37.55 58.09 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.416 -1.327 . . . . 1.68 107.416 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.52 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.5 mtpt -63.13 -32.84 74.32 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 105.351 -2.092 . . . . 1.12 105.351 176.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.672 ' HB3' ' O ' ' A' ' 45' ' ' MET . 65.0 t60 -69.54 -63.83 1.0 Allowed 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 107.813 -1.18 . . . . 0.61 107.813 177.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.469 ' C ' ' O ' ' A' ' 48' ' ' HIS . 70.5 p -39.9 -38.31 0.67 Allowed 'General case' 0 N--CA 1.482 1.154 0 O-C-N 120.4 -1.438 . . . . 0.51 110.249 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.613 ' CE1' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-85 -70.26 -35.17 73.6 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.166 -0.959 . . . . 0.51 109.503 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.561 HG12 ' O ' ' A' ' 48' ' ' HIS . 4.4 pt -57.45 -21.25 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 C-N-CA 118.158 -1.417 . . . . 0.7 107.392 176.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . 0.286 77.9 m-70 -94.22 -35.86 12.28 Favored 'General case' 0 N--CA 1.53 3.556 0 O-C-N 120.917 -1.115 . . . . 0.77 112.998 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.465 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 68.6 p -74.67 -17.67 60.64 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.748 0.785 . . . . 0.65 109.094 -176.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.63 7.6 68.8 Favored Glycine 0 C--N 1.292 -1.876 0 N-CA-C 107.941 -2.064 . . . . 0.59 107.941 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.613 ' OE1' ' CE1' ' A' ' 50' ' ' PHE . 91.8 mt-10 -73.48 115.41 12.83 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 122.313 1.054 . . . . 1.53 112.409 -177.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.0 mttm -125.2 68.77 58.46 Favored Pre-proline 0 N--CA 1.495 1.818 0 N-CA-C 108.597 -0.89 . . . . 1.67 108.597 177.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.461 ' HD3' ' C ' ' A' ' 55' ' ' GLU . 31.6 Cg_exo -56.69 -10.55 5.45 Favored 'Trans proline' 0 N--CA 1.503 2.074 0 C-N-CA 123.425 2.75 . . . . 0.75 114.487 -179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.436 ' HB3' HD22 ' A' ' 73' ' ' LEU . 62.6 m80 -99.42 85.84 3.25 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.474 -1.391 . . . . 1.02 109.288 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -84.41 124.76 31.67 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.368 -0.833 . . . . 2.52 110.072 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.673 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 0.5 OUTLIER -54.41 -89.02 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.785 0 O-C-N 121.864 -0.523 . . . . 0.89 110.02 179.24 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.673 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 3.9 mm-40 120.06 -10.17 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.372 0 CA-C-O 121.79 0.805 . . . . 1.85 110.238 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.493 HG11 ' CG ' ' A' ' 80' ' ' HIS . 14.5 t -94.69 -53.21 8.6 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-O 122.006 0.908 . . . . 1.35 108.631 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 26.8 p -108.48 -8.67 15.5 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.913 -0.585 . . . . 1.48 110.135 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.68 33.39 16.21 Favored Glycine 0 N--CA 1.498 2.795 0 O-C-N 121.17 -0.956 . . . . 1.06 113.123 177.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.1 tttm -109.32 174.53 5.82 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.356 -1.673 . . . . 2.5 108.117 178.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -137.41 156.36 48.29 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.398 -1.439 . . . . 0.8 111.79 -177.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -137.75 147.77 45.01 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 122.522 1.153 . . . . 0.99 113.758 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.0 m -81.21 -27.15 35.41 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 115.023 -0.99 . . . . 1.39 109.428 178.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -120.67 144.15 48.34 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 118.916 -1.114 . . . . 3.01 111.0 -178.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.415 ' HG ' ' CD2' ' A' ' 58' ' ' HIS . 17.1 m -65.12 -42.6 93.77 Favored 'General case' 0 C--O 1.197 -1.674 0 C-N-CA 119.248 -0.981 . . . . 1.45 108.831 178.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.8 m -50.34 -44.26 54.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.038 -1.039 . . . . 1.71 108.524 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -69.04 -33.61 73.87 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 118.48 -1.288 . . . . 2.21 108.731 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.436 HD22 ' HB3' ' A' ' 58' ' ' HIS . 21.2 tp -73.05 -47.16 47.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.414 -1.429 . . . . 0.85 108.907 177.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.451 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 67.8 mt -55.01 -52.68 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.544 -1.347 . . . . 1.54 108.307 178.166 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.668 HG22 ' NZ ' ' A' ' 79' ' ' LYS . 91.8 m -59.14 -47.96 83.37 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 118.878 -1.129 . . . . 1.51 108.182 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.2 t60 -54.75 -49.23 71.36 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.752 0.787 . . . . 0.82 109.84 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.0 t -67.89 -31.22 70.85 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.382 -1.449 . . . . 0.66 108.928 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 44.5 mtp180 -61.42 -31.63 71.57 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 106.805 -1.554 . . . . 2.75 106.805 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.668 ' NZ ' HG22 ' A' ' 75' ' ' THR . 61.5 mttp -67.42 -46.32 73.51 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 107.255 -1.387 . . . . 2.64 107.255 177.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.493 ' CG ' HG11 ' A' ' 62' ' ' VAL . 58.1 m-70 -59.98 -65.94 0.6 Allowed 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 117.383 -1.727 . . . . 0.83 109.275 178.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.5 m -54.74 -55.25 31.92 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.714 -0.616 . . . . 0.75 110.03 -178.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.518 0 N-CA-C 109.243 -1.543 . . . . 1.46 109.243 179.828 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.598 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.5 m-85 . . . . . 0 N--CA 1.496 1.87 0 N-CA-C 108.711 -0.848 . . . . 0.88 108.711 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.14 112.08 21.17 Favored 'General case' 0 N--CA 1.512 2.627 0 CA-C-O 122.797 1.284 . . . . 1.78 113.5 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 0.1 OUTLIER -48.1 131.33 15.94 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-N 114.372 -1.286 . . . . 0.82 111.478 179.362 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -90.61 -22.36 21.26 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.649 -0.657 . . . . 2.42 112.003 -178.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.753 ' N ' HD12 ' A' ' 6' ' ' ILE . 1.1 mp -74.82 -69.29 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 O-C-N 120.253 -1.529 . . . . 0.91 111.479 -177.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.0 p -92.14 -18.77 23.05 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.727 -1.233 . . . . 0.87 110.018 -178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.86 51.59 2.8 Favored Glycine 0 N--CA 1.502 3.074 0 C-N-CA 119.999 -1.096 . . . . 0.83 114.552 175.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.401 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 27.9 mttp -121.63 160.89 23.45 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 119.603 1.702 . . . . 1.27 108.251 176.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 36.8 m -112.42 149.83 31.99 Favored 'General case' 0 N--CA 1.51 2.566 0 CA-C-O 122.51 1.148 . . . . 1.33 113.7 -175.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.543 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.6 m-85 -130.33 123.3 29.67 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.176 -0.92 . . . . 0.77 110.484 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.496 ' N ' ' CD ' ' A' ' 12' ' ' LYS . 11.6 mptt -63.46 -20.64 65.75 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 109.091 -0.707 . . . . 3.25 109.091 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.69 ' HB2' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -121.26 137.25 54.77 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.679 -0.638 . . . . 1.27 109.625 -178.231 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.598 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 0.0 OUTLIER -61.36 -34.7 75.74 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 118.887 -1.125 . . . . 0.69 107.99 179.575 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.8 t -63.32 -44.58 94.56 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.682 -0.636 . . . . 1.07 110.139 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.69 ' OG1' ' HB2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -62.27 -32.8 73.56 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 106.637 -1.616 . . . . 0.56 106.637 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.9 tp -72.63 -35.87 67.91 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.527 -1.286 . . . . 0.64 107.527 177.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.458 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 18.5 m -59.31 -59.13 5.95 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.802 -1.186 . . . . 0.55 108.726 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 80.4 m -53.71 -35.73 61.47 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.102 -1.073 . . . . 0.46 108.102 178.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.543 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 55.1 t60 -66.34 -47.65 72.79 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 122.262 1.029 . . . . 0.45 108.719 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 49.3 mt -58.42 -29.97 66.52 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 107.545 -1.28 . . . . 0.58 107.545 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 18' ' ' SER . 86.7 mt -73.3 -27.76 61.72 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 107.724 -1.213 . . . . 0.5 107.724 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.438 HG12 HH22 ' A' ' 28' ' ' ARG . 72.4 mt -63.02 -33.78 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 106.988 -1.486 . . . . 0.53 106.988 177.234 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.485 ' ND1' HG21 ' A' ' 6' ' ' ILE . 79.7 m-70 -79.57 -44.08 21.76 Favored 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 119.805 -0.758 . . . . 0.72 111.168 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.418 ' O ' ' C ' ' A' ' 26' ' ' ASP . 1.2 m -85.86 2.97 43.76 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.201 -1.562 . . . . 0.84 108.57 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.418 ' C ' ' O ' ' A' ' 25' ' ' SER . 4.6 m-20 36.31 57.42 1.05 Allowed 'General case' 0 N--CA 1.498 1.975 0 CA-C-O 121.719 0.771 . . . . 1.4 111.155 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 58.2 m -68.85 -52.25 31.79 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.794 -0.817 . . . . 0.61 108.794 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.481 ' HD2' ' N ' ' A' ' 28' ' ' ARG . 5.5 mpt_? 43.12 61.1 10.1 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.318 -0.864 . . . . 0.6 110.503 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.47 19.75 0.31 Allowed 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.085 1.856 . . . . 0.55 113.731 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -126.8 88.92 53.37 Favored Pre-proline 0 N--CA 1.503 2.184 0 O-C-N 120.611 -1.306 . . . . 0.66 109.338 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.94 136.97 9.57 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.817 2.345 . . . . 0.56 114.095 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.602 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -60.56 129.74 43.06 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.536 -0.913 . . . . 0.36 108.536 179.399 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -74.06 -11.67 60.39 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-N 116.058 -0.519 . . . . 1.34 110.772 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.501 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 40.5 m-85 -113.86 -70.45 0.8 Allowed 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.507 -1.37 . . . . 0.48 112.541 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.602 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 18.0 p -89.28 -7.54 55.21 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.893 -1.129 . . . . 0.34 111.18 -178.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.501 ' C ' ' HB3' ' A' ' 32' ' ' CYS . . . 87.88 -3.78 85.85 Favored Glycine 0 N--CA 1.5 2.901 0 N-CA-C 115.821 1.088 . . . . 0.39 115.821 175.039 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.569 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 19.4 mttm -48.08 148.07 1.9 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-N 121.795 2.797 . . . . 0.7 106.93 178.115 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -117.45 134.79 54.45 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.068 -1.645 . . . . 1.69 109.449 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 17.9 m-85 -119.19 175.48 5.77 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.433 -0.792 . . . . 0.53 109.016 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.465 ' CD2' ' HG3' ' A' ' 41' ' ' GLN . 10.4 p-80 -113.31 8.56 18.07 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.639 -0.663 . . . . 0.98 111.362 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.507 ' O ' ' C ' ' A' ' 42' ' ' LYS . 7.4 mt-30 -143.1 111.51 6.24 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.453 -1.404 . . . . 1.48 110.421 179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' A' ' 45' ' ' MET . 49.4 tttm -30.95 -80.59 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.527 -0.733 . . . . 1.1 111.05 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 42' ' ' LYS . 10.8 p -36.12 -31.15 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.144 -0.973 . . . . 0.77 111.718 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -75.55 -40.9 56.18 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 118.359 -1.337 . . . . 0.81 108.349 179.796 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.617 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.5 tmm? -65.28 -46.23 81.27 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.434 -1.691 . . . . 0.69 106.434 177.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.569 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 52.9 mmtt -50.7 -36.83 38.07 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 107.476 -1.305 . . . . 1.44 107.476 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.626 ' O ' HG23 ' A' ' 51' ' ' ILE . 5.4 mtmp? -63.33 -32.09 73.41 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 106.395 -1.706 . . . . 1.92 106.395 177.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.637 ' O ' HG12 ' A' ' 51' ' ' ILE . 66.3 t60 -72.6 -67.32 0.56 Allowed 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.273 -1.38 . . . . 0.33 107.273 177.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.569 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 41.7 p -40.68 -32.28 0.2 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 120.136 -1.602 . . . . 0.42 109.61 177.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.553 ' CZ ' ' OE1' ' A' ' 55' ' ' GLU . 3.9 m-30 -70.41 -32.82 70.6 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 121.074 -1.016 . . . . 0.47 108.955 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.637 HG12 ' O ' ' A' ' 48' ' ' HIS . 15.6 pt -71.1 -16.75 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 C-N-CA 118.409 -1.316 . . . . 0.37 109.264 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.467 ' NE2' ' HB2' ' A' ' 34' ' ' TYR . 67.1 m-70 -90.86 -30.68 16.81 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.403 -1.436 . . . . 0.32 109.061 176.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 62.8 p -85.23 -11.2 55.43 Favored 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 112.608 0.596 . . . . 0.56 112.608 -176.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 83.15 14.75 73.86 Favored Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.071 -1.612 . . . . 0.45 109.071 -178.141 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.553 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 85.2 mt-10 -74.5 130.51 39.75 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.282 -1.128 . . . . 1.77 111.031 -177.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.1 mmtt -139.46 67.42 37.82 Favored Pre-proline 0 N--CA 1.487 1.418 0 N-CA-C 108.581 -0.896 . . . . 1.39 108.581 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.55 -7.7 11.35 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.9 2.4 . . . . 0.47 113.122 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.42 ' HB3' HD22 ' A' ' 73' ' ' LEU . 80.2 m-70 -105.73 93.19 4.51 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.734 -1.229 . . . . 0.54 109.019 179.213 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.464 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 91.5 mttt -94.31 123.72 37.88 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.068 -1.02 . . . . 1.34 110.761 -178.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.02 119.09 24.52 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.532 -1.284 . . . . 0.8 107.532 177.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.464 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 38.6 mm-40 -74.79 -16.17 60.72 Favored 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 112.439 0.533 . . . . 1.39 112.439 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.478 HG11 ' CG ' ' A' ' 80' ' ' HIS . 40.7 t -69.54 -55.97 13.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.039 0 O-C-N 120.187 -1.571 . . . . 1.04 111.469 -178.089 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.8 p -112.11 -0.07 15.74 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 119.305 -0.958 . . . . 0.92 110.83 -177.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.79 31.8 55.17 Favored Glycine 0 N--CA 1.498 2.803 0 C-N-CA 119.768 -1.206 . . . . 0.74 112.516 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -102.16 168.72 9.18 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 106.203 -1.777 . . . . 1.67 106.203 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -139.09 149.19 44.26 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.436 -1.415 . . . . 0.6 110.836 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.431 ' HZ ' ' CE1' ' A' ' 76' ' ' HIS . 31.2 m-85 -133.46 151.53 51.8 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 122.061 0.934 . . . . 0.54 112.905 -177.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 79.7 p -79.08 -27.39 43.02 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.717 -0.674 . . . . 0.64 109.777 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -116.72 140.13 49.77 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.877 -1.139 . . . . 2.25 111.189 -178.345 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.449 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -64.18 -45.28 89.05 Favored 'General case' 0 C--O 1.2 -1.538 0 N-CA-C 108.223 -1.028 . . . . 0.82 108.223 178.194 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.0 t -49.75 -35.87 23.85 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.299 -0.876 . . . . 0.99 108.923 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -74.96 -31.21 61.42 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.193 -1.41 . . . . 0.84 107.193 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' A' ' 70' ' ' SER . 43.7 tp -72.73 -54.52 8.72 Favored 'General case' 0 C--O 1.199 -1.582 0 N-CA-C 107.288 -1.375 . . . . 0.76 107.288 176.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.429 ' C ' ' O ' ' A' ' 73' ' ' LEU . 72.0 mt -45.34 -51.14 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 O-C-N 120.438 -1.414 . . . . 1.02 108.549 178.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 57.2 m -62.43 -45.84 91.24 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 120.8 -1.188 . . . . 0.96 109.313 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.431 ' CE1' ' HZ ' ' A' ' 67' ' ' PHE . 22.1 t60 -60.84 -43.34 98.43 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 122.141 0.972 . . . . 0.8 109.593 -179.328 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -69.33 -32.55 71.71 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 120.779 -1.2 . . . . 1.34 108.283 178.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 82' ' ' GLY . 93.0 mtt180 -62.83 -31.88 72.98 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 106.673 -1.602 . . . . 2.35 106.673 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.03 -43.55 87.27 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 118.134 -1.426 . . . . 1.76 107.29 178.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.478 ' CG ' HG11 ' A' ' 62' ' ' VAL . 68.3 m-70 -66.12 -33.41 75.72 Favored 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 118.099 -1.44 . . . . 1.12 109.506 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 17.5 p -103.0 16.79 25.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.303 -0.873 . . . . 1.57 111.265 -177.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.488 2.129 0 C-N-CA 119.237 -1.459 . . . . 1.59 109.686 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.621 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.2 m-85 . . . . . 0 N--CA 1.493 1.723 0 N-CA-C 109.113 -0.699 . . . . 70.07 109.113 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -113.72 120.79 42.04 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 122.526 1.155 . . . . 83.59 112.414 -177.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.506 ' O ' ' HA2' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -52.62 126.61 20.27 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 108.377 -0.972 . . . . 50.89 108.377 177.257 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.457 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.3 OUTLIER -86.31 -17.33 34.87 Favored 'General case' 0 C--N 1.289 -2.053 0 O-C-N 120.846 -1.159 . . . . 99.16 111.939 -177.895 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.9 mm -77.91 -72.75 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 120.822 -1.174 . . . . 112.28 112.592 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.5 p -87.3 -32.0 19.91 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 106.516 -1.661 . . . . 82.08 106.516 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.506 ' HA2' ' O ' ' A' ' 4' ' ' CYS . . . 95.94 53.77 1.47 Allowed Glycine 0 N--CA 1.496 2.652 0 C-N-CA 118.513 -1.803 . . . . 195.93 114.54 174.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -115.71 164.56 14.18 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 104.438 -2.43 . . . . 114.22 104.438 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 90.2 p -115.7 149.19 38.8 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 119.826 -1.796 . . . . 78.05 113.847 -175.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 17.3 m-85 -129.21 129.69 45.36 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.682 0.753 . . . . 54.66 110.453 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.3 mtpt -73.31 -22.2 60.4 Favored 'General case' 0 N--CA 1.497 1.894 0 CA-C-O 121.785 0.803 . . . . 101.13 109.562 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.479 ' CB ' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -113.63 131.03 56.28 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.693 -0.855 . . . . 74.89 108.693 -177.516 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.621 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 98.3 p -58.63 -32.44 69.04 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.771 -1.206 . . . . 25.87 107.899 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 76.0 p -64.68 -41.48 96.02 Favored 'General case' 0 N--CA 1.485 1.315 0 O-C-N 121.541 -0.724 . . . . 23.45 110.337 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.479 ' OG1' ' CB ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -65.38 -33.5 76.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.078 -1.452 . . . . 32.27 107.078 179.816 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 tp -72.83 -36.36 67.49 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 107.509 -1.293 . . . . 97.78 107.509 177.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.594 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 20.7 t -57.84 -60.44 3.71 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.067 -1.021 . . . . 34.23 108.794 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.488 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 58.3 m -52.36 -40.55 62.15 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 122.526 1.155 . . . . 30.69 109.32 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 61.8 t60 -63.31 -46.05 88.5 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 108.116 -1.068 . . . . 81.83 108.116 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.7 mt -58.44 -31.4 67.73 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 106.638 -1.616 . . . . 156.93 106.638 178.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 18' ' ' SER . 35.7 mt -70.02 -24.49 63.29 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 115.278 -0.874 . . . . 64.07 108.685 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 86.9 mt -68.32 -33.3 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 107.13 -1.433 . . . . 150.1 107.13 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.5 m-70 -80.71 -38.31 29.09 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.434 -1.307 . . . . 55.94 109.744 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 m -84.78 -3.63 58.7 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 120.596 -1.315 . . . . 89.1 108.846 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 22' ' ' LEU . 53.7 m-20 47.94 51.3 14.62 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 121.385 0.612 . . . . 62.89 110.248 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -91.55 130.67 37.34 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.354 -0.841 . . . . 115.68 109.509 179.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.0 mtt-85 -144.84 76.06 14.07 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 120.98 -1.075 . . . . 115.33 109.374 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.46 10.23 1.3 Allowed 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 121.843 1.695 . . . . 90.27 113.385 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.466 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 73.5 m-85 -115.19 81.72 8.33 Favored Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 120.985 -1.072 . . . . 131.19 108.434 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.81 126.07 7.06 Favored 'Trans proline' 0 C--N 1.312 -1.342 0 C-N-CA 122.509 2.139 . . . . 108.54 112.746 -178.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.501 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.1 OUTLIER -48.32 142.88 5.14 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.174 0.988 . . . . 43.4 110.08 178.204 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -83.36 -11.79 57.26 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.691 -0.631 . . . . 113.04 110.831 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.501 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 52.6 m-85 -117.67 -73.42 0.64 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.242 -1.536 . . . . 118.47 112.187 -178.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 18.3 p -79.21 -27.32 42.53 Favored 'General case' 0 N--CA 1.504 2.242 0 C-N-CA 119.088 -1.045 . . . . 56.06 110.634 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 104.94 1.46 42.23 Favored Glycine 0 N--CA 1.488 2.125 0 C-N-CA 119.405 -1.379 . . . . 19.15 114.218 175.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -54.73 153.32 6.09 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 121.12 2.46 . . . . 73.47 106.023 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -117.28 138.94 51.41 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.305 -1.497 . . . . 160.56 109.681 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.446 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 51.6 m-85 -120.18 160.53 22.73 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.078 -1.014 . . . . 72.45 110.153 -179.406 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.544 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -99.91 -7.67 24.96 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 116.234 -0.439 . . . . 97.77 110.542 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.517 ' O ' ' C ' ' A' ' 42' ' ' LYS . 88.3 mt-30 -130.3 109.24 10.61 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.885 -1.135 . . . . 106.11 109.32 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.585 ' O ' ' N ' ' A' ' 45' ' ' MET . 85.5 tttt -29.74 -82.47 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.781 -0.574 . . . . 136.29 111.199 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 42' ' ' LYS . 2.1 m -37.71 -30.42 0.03 OUTLIER 'General case' 0 C--N 1.291 -1.938 0 O-C-N 121.204 -0.935 . . . . 65.22 111.879 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 41' ' ' GLN . 57.6 t0 -72.35 -36.31 68.75 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.108 -1.62 . . . . 40.66 107.314 178.209 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.597 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.1 tmm? -71.31 -47.3 57.54 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.326 -1.361 . . . . 31.66 107.326 176.525 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.534 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 7.7 tptp -50.54 -39.06 48.01 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.21 -1.404 . . . . 103.12 107.21 -179.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.512 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.8 mtmt -64.41 -34.97 79.42 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 106.178 -1.786 . . . . 48.51 106.178 176.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.662 ' O ' HG12 ' A' ' 51' ' ' ILE . 64.8 t60 -65.38 -65.49 0.67 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 107.426 -1.324 . . . . 65.66 107.426 176.239 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.534 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 31.9 p -42.2 -33.32 0.59 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.227 -1.545 . . . . 47.02 109.9 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.508 ' CE2' ' OE1' ' A' ' 55' ' ' GLU . 2.6 m-85 -71.69 -27.65 63.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.86 -1.15 . . . . 54.63 109.572 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 48' ' ' HIS . 15.0 pt -74.96 -17.55 16.23 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 121.058 -1.026 . . . . 99.09 109.149 176.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.426 ' CE1' ' HB2' ' A' ' 34' ' ' TYR . 59.2 m-70 -89.34 -30.27 18.53 Favored 'General case' 0 N--CA 1.516 2.847 0 C-N-CA 118.065 -1.454 . . . . 59.33 107.916 176.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.465 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 38.6 p -77.18 -23.16 51.56 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.654 0.74 . . . . 97.33 109.061 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.69 22.64 35.9 Favored Glycine 0 N--CA 1.485 1.966 0 N-CA-C 108.276 -1.93 . . . . 23.68 108.276 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.508 ' OE1' ' CE2' ' A' ' 50' ' ' PHE . 86.5 mt-10 -85.66 127.1 34.4 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 122.394 1.092 . . . . 47.26 112.026 -177.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -137.76 78.83 35.58 Favored Pre-proline 0 C--N 1.296 -1.731 0 N-CA-C 107.588 -1.264 . . . . 86.79 107.588 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -67.37 -13.02 37.91 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 C-N-CA 123.101 2.534 . . . . 151.44 112.782 -178.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 67.4 m80 -96.34 91.32 5.79 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 118.437 -1.305 . . . . 42.67 108.623 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.404 ' O ' ' OE1' ' A' ' 61' ' ' GLN . 91.5 mttt -93.0 122.07 34.98 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.214 -0.929 . . . . 72.96 110.014 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.422 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -72.93 121.66 20.41 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.006 -1.109 . . . . 38.91 108.006 178.592 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.404 ' OE1' ' O ' ' A' ' 59' ' ' LYS . 1.6 mm100 -84.25 7.99 17.37 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.297 -0.877 . . . . 124.0 109.855 -178.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.788 HG11 ' CG ' ' A' ' 80' ' ' HIS . 21.7 t -91.65 -59.66 2.83 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 C-N-CA 119.566 -0.854 . . . . 56.07 109.546 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.1 p -111.22 -12.63 14.09 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.285 0.846 . . . . 63.83 113.285 -178.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.47 12.4 51.25 Favored Glycine 0 N--CA 1.505 3.247 0 O-C-N 120.057 -1.652 . . . . 23.81 112.867 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -86.18 166.79 15.47 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.087 -1.82 . . . . 120.74 106.087 177.124 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -132.41 144.76 50.73 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.481 -1.387 . . . . 39.51 109.702 -178.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.459 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 82.3 m-85 -128.49 147.03 50.65 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 122.237 1.018 . . . . 62.57 112.183 -177.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.1 m -74.31 -36.79 63.73 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.631 -0.713 . . . . 84.84 109.089 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -116.19 141.62 47.91 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.403 1.097 . . . . 93.39 111.751 -178.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.4 p -59.6 -40.83 88.79 Favored 'General case' 0 C--O 1.197 -1.664 0 N-CA-C 107.842 -1.169 . . . . 67.34 107.842 178.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.2 t -48.18 -41.9 28.27 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.374 -0.829 . . . . 68.68 110.004 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 -76.19 -29.73 57.76 Favored 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 118.321 -1.351 . . . . 33.83 108.307 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' A' ' 74' ' ' ILE . 48.3 tp -70.44 -55.65 8.5 Favored 'General case' 0 C--O 1.195 -1.804 0 N-CA-C 107.517 -1.29 . . . . 75.65 107.517 176.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.403 ' C ' ' O ' ' A' ' 73' ' ' LEU . 79.9 mt -45.91 -52.23 3.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 O-C-N 120.666 -1.271 . . . . 27.72 108.985 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.3 m -61.45 -45.87 92.45 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.985 -1.072 . . . . 95.2 109.702 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.459 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 11.6 t60 -64.56 -38.07 89.73 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 122.496 1.141 . . . . 66.3 109.09 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.53 -31.93 70.45 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 107.332 -1.358 . . . . 87.23 107.332 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 82' ' ' GLY . 10.0 mmt85 -63.36 -38.9 92.94 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 107.709 -1.219 . . . . 73.27 107.709 177.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.0 mttm -60.41 -44.07 96.07 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 118.014 -1.474 . . . . 80.85 107.403 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.788 ' CG ' HG11 ' A' ' 62' ' ' VAL . 59.3 m-70 -61.3 -35.73 78.15 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 117.002 -1.879 . . . . 46.01 107.898 177.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.467 HG22 ' O ' ' A' ' 81' ' ' THR . 20.4 m -98.26 24.16 7.53 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 107.918 -1.142 . . . . 89.5 107.918 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 109.476 -1.45 . . . . 8.65 109.476 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.666 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.6 m-85 . . . . . 0 N--CA 1.497 1.91 0 CA-C-O 121.609 0.719 . . . . 70.07 109.152 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.7 139.56 40.93 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 122.272 1.034 . . . . 83.59 110.844 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -72.53 130.24 40.18 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 122.046 0.927 . . . . 50.89 110.593 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -92.95 22.89 4.55 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 109.311 -0.626 . . . . 99.16 109.311 -177.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.3 mm -123.72 -58.24 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.055 -1.028 . . . . 112.28 113.603 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.9 p -103.79 -38.5 7.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.706 -1.246 . . . . 82.08 110.537 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 133.04 13.58 1.54 Allowed Glycine 0 N--CA 1.506 3.362 0 CA-C-O 118.727 -1.041 . . . . 195.93 114.463 177.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -104.01 164.11 11.92 Favored 'General case' 0 N--CA 1.516 2.837 0 CA-C-N 121.167 2.483 . . . . 114.22 113.805 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.5 t -117.36 160.06 21.75 Favored 'General case' 0 N--CA 1.511 2.593 0 CA-C-O 122.511 1.148 . . . . 78.05 113.195 -176.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.539 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.9 m-85 -140.06 127.9 21.95 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-N 115.455 -0.793 . . . . 54.66 110.401 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -72.59 -23.63 60.98 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 122.612 1.196 . . . . 101.13 109.217 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.732 ' HE ' ' N ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -119.17 115.5 24.36 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 114.784 -1.098 . . . . 74.89 110.158 -177.275 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.666 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 1.3 t -50.39 -33.69 21.59 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 118.4 -1.32 . . . . 25.87 109.303 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 p -56.28 -39.96 73.5 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.262 -1.524 . . . . 23.45 109.304 -178.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.1 m -72.64 -32.02 65.56 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.389 -0.967 . . . . 32.27 108.389 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.7 tp -72.73 -44.98 60.99 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 106.395 -1.706 . . . . 97.78 106.395 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.621 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 45.1 m -44.35 -53.96 6.28 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.84 -1.17 . . . . 34.23 107.84 178.344 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.7 m -59.63 -41.33 90.22 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.911 0.863 . . . . 30.69 109.008 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.539 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 56.6 t60 -63.18 -35.73 81.26 Favored 'General case' 0 C--N 1.291 -1.94 0 CA-C-O 122.423 1.106 . . . . 81.83 108.602 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.2 mt -70.73 -34.69 72.16 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.103 -1.814 . . . . 156.93 106.103 178.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 18' ' ' SER . 22.2 mt -65.4 -21.48 66.67 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.215 -1.402 . . . . 64.07 107.215 177.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 80.2 mt -74.89 -41.05 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 120.864 -1.148 . . . . 150.1 109.262 178.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -76.01 -27.71 57.48 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 118.027 -1.469 . . . . 55.94 108.865 178.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -86.91 -25.75 24.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.3 -0.875 . . . . 89.1 108.694 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 64.64 50.9 2.01 Favored 'General case' 0 C--N 1.29 -1.998 0 O-C-N 121.404 -0.81 . . . . 62.89 109.56 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.454 ' C ' HH11 ' A' ' 28' ' ' ARG . 2.3 m -98.23 127.46 44.17 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.445 -0.784 . . . . 115.68 109.261 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.454 HH11 ' C ' ' A' ' 27' ' ' THR . 1.7 mpt_? -136.36 80.04 40.81 Favored Pre-proline 0 N--CA 1.495 1.783 0 O-C-N 121.147 -0.971 . . . . 115.33 109.878 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -75.69 17.88 0.65 Allowed 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 122.296 1.997 . . . . 90.27 114.13 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.498 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 61.9 m-85 -124.1 82.73 56.4 Favored Pre-proline 0 N--CA 1.497 1.9 0 N-CA-C 107.657 -1.238 . . . . 131.19 107.657 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 5.4 Cg_endo -79.41 147.49 20.23 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 C-N-CA 122.689 2.259 . . . . 108.54 114.396 -177.355 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.625 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.5 OUTLIER -71.78 137.29 47.54 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-O 121.674 0.75 . . . . 43.4 109.826 -179.029 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.429 ' HG2' ' H ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -81.56 -15.68 54.04 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 120.414 -0.515 . . . . 113.04 110.476 -179.435 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.413 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 25.0 m-85 -119.09 -51.82 2.32 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 115.185 1.55 . . . . 118.47 115.185 -175.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.625 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.6 p -100.54 -18.62 16.55 Favored 'General case' 0 N--CA 1.517 2.917 0 O-C-N 120.414 -1.429 . . . . 56.06 113.843 -175.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 124.54 -32.58 4.04 Favored Glycine 0 N--CA 1.512 3.744 0 O-C-N 119.597 -1.94 . . . . 19.15 114.548 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -51.67 160.69 0.61 Allowed 'General case' 0 C--N 1.292 -1.915 0 O-C-N 120.895 -1.356 . . . . 73.47 112.698 -177.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.46 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 0.3 OUTLIER -131.97 152.96 50.78 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 107.801 -1.185 . . . . 160.56 107.801 179.846 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.467 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 35.4 m-85 -135.02 162.18 33.19 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-O 121.979 0.895 . . . . 72.45 110.36 -178.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.492 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -94.17 -11.92 29.4 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 115.598 -0.728 . . . . 97.77 110.863 -178.796 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' C ' ' A' ' 42' ' ' LYS . 65.7 mt-30 -131.86 116.24 16.95 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.928 -1.107 . . . . 106.11 110.126 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.499 ' O ' ' N ' ' A' ' 45' ' ' MET . 81.9 tttt -34.32 -74.21 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.197 -0.939 . . . . 136.29 111.384 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -43.98 -34.43 1.7 Allowed 'General case' 0 C--N 1.295 -1.775 0 O-C-N 121.566 -0.709 . . . . 65.22 111.287 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -68.36 -40.74 81.39 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.332 -1.729 . . . . 40.66 106.332 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.662 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 9.1 tmm? -69.45 -47.61 63.46 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 119.965 -1.709 . . . . 31.66 108.05 176.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.556 ' O ' ' OG1' ' A' ' 49' ' ' THR . 31.7 ttmt -50.9 -35.97 35.75 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.681 -1.229 . . . . 103.12 107.681 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.519 ' O ' HG23 ' A' ' 51' ' ' ILE . 25.9 mtmm -67.9 -32.78 73.5 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 105.596 -2.002 . . . . 48.51 105.596 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.824 ' O ' HG12 ' A' ' 51' ' ' ILE . 73.9 t60 -64.67 -65.21 0.7 Allowed 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 106.121 -1.807 . . . . 65.66 106.121 174.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.556 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 41.0 p -40.79 -37.05 0.7 Allowed 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.934 -1.104 . . . . 47.02 110.521 178.523 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.485 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 4.0 m-30 -65.52 -36.99 85.46 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.034 -1.042 . . . . 54.63 109.082 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.824 HG12 ' O ' ' A' ' 48' ' ' HIS . 10.5 pt -59.91 -36.58 67.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 N-CA-C 106.857 -1.535 . . . . 99.09 106.857 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -74.4 -32.08 62.57 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.452 -1.405 . . . . 59.33 110.852 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.485 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 69.3 p -85.56 -8.7 58.14 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.551 -1.343 . . . . 97.33 111.626 -176.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 74.0 13.78 80.71 Favored Glycine 0 N--CA 1.49 2.284 0 O-C-N 120.761 -1.212 . . . . 23.68 110.082 -178.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -75.82 107.78 8.23 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.98 0.895 . . . . 47.26 110.657 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -115.49 79.66 7.32 Favored Pre-proline 0 C--N 1.292 -1.912 0 N-CA-C 108.241 -1.022 . . . . 86.79 108.241 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -75.06 -13.31 21.33 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.488 2.126 . . . . 151.44 114.125 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -90.73 82.08 5.77 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 120.267 -1.521 . . . . 42.67 109.421 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -77.31 140.03 39.92 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 122.003 0.906 . . . . 72.96 111.404 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.481 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -103.11 115.4 30.52 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.621 -1.992 . . . . 38.91 105.621 177.569 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -85.12 14.05 5.53 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.34 -1.475 . . . . 124.0 109.934 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.675 HG11 ' CG ' ' A' ' 80' ' ' HIS . 46.8 t -95.47 -38.93 9.22 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 O-C-N 121.255 -0.903 . . . . 56.07 110.439 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.7 p -131.3 -8.01 3.78 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 122.139 0.971 . . . . 63.83 108.877 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.16 31.94 33.2 Favored Glycine 0 C--N 1.29 -2.024 0 O-C-N 120.837 -1.164 . . . . 23.81 111.195 176.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -96.36 -172.4 2.52 Favored 'General case' 0 C--N 1.287 -2.127 0 N-CA-C 103.216 -2.883 . . . . 120.74 103.216 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -165.74 148.13 7.44 Favored 'General case' 0 C--N 1.265 -3.077 0 N-CA-C 105.739 -1.949 . . . . 39.51 105.739 -176.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.55 ' CZ ' ' CG ' ' A' ' 76' ' ' HIS . 2.7 m-85 -129.22 146.77 51.06 Favored 'General case' 0 C--N 1.28 -2.419 0 C-N-CA 117.79 -1.564 . . . . 62.57 113.401 -175.097 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.446 ' OG ' ' HG3' ' A' ' 69' ' ' GLN . 4.9 p -70.7 -8.03 49.06 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 115.277 -0.874 . . . . 84.84 108.993 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.446 ' HG3' ' OG ' ' A' ' 68' ' ' SER . 24.7 mt-30 -145.4 130.82 18.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.036 -1.04 . . . . 93.39 111.312 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.596 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -51.1 -48.9 61.59 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.767 -1.208 . . . . 67.34 109.3 177.224 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.436 ' C ' ' O ' ' A' ' 70' ' ' SER . 0.3 OUTLIER -44.6 -44.87 9.18 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.969 -1.082 . . . . 68.68 108.7 -179.304 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.407 ' O ' ' CB ' ' A' ' 76' ' ' HIS . 63.0 m-20 -70.66 -28.1 64.53 Favored 'General case' 0 C--N 1.291 -1.976 0 C-N-CA 118.187 -1.405 . . . . 33.83 108.145 178.531 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.596 ' N ' ' O ' ' A' ' 70' ' ' SER . 37.6 tp -70.19 -59.33 2.95 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 106.778 -1.564 . . . . 75.65 106.778 175.23 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 91.5 mt -46.78 -54.34 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.376 -1.452 . . . . 27.72 109.875 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 3.2 m -61.96 -43.27 99.19 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 119.631 -1.918 . . . . 95.2 109.004 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.55 ' CG ' ' CZ ' ' A' ' 67' ' ' PHE . 16.2 t60 -58.94 -45.65 89.91 Favored 'General case' 0 C--N 1.296 -1.76 0 O-C-N 121.12 -0.988 . . . . 66.3 109.39 -178.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.6 t -69.15 -33.78 73.95 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 120.244 -1.535 . . . . 87.23 107.997 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.449 ' HB2' ' O ' ' A' ' 75' ' ' THR . 4.3 mtt85 -50.83 -41.04 57.3 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 106.49 -1.67 . . . . 73.27 106.49 178.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -64.6 -45.02 88.75 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 118.252 -1.379 . . . . 80.85 108.582 178.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.675 ' CG ' HG11 ' A' ' 62' ' ' VAL . 63.7 m-70 -62.49 -35.28 78.85 Favored 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 116.52 -2.072 . . . . 46.01 108.52 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 50.6 p -96.09 19.1 12.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.085 -1.01 . . . . 89.5 109.786 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.552 0 N-CA-C 109.381 -1.487 . . . . 8.65 109.381 178.971 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.576 ' CE2' ' N ' ' A' ' 14' ' ' SER . 3.7 m-85 . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.671 0.748 . . . . 70.07 109.158 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.904 ' O ' ' O ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -108.68 103.24 12.29 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 122.009 0.909 . . . . 83.59 110.761 -178.558 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.904 ' O ' ' O ' ' A' ' 3' ' ' ASP . 19.4 t -13.88 157.21 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.214 0 CA-C-N 114.621 -1.172 . . . . 50.89 109.573 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.7 mttp -120.36 20.44 11.92 Favored 'General case' 0 N--CA 1.507 2.385 0 N-CA-C 106.474 -1.676 . . . . 99.16 106.474 174.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.541 ' HB ' ' NE2' ' A' ' 24' ' ' HIS . 6.3 mm -126.13 -80.35 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 CA-C-N 115.333 -0.848 . . . . 112.28 110.361 -178.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.8 p -81.45 -36.2 29.66 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.269 -1.519 . . . . 82.08 109.384 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.88 43.44 1.12 Allowed Glycine 0 N--CA 1.506 3.302 0 C-N-CA 119.696 -1.24 . . . . 195.93 113.521 177.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.49 ' HG2' ' N ' ' A' ' 10' ' ' SER . 49.5 tttm -112.19 160.39 17.64 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.503 -1.586 . . . . 114.22 107.856 178.146 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.49 ' N ' ' HG2' ' A' ' 9' ' ' LYS . 57.6 p -112.32 146.96 37.34 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 123.499 1.619 . . . . 78.05 114.708 -174.048 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.531 ' HZ ' ' ND1' ' A' ' 20' ' ' HIS . 49.4 m-85 -130.22 125.69 35.52 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 113.35 -1.75 . . . . 54.66 110.047 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.1 mttp -70.82 -21.21 62.49 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 122.631 1.205 . . . . 101.13 108.507 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.563 ' NH2' ' H ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -114.68 136.82 52.64 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 114.893 -1.049 . . . . 74.89 110.19 -177.178 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.576 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 19.3 t -65.62 -36.4 83.6 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.041 -1.037 . . . . 25.87 108.978 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -38.99 90.01 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.186 -0.946 . . . . 23.45 110.293 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.8 m -66.11 -31.31 72.1 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 105.854 -1.906 . . . . 32.27 105.854 178.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 2' ' ' PHE . 14.9 tp -73.19 -35.14 66.33 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 106.712 -1.588 . . . . 97.78 106.712 176.329 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.635 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 40.3 p -57.91 -57.16 14.0 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.782 -1.199 . . . . 34.23 108.308 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.9 m -53.53 -41.17 66.12 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 122.439 1.114 . . . . 30.69 108.863 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.531 ' ND1' ' HZ ' ' A' ' 11' ' ' PHE . 55.3 t60 -62.78 -47.47 83.35 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-O 122.511 1.148 . . . . 81.83 108.411 178.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 37.9 mt -58.19 -30.72 66.65 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.025 -1.472 . . . . 156.93 107.025 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 18' ' ' SER . 61.3 mt -72.41 -26.69 61.96 Favored 'General case' 0 C--O 1.205 -1.246 0 N-CA-C 107.967 -1.123 . . . . 64.07 107.967 178.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 49.5 mt -64.07 -34.0 65.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 O-C-N 120.046 -1.659 . . . . 150.1 107.028 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.541 ' NE2' ' HB ' ' A' ' 6' ' ' ILE . 89.7 m-70 -81.21 -37.29 28.88 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 118.697 -1.201 . . . . 55.94 110.477 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.51 ' O ' ' C ' ' A' ' 26' ' ' ASP . 57.4 m -93.6 1.87 56.54 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.387 -1.446 . . . . 89.1 109.043 -179.299 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.51 ' C ' ' O ' ' A' ' 25' ' ' SER . 1.1 p30 32.47 59.86 0.38 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.436 0.636 . . . . 62.89 110.164 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 91.5 m -70.65 -54.54 11.53 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 108.077 -1.083 . . . . 115.68 108.077 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.431 HH11 ' HG2' ' A' ' 28' ' ' ARG . 23.3 mtt-85 40.69 67.64 2.76 Favored Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.731 -0.605 . . . . 115.33 110.843 179.029 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -89.1 26.24 0.57 Allowed 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.639 2.226 . . . . 90.27 113.847 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.531 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 63.9 m-85 -122.73 76.54 47.54 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 120.694 -1.254 . . . . 131.19 107.634 179.035 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.29 125.81 12.28 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 122.696 2.264 . . . . 108.54 114.507 -176.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.9 OUTLIER -52.92 135.24 36.8 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.636 -0.876 . . . . 43.4 108.636 177.914 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.7 -11.57 58.24 Favored 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.372 -0.931 . . . . 113.04 109.652 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.519 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 85.6 m-85 -104.71 -74.29 0.65 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.798 -1.189 . . . . 118.47 111.659 -178.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.555 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 28.4 p -85.98 -19.82 29.83 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 118.614 -1.234 . . . . 56.06 111.487 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.71 0.16 55.33 Favored Glycine 0 N--CA 1.498 2.771 0 O-C-N 120.409 -1.432 . . . . 19.15 114.867 175.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.413 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 25.5 mttp -54.57 164.84 0.66 Allowed 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 121.737 2.769 . . . . 73.47 107.42 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -123.85 107.56 11.52 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.454 -1.404 . . . . 160.56 109.132 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.608 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 31.6 m-85 -89.44 170.63 10.37 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.334 -0.854 . . . . 72.45 111.15 -178.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.776 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -117.1 40.25 3.05 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 115.651 -0.704 . . . . 97.77 111.037 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.776 ' HG3' ' O ' ' A' ' 40' ' ' HIS . 5.1 mt-30 179.72 105.73 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 108.473 -0.936 . . . . 106.11 108.473 177.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 33.8 tttp -32.35 -65.37 0.15 Allowed 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 112.627 0.603 . . . . 136.29 112.627 -178.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.1 m -52.89 -39.15 62.46 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.502 -0.749 . . . . 65.22 111.11 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -64.74 -42.1 95.43 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.309 -1.367 . . . . 40.66 107.309 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.609 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 61.9 ttp -63.32 -44.9 93.62 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.33 -1.481 . . . . 31.66 107.22 177.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.638 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 22.9 mttm -51.41 -42.44 61.46 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 107.547 -1.279 . . . . 103.12 107.547 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.514 ' O ' HG23 ' A' ' 51' ' ' ILE . 51.7 mtmt -59.63 -30.99 69.11 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 106.361 -1.718 . . . . 48.51 106.361 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.614 ' O ' HG12 ' A' ' 51' ' ' ILE . 76.3 t60 -71.19 -65.14 0.78 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 107.419 -1.326 . . . . 65.66 107.419 176.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.638 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 19.4 p -43.99 -31.07 0.82 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.586 -1.321 . . . . 47.02 110.003 178.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -71.39 -34.02 70.02 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.457 -0.777 . . . . 54.63 109.198 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.0 pt -65.95 -36.64 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 C-N-CA 118.029 -1.468 . . . . 99.09 108.362 176.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.505 ' NE2' ' HB2' ' A' ' 34' ' ' TYR . 78.1 m-70 -69.48 -32.04 70.69 Favored 'General case' 0 N--CA 1.524 3.232 0 O-C-N 120.142 -1.599 . . . . 59.33 110.368 178.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 63.1 p -82.27 -17.48 45.76 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.506 -0.746 . . . . 97.33 109.599 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 84.13 17.38 65.08 Favored Glycine 0 N--CA 1.481 1.697 0 N-CA-C 107.359 -2.297 . . . . 23.68 107.359 -177.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -76.48 116.97 17.65 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 122.143 0.973 . . . . 47.26 110.348 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -125.72 78.47 69.03 Favored Pre-proline 0 N--CA 1.49 1.575 0 N-CA-C 108.76 -0.83 . . . . 86.79 108.76 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -65.0 -10.66 26.36 Favored 'Trans proline' 0 C--N 1.309 -1.548 0 C-N-CA 122.589 2.193 . . . . 151.44 112.804 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -112.34 95.79 5.65 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 117.762 -1.575 . . . . 42.67 109.434 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -97.96 129.49 44.86 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.22 -0.925 . . . . 72.96 110.219 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.405 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -71.84 120.55 17.59 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 107.147 -1.427 . . . . 38.91 107.147 178.523 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -88.2 9.7 22.01 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.275 -1.009 . . . . 124.0 108.275 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.457 HG11 ' CG ' ' A' ' 80' ' ' HIS . 14.2 t -94.56 -59.89 2.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 C-N-CA 119.929 -0.709 . . . . 56.07 111.026 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.4 p -114.56 -17.87 11.59 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 113.987 1.106 . . . . 63.83 113.987 -177.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.86 -11.75 7.37 Favored Glycine 0 N--CA 1.514 3.891 0 CA-C-N 122.112 2.233 . . . . 23.81 114.765 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.5 tttp -86.8 166.0 15.56 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.077 -1.837 . . . . 120.74 112.024 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.52 151.82 48.98 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.19 -0.944 . . . . 39.51 112.228 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.552 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 90.6 m-85 -132.49 144.18 50.27 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 122.264 1.03 . . . . 62.57 112.922 -177.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.9 t -78.47 -40.03 36.68 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.293 -1.003 . . . . 84.84 108.293 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -106.29 140.66 38.88 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.965 0.888 . . . . 93.39 110.747 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 75.2 p -62.33 -40.37 96.12 Favored 'General case' 0 C--O 1.195 -1.796 0 N-CA-C 107.86 -1.163 . . . . 67.34 107.86 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.446 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.4 OUTLIER -51.66 -35.1 41.02 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.621 -0.674 . . . . 68.68 110.078 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -80.57 -32.77 36.5 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.012 -1.075 . . . . 33.83 108.581 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.6 tp -73.71 -35.21 65.1 Favored 'General case' 0 C--O 1.202 -1.402 0 N-CA-C 106.914 -1.513 . . . . 75.65 106.914 176.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.5 ' O ' ' OG ' ' A' ' 77' ' ' SER . 66.6 mt -59.25 -54.16 38.14 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 O-C-N 120.486 -1.384 . . . . 27.72 107.732 177.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.65 ' O ' ' N ' ' A' ' 78' ' ' ARG . 55.2 m -57.98 -61.76 2.31 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 122.705 1.24 . . . . 95.2 107.91 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.552 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 13.0 t60 -45.59 -40.7 9.13 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.079 -1.082 . . . . 66.3 108.079 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.5 ' OG ' ' O ' ' A' ' 74' ' ' ILE . 95.6 p -69.45 -32.07 70.77 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 107.207 -1.405 . . . . 87.23 107.207 177.135 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.65 ' N ' ' O ' ' A' ' 75' ' ' THR . 51.8 mtp85 -61.41 -39.76 91.9 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.071 -1.018 . . . . 73.27 108.915 178.478 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.3 mttt -59.17 -45.72 90.27 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 105.622 -1.992 . . . . 80.85 105.622 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.457 ' CG ' HG11 ' A' ' 62' ' ' VAL . 47.7 m-70 -60.06 -43.13 95.62 Favored 'General case' 0 C--N 1.295 -1.78 0 C-N-CA 117.211 -1.796 . . . . 46.01 109.305 175.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 75.4 p -91.82 22.13 4.39 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.379 -1.45 . . . . 89.5 108.919 -179.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.486 2.002 0 N-CA-C 109.875 -1.29 . . . . 8.65 109.875 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.474 ' CE2' ' N ' ' A' ' 14' ' ' SER . 1.7 m-85 . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 108.44 -0.948 . . . . 70.07 108.44 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.5 p-10 -103.23 128.42 50.24 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 122.483 1.135 . . . . 83.59 110.341 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.34 123.88 19.41 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 108.123 -1.066 . . . . 50.89 108.123 178.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -83.43 -8.7 59.34 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.297 -0.877 . . . . 99.16 109.758 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.404 ' HB ' ' CD2' ' A' ' 24' ' ' HIS . 6.3 mm -83.14 -70.0 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.767 -1.208 . . . . 112.28 110.618 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 24.2 p -94.42 -23.9 17.56 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 120.816 -1.177 . . . . 82.08 111.215 -178.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 101.93 37.32 3.44 Favored Glycine 0 N--CA 1.504 3.226 0 C-N-CA 119.214 -1.47 . . . . 195.93 114.047 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -113.86 161.87 17.05 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.556 -1.556 . . . . 114.22 107.512 177.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.3 t -114.02 166.3 11.74 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.377 -1.452 . . . . 78.05 112.739 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.544 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 53.0 m-85 -143.18 127.94 18.22 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 114.643 -1.162 . . . . 54.66 109.775 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.632 ' NZ ' ' NH1' ' A' ' 13' ' ' ARG . 7.0 mtmp? -70.36 -24.45 62.97 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.609 0.719 . . . . 101.13 109.433 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.884 ' HE ' ' H ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -118.5 138.24 52.65 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.611 -0.681 . . . . 74.89 109.309 -178.642 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.474 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 22.9 t -59.87 -34.13 72.74 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 120.95 -1.094 . . . . 25.87 108.706 -179.309 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.46 -44.18 97.03 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 121.245 -0.909 . . . . 23.45 109.004 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.546 ' OG1' ' HB2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -61.51 -32.72 72.77 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 106.977 -1.49 . . . . 32.27 106.977 179.675 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.422 HD22 ' HB3' ' A' ' 2' ' ' PHE . 18.5 tp -73.83 -37.64 64.79 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.112 -1.44 . . . . 97.78 107.112 177.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.649 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 31.9 p -57.6 -58.53 7.93 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.796 -1.19 . . . . 34.23 109.195 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.429 ' N ' ' OG ' ' A' ' 18' ' ' SER . 97.0 m -57.07 -34.96 68.81 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 122.026 0.917 . . . . 30.69 108.961 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 62.1 t60 -65.94 -49.55 67.52 Favored 'General case' 0 C--N 1.295 -1.761 0 O-C-N 121.003 -1.061 . . . . 81.83 108.488 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 71.1 mt -55.25 -30.27 59.71 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 106.743 -1.577 . . . . 156.93 106.743 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 18' ' ' SER . 26.0 mt -70.9 -29.2 65.2 Favored 'General case' 0 C--O 1.208 -1.088 0 N-CA-C 108.178 -1.045 . . . . 64.07 108.178 178.623 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.414 ' N ' ' O ' ' A' ' 20' ' ' HIS . 65.4 mt -62.14 -36.1 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 O-C-N 119.877 -1.764 . . . . 150.1 107.728 177.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.404 ' CD2' ' HB ' ' A' ' 6' ' ' ILE . 88.7 m-70 -80.97 -31.15 34.92 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 118.765 -1.174 . . . . 55.94 111.192 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.8 m -92.98 -5.0 51.66 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.173 -1.579 . . . . 89.1 108.875 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 46.21 73.22 0.18 Allowed 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 109.245 -0.65 . . . . 62.89 109.245 -178.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.5 m -107.84 122.59 47.08 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.53 -0.915 . . . . 115.68 108.53 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -139.02 85.55 15.86 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.078 -1.014 . . . . 115.33 109.974 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -83.07 7.84 4.97 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 122.498 2.132 . . . . 90.27 113.388 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -112.27 93.94 24.38 Favored Pre-proline 0 N--CA 1.499 1.982 0 O-C-N 120.988 -1.07 . . . . 131.19 109.036 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.485 ' CB ' ' HE ' ' A' ' 38' ' ' ARG . 93.0 Cg_endo -85.78 129.29 3.5 Favored 'Trans proline' 0 N--CA 1.491 1.325 0 C-N-CA 122.636 2.224 . . . . 108.54 115.099 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.577 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -55.43 135.11 50.66 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.017 -1.105 . . . . 43.4 108.017 177.374 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -80.55 -16.27 54.62 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 121.826 -0.546 . . . . 113.04 110.954 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.48 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 13.9 m-85 -109.77 -66.61 1.05 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.603 -1.311 . . . . 118.47 112.333 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.577 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.9 p -91.01 12.72 18.84 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.602 -1.311 . . . . 56.06 112.209 -178.482 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 37' ' ' LYS . . . 69.79 -11.44 1.84 Allowed Glycine 0 N--CA 1.511 3.651 0 O-C-N 121.099 -1.001 . . . . 19.15 115.581 175.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.417 ' C ' ' O ' ' A' ' 36' ' ' GLY . 21.9 tttp -46.55 154.44 0.3 Allowed 'General case' 0 N--CA 1.507 2.411 0 CA-C-N 120.423 2.111 . . . . 73.47 108.717 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.485 ' HE ' ' CB ' ' A' ' 31' ' ' PRO . 1.1 mmt85 -120.23 147.6 44.74 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 120.081 -1.637 . . . . 160.56 109.785 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.541 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 77.5 m-85 -128.7 171.86 11.79 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.537 -0.727 . . . . 72.45 109.373 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.592 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 2.8 p-80 -109.58 -8.43 14.99 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.828 -0.545 . . . . 97.77 111.108 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -128.52 123.13 32.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.745 -1.222 . . . . 106.11 109.708 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -43.88 -66.1 0.42 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.887 -1.133 . . . . 136.29 111.177 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 21.9 t -47.18 -33.28 5.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.356 -0.84 . . . . 65.22 111.094 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -69.09 -45.2 70.86 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.129 -1.029 . . . . 40.66 108.28 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.554 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 35.7 ttp -63.03 -46.18 88.8 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.215 -1.402 . . . . 31.66 107.215 177.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.557 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 3.9 mmpt? -52.04 -40.74 61.54 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.33 -0.989 . . . . 103.12 108.33 -179.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.6 mtmt -63.14 -32.83 74.31 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 107.272 -1.381 . . . . 48.51 107.272 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.554 ' HB3' ' O ' ' A' ' 45' ' ' MET . 53.6 t60 -69.4 -65.82 0.66 Allowed 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 106.753 -1.573 . . . . 65.66 106.753 177.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.557 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 25.6 p -42.38 -30.43 0.33 Allowed 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.832 -1.168 . . . . 47.02 109.936 177.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.56 ' CD1' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-30 -73.46 -34.99 65.66 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.301 -0.875 . . . . 54.63 110.283 -179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 48' ' ' HIS . 19.2 pt -69.13 -22.28 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 C-N-CA 118.191 -1.404 . . . . 99.09 107.583 177.022 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.458 ' CE1' ' HB2' ' A' ' 34' ' ' TYR . 45.0 m-70 -79.72 -32.48 41.2 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.022 -1.048 . . . . 59.33 108.86 176.21 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.505 HG23 ' O ' ' A' ' 49' ' ' THR . 76.3 p -87.88 -11.98 46.13 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.709 -0.62 . . . . 97.33 112.175 -177.14 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.57 19.58 65.83 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 107.87 -2.092 . . . . 23.68 107.87 -177.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.56 ' OE1' ' CD1' ' A' ' 50' ' ' PHE . 32.3 mt-10 -79.14 130.24 35.29 Favored 'General case' 0 C--N 1.306 -1.3 0 O-C-N 121.379 -1.071 . . . . 47.26 110.922 -177.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -145.85 62.47 8.41 Favored Pre-proline 0 N--CA 1.49 1.567 0 N-CA-C 109.065 -0.717 . . . . 86.79 109.065 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -53.1 -15.47 5.09 Favored 'Trans proline' 0 N--CA 1.501 1.962 0 C-N-CA 123.132 2.554 . . . . 151.44 113.314 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.465 ' CD2' ' HG ' ' A' ' 70' ' ' SER . 60.0 m80 -94.54 96.16 9.28 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.85 -1.156 . . . . 42.67 108.86 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.444 ' O ' ' C ' ' A' ' 60' ' ' CYS . 95.9 mttt -93.6 120.46 33.9 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.035 -1.041 . . . . 72.96 110.615 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.664 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 3.9 t -38.47 -86.68 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.728 -0.607 . . . . 38.91 109.765 179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.664 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 8.7 mm100 117.1 -16.51 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.732 0 CA-C-O 122.173 0.987 . . . . 124.0 108.804 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.47 HG11 ' CG ' ' A' ' 80' ' ' HIS . 5.6 t -95.86 -63.04 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 CA-C-O 121.776 0.798 . . . . 56.07 109.994 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 23.8 p -101.42 -14.05 17.72 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.856 -0.528 . . . . 63.83 111.647 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.71 27.43 9.04 Favored Glycine 0 N--CA 1.504 3.207 0 O-C-N 120.372 -1.455 . . . . 23.81 111.709 178.254 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -105.37 164.0 12.19 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.514 -1.58 . . . . 120.74 107.41 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.444 ' C ' ' CD2' ' A' ' 67' ' ' PHE . . . -134.27 163.22 30.11 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.897 -1.127 . . . . 39.51 111.518 -177.301 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.444 ' CD2' ' C ' ' A' ' 66' ' ' ALA . 66.2 m-85 -145.5 147.18 31.87 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 122.569 1.176 . . . . 62.57 113.548 -177.115 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 78.6 p -81.6 -10.72 59.36 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 115.266 -0.879 . . . . 84.84 109.193 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -133.63 145.06 49.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.214 -0.928 . . . . 93.39 110.646 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.465 ' HG ' ' CD2' ' A' ' 58' ' ' HIS . 10.0 m -71.2 -47.44 57.42 Favored 'General case' 0 C--O 1.197 -1.685 0 C-N-CA 119.45 -0.9 . . . . 67.34 109.135 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.616 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.6 OUTLIER -50.45 -33.22 20.26 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.193 -0.942 . . . . 68.68 108.58 179.675 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -77.37 -34.09 55.12 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.976 -1.078 . . . . 33.83 108.347 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.0 tp -73.28 -39.41 65.39 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.105 -1.072 . . . . 75.65 108.105 177.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' A' ' 71' ' ' SER . 93.0 mt -57.86 -53.79 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 O-C-N 120.768 -1.207 . . . . 27.72 108.666 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.475 ' HA ' ' HE ' ' A' ' 78' ' ' ARG . 97.4 m -59.08 -43.86 91.83 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.865 -1.147 . . . . 95.2 108.372 179.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.409 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 31.8 t60 -58.54 -43.34 89.22 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 122.563 1.173 . . . . 66.3 108.149 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 36.4 t -68.38 -34.51 76.18 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.173 -0.955 . . . . 87.23 109.279 178.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.475 ' HE ' ' HA ' ' A' ' 75' ' ' THR . 28.1 mtm180 -61.38 -33.68 74.07 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 107.948 -1.13 . . . . 73.27 107.948 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -47.9 77.59 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 107.19 -1.411 . . . . 80.85 107.19 178.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.47 ' CG ' HG11 ' A' ' 62' ' ' VAL . 53.3 m-70 -61.05 -44.96 96.61 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 117.834 -1.547 . . . . 46.01 109.077 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 33.8 m -50.31 -54.8 18.85 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.442 -0.786 . . . . 89.5 110.383 -177.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.65 -1.38 . . . . 8.65 109.65 179.995 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.548 ' CE1' ' N ' ' A' ' 14' ' ' SER . 13.7 m-85 . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 108.834 -0.802 . . . . 70.07 108.834 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -104.96 137.36 42.83 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 122.287 1.041 . . . . 83.59 112.016 -178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.41 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 0.5 OUTLIER -75.57 130.26 38.52 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-N 115.199 -0.91 . . . . 50.89 110.34 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -98.82 32.12 2.72 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 121.216 0.532 . . . . 99.16 109.617 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.473 HG21 ' CG ' ' A' ' 24' ' ' HIS . 5.2 mm -126.92 -78.38 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.293 -0.879 . . . . 112.28 108.82 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.54 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 31.7 p -83.26 -52.07 6.9 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.559 -1.645 . . . . 82.08 106.559 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.54 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 121.46 62.77 0.23 Allowed Glycine 0 N--CA 1.496 2.659 0 C-N-CA 119.761 -1.209 . . . . 195.93 113.401 176.6 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.41 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 34.6 tttt -131.11 161.6 31.73 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 106.357 -1.72 . . . . 114.22 106.357 176.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.3 p -115.37 167.91 10.44 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.094 -1.629 . . . . 78.05 112.466 -176.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.508 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 55.3 m-85 -145.43 131.95 19.79 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 115.078 -0.965 . . . . 54.66 110.966 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -19.57 63.07 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 115.788 -0.642 . . . . 101.13 110.035 -179.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.426 ' O ' ' OG1' ' A' ' 16' ' ' THR . 0.1 OUTLIER -124.9 136.81 54.12 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.32 -0.863 . . . . 74.89 109.975 -178.32 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.548 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 30.5 t -56.07 -33.12 64.72 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 118.975 -1.09 . . . . 25.87 108.337 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.5 p -65.22 -42.06 93.81 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.039 -0.726 . . . . 23.45 109.039 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -63.44 -33.25 75.14 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.336 -1.357 . . . . 32.27 107.336 179.555 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.444 HD22 ' HB3' ' A' ' 2' ' ' PHE . 16.7 tp -72.37 -46.32 55.91 Favored 'General case' 0 C--O 1.199 -1.59 0 N-CA-C 106.009 -1.848 . . . . 97.78 106.009 177.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.65 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 19.1 t -48.74 -58.84 4.16 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.162 -0.961 . . . . 34.23 108.505 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.501 HG23 ' CD2' ' A' ' 40' ' ' HIS . 87.4 m -54.61 -36.49 64.51 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.06 0.933 . . . . 30.69 109.163 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.508 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 64.4 t60 -68.21 -47.08 68.85 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-O 122.5 1.143 . . . . 81.83 108.269 179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 21' ' ' LEU . 72.9 mt -59.97 -34.35 73.18 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 106.448 -1.686 . . . . 156.93 106.448 179.221 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.658 HD12 ' CE1' ' A' ' 40' ' ' HIS . 7.0 mt -62.36 -31.18 71.79 Favored 'General case' 0 C--O 1.205 -1.246 0 N-CA-C 107.237 -1.394 . . . . 64.07 107.237 178.121 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.432 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 65.1 mt -63.01 -34.88 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.38 -1.45 . . . . 150.1 108.112 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.473 ' CG ' HG21 ' A' ' 6' ' ' ILE . 97.2 m-70 -85.59 -14.39 45.89 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.248 -0.981 . . . . 55.94 109.434 178.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.537 ' O ' ' C ' ' A' ' 26' ' ' ASP . 4.9 p -108.62 0.24 20.59 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.945 -1.097 . . . . 89.1 109.457 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.537 ' C ' ' O ' ' A' ' 25' ' ' SER . 9.9 m-20 27.88 51.5 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.323 0.582 . . . . 62.89 109.845 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.581 HG21 HD13 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -66.53 -47.09 74.01 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.882 -0.784 . . . . 115.68 108.882 179.601 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.434 ' H ' ' HD2' ' A' ' 28' ' ' ARG . 9.6 mpt_? 37.33 65.76 2.42 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.694 -0.629 . . . . 115.33 111.354 178.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 40' ' ' HIS . 70.7 Cg_endo -83.07 31.58 0.52 Allowed 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.998 2.465 . . . . 90.27 113.378 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -136.13 76.23 51.79 Favored Pre-proline 0 N--CA 1.5 2.066 0 O-C-N 120.795 -1.191 . . . . 131.19 108.605 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.43 ' HB3' ' HE ' ' A' ' 38' ' ' ARG . 18.5 Cg_exo -66.09 160.4 44.84 Favored 'Trans proline' 0 N--CA 1.502 2.028 0 C-N-CA 123.331 2.688 . . . . 108.54 114.681 -178.008 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.565 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -83.79 136.53 34.11 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 122.058 0.932 . . . . 43.4 108.633 178.215 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -79.23 -16.92 55.77 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 115.842 -0.617 . . . . 113.04 109.772 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.538 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 18.1 m-85 -111.89 -71.02 0.78 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.779 -1.201 . . . . 118.47 112.634 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.565 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 20.1 p -83.03 -18.72 38.73 Favored 'General case' 0 N--CA 1.517 2.883 0 O-C-N 120.331 -1.481 . . . . 56.06 113.7 -177.088 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.567 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 114.05 -35.01 4.68 Favored Glycine 0 N--CA 1.511 3.65 0 O-C-N 120.189 -1.569 . . . . 19.15 113.518 176.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.567 ' O ' ' O ' ' A' ' 36' ' ' GLY . 5.8 mtpm? -26.57 149.34 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.862 0 O-C-N 121.075 -1.25 . . . . 73.47 110.772 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.433 ' NH2' ' O ' ' A' ' 36' ' ' GLY . 3.2 mmp_? -116.89 136.61 52.81 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.823 -1.176 . . . . 160.56 107.823 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.424 ' CZ ' ' CG ' ' A' ' 48' ' ' HIS . 34.1 m-85 -124.91 176.78 6.41 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.311 -0.996 . . . . 72.45 108.311 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.658 ' CE1' HD12 ' A' ' 22' ' ' LEU . 2.1 t60 -113.34 -19.38 11.76 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.73 -0.788 . . . . 97.77 111.563 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.558 ' HG3' ' CD2' ' A' ' 40' ' ' HIS . 67.5 mt-30 -121.88 128.43 51.59 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.728 -1.232 . . . . 106.11 111.635 -178.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.42 ' C ' ' O ' ' A' ' 41' ' ' GLN . 35.1 tptt -41.98 -71.05 0.09 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.227 -0.921 . . . . 136.29 110.109 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.411 ' C ' ' O ' ' A' ' 42' ' ' LYS . 26.0 p -43.5 -29.26 0.44 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.909 -1.12 . . . . 65.22 110.619 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 41' ' ' GLN . 4.8 m-20 -70.57 -47.59 59.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.377 -1.452 . . . . 40.66 107.822 178.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.497 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.0 tmm? -63.98 -48.01 78.12 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.425 -1.422 . . . . 31.66 107.796 178.046 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.579 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 90.2 mttt -51.1 -36.02 38.25 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.041 -1.096 . . . . 103.12 108.041 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.638 ' O ' HG23 ' A' ' 51' ' ' ILE . 30.3 mtpt -68.49 -34.52 76.06 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.106 -1.442 . . . . 48.51 107.106 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.813 ' O ' HG12 ' A' ' 51' ' ' ILE . 66.3 t60 -70.94 -64.49 0.89 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 106.9 -1.518 . . . . 65.66 106.9 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.579 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 16.9 p -42.66 -33.6 0.75 Allowed 'General case' 0 C--N 1.31 -1.148 0 O-C-N 120.414 -1.429 . . . . 47.02 108.775 177.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.531 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.1 m-85 -69.54 -28.06 65.69 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.057 -1.027 . . . . 54.63 108.233 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.813 HG12 ' O ' ' A' ' 48' ' ' HIS . 12.6 pt -73.34 -19.12 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 120.74 -1.225 . . . . 99.09 109.32 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.439 ' CD2' ' HB2' ' A' ' 34' ' ' TYR . 69.4 m-70 -89.9 -31.49 17.27 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.367 -1.458 . . . . 59.33 108.754 177.613 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.531 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 41.3 p -84.65 -20.73 30.84 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-N 115.345 -0.843 . . . . 97.33 109.329 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 71.72 49.06 25.41 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 108.606 -1.798 . . . . 23.68 108.606 -177.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.42 110.49 22.5 Favored 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.515 -0.991 . . . . 47.26 109.025 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -117.86 70.75 7.51 Favored Pre-proline 0 N--CA 1.494 1.725 0 O-C-N 121.5 -0.75 . . . . 86.79 110.556 -178.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -60.76 -8.2 8.91 Favored 'Trans proline' 0 N--CA 1.505 2.163 0 C-N-CA 123.841 3.027 . . . . 151.44 114.082 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.553 ' HB3' HD22 ' A' ' 73' ' ' LEU . 96.7 m-70 -101.83 93.0 5.07 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.549 -1.345 . . . . 42.67 108.315 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.457 ' CB ' ' NZ ' ' A' ' 59' ' ' LYS . 7.3 mtpm? -94.78 128.12 41.27 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.281 -0.887 . . . . 72.96 110.151 -178.682 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -79.43 124.64 28.64 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.702 0.763 . . . . 38.91 109.586 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -85.66 11.26 11.23 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.254 -0.904 . . . . 124.0 110.046 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.827 HG11 ' CG ' ' A' ' 80' ' ' HIS . 22.3 t -98.81 -58.1 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 120.865 -1.147 . . . . 56.07 111.049 -178.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 31.8 p -107.15 -25.5 11.52 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.157 -0.964 . . . . 63.83 109.76 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 109.39 10.85 22.96 Favored Glycine 0 N--CA 1.5 2.94 0 O-C-N 120.901 -1.125 . . . . 23.81 111.687 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 tttm -88.81 174.54 7.92 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.446 -1.62 . . . . 120.74 108.765 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -137.65 150.38 47.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.761 -1.212 . . . . 39.51 111.419 -177.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.508 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 63.8 m-85 -132.09 147.68 52.45 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 122.167 0.984 . . . . 62.57 111.534 -178.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.8 m -83.55 -19.6 35.33 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 108.934 -0.765 . . . . 84.84 108.934 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -122.53 146.1 47.71 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.121 -1.032 . . . . 93.39 111.697 -177.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 10.6 m -65.45 -40.82 93.69 Favored 'General case' 0 C--O 1.199 -1.571 0 N-CA-C 106.794 -1.558 . . . . 67.34 106.794 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.5 t -50.24 -45.69 54.23 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.479 -0.763 . . . . 68.68 109.356 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -73.25 -30.99 63.84 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 118.72 -1.192 . . . . 33.83 109.459 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.553 HD22 ' HB3' ' A' ' 58' ' ' HIS . 18.2 tp -74.4 -39.76 62.47 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.869 -1.144 . . . . 75.65 108.987 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.406 ' O ' ' CG ' ' A' ' 78' ' ' ARG . 97.3 mt -63.6 -50.4 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 120.254 -1.529 . . . . 27.72 107.67 177.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.7 m -57.98 -49.8 75.58 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 122.286 1.041 . . . . 95.2 108.64 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.508 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 28.3 t60 -58.64 -48.7 80.15 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.783 0.801 . . . . 66.3 110.717 -178.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.1 t -70.09 -34.29 72.97 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 120.136 -1.602 . . . . 87.23 108.656 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.406 ' CG ' ' O ' ' A' ' 74' ' ' ILE . 19.8 mmt180 -55.9 -32.13 63.46 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 107.083 -1.451 . . . . 73.27 107.083 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -69.29 -47.9 63.21 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.946 -1.131 . . . . 80.85 107.946 177.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.827 ' CG ' HG11 ' A' ' 62' ' ' VAL . 60.1 m-70 -56.98 -58.04 9.9 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 117.078 -1.849 . . . . 46.01 107.9 178.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 49.5 m -49.12 -52.27 27.11 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.102 -1.073 . . . . 89.5 108.102 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 109.392 -1.483 . . . . 8.65 109.392 179.928 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 2' ' ' PHE . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 107.51 -1.293 . . . . 1.35 107.51 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.573 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 0.5 OUTLIER -110.63 132.99 53.71 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 122.532 1.158 . . . . 1.67 110.95 -178.755 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.29 129.82 41.88 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 113.886 -1.506 . . . . 0.92 111.037 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -103.64 30.6 4.93 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.276 -0.89 . . . . 2.46 109.315 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.615 HD12 ' CD2' ' A' ' 24' ' ' HIS . 29.0 mt -121.45 -29.59 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 119.754 -0.778 . . . . 1.51 111.0 -178.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.5 p -142.07 -27.75 0.63 Allowed 'General case' 0 C--N 1.298 -1.667 0 C-N-CA 118.995 -1.082 . . . . 1.5 109.784 -179.225 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 112.06 61.58 0.46 Allowed Glycine 0 N--CA 1.498 2.792 0 C-N-CA 119.489 -1.338 . . . . 1.27 114.1 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.0 tttm -142.83 150.95 40.6 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.543 -1.563 . . . . 1.33 107.817 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 3' ' ' ASP . 3.6 p -109.86 158.8 17.8 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.731 -1.231 . . . . 0.8 111.911 -176.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.629 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 63.1 m-85 -136.68 128.17 28.55 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 115.275 -0.875 . . . . 0.7 111.335 -178.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -69.99 -21.1 63.26 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 115.447 -0.797 . . . . 2.61 108.96 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.401 ' HB2' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -127.82 140.82 51.8 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 122.123 0.964 . . . . 2.04 109.976 -177.762 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.5 t -59.49 -33.36 71.24 Favored 'General case' 0 C--N 1.289 -2.029 0 O-C-N 120.48 -1.388 . . . . 1.27 107.411 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.1 p -61.55 -52.0 66.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 119.94 -0.704 . . . . 1.48 109.462 -178.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.401 ' OG1' ' HB2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -58.2 -36.02 72.5 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.184 -1.043 . . . . 0.95 108.184 -179.865 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.8 tp -69.62 -40.51 76.55 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 107.128 -1.434 . . . . 0.62 107.128 177.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.674 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.5 t -53.12 -50.25 64.88 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.283 -0.886 . . . . 0.74 109.389 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 74.9 m -65.09 -38.26 90.17 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.948 -1.095 . . . . 1.2 108.816 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.629 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 43.8 t60 -61.27 -41.95 97.8 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.218 -1.03 . . . . 0.8 108.218 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 54.2 mt -62.51 -35.34 79.08 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 106.969 -1.493 . . . . 0.82 106.969 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 18' ' ' SER . 31.9 mt -65.5 -30.05 70.77 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.643 -1.243 . . . . 1.16 107.643 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 67.8 mt -59.87 -40.11 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 O-C-N 120.102 -1.624 . . . . 1.38 106.64 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.615 ' CD2' HD12 ' A' ' 6' ' ' ILE . 77.7 m-70 -72.76 -60.88 2.02 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 118.432 -1.307 . . . . 1.29 109.44 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.424 ' O ' ' C ' ' A' ' 26' ' ' ASP . 20.2 m -62.11 -5.7 2.45 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.835 -1.165 . . . . 1.63 112.148 -178.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 25' ' ' SER . 65.3 m-20 43.73 63.18 1.66 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.844 -1.16 . . . . 1.45 109.132 -177.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.546 ' C ' HH11 ' A' ' 28' ' ' ARG . 1.8 m -99.4 111.26 23.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.424 -0.797 . . . . 1.22 109.294 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.546 HH11 ' C ' ' A' ' 27' ' ' THR . 1.7 mpt_? -125.45 79.22 67.25 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.47 -0.769 . . . . 0.97 110.225 -179.101 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -78.54 9.08 3.33 Favored 'Trans proline' 0 C--N 1.313 -1.314 0 C-N-CA 122.682 2.255 . . . . 1.1 112.437 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.507 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 60.0 m-85 -117.92 84.94 21.98 Favored Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 121.303 -0.873 . . . . 0.8 109.435 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -83.43 143.03 10.85 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.321 2.014 . . . . 0.85 112.943 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.478 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -67.15 149.72 50.11 Favored 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 119.298 -0.961 . . . . 0.51 109.796 -179.307 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.447 HE21 HG21 ' A' ' 49' ' ' THR . 0.4 OUTLIER -87.42 -23.54 24.48 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.93 -0.708 . . . . 1.31 111.633 -178.53 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.491 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 5.2 m-85 -102.91 -69.78 0.78 Allowed 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 117.364 -1.734 . . . . 0.76 111.289 -179.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 15.3 p -81.15 -23.34 38.34 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.559 -1.338 . . . . 0.51 111.728 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.609 ' O ' ' NH1' ' A' ' 38' ' ' ARG . . . 102.72 -4.33 50.05 Favored Glycine 0 N--CA 1.514 3.855 0 O-C-N 120.201 -1.562 . . . . 0.54 116.441 174.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.5 ' C ' ' O ' ' A' ' 36' ' ' GLY . 36.0 mttp -47.14 156.91 0.2 Allowed 'General case' 0 N--CA 1.509 2.489 0 CA-C-N 122.39 3.095 . . . . 1.38 108.649 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.609 ' NH1' ' O ' ' A' ' 36' ' ' GLY . 9.6 mmt-85 -111.09 123.54 50.4 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 107.465 -1.309 . . . . 2.11 107.465 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.459 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 82.9 m-85 -113.85 164.62 13.52 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.712 -1.242 . . . . 0.69 109.889 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.512 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -103.19 -6.64 21.94 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 116.243 -0.435 . . . . 1.03 111.073 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -133.33 119.67 20.03 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.538 -1.351 . . . . 1.03 110.201 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.507 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 71.8 tttt -41.61 -61.32 1.1 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.521 -0.737 . . . . 0.59 110.895 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.4 p -53.7 -30.14 42.28 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.254 -0.904 . . . . 1.42 111.971 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 47' ' ' LYS . 51.4 m-20 -76.67 -39.71 51.3 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 117.385 -1.726 . . . . 1.48 107.588 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.655 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 7.6 tmm? -60.81 -46.72 89.44 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 105.728 -1.953 . . . . 0.48 105.728 176.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.511 ' O ' ' OG1' ' A' ' 49' ' ' THR . 59.8 tttp -54.2 -38.0 65.16 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.105 -1.072 . . . . 2.61 108.105 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.576 ' O ' HG23 ' A' ' 51' ' ' ILE . 47.5 mtpt -66.47 -32.65 74.14 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 106.582 -1.636 . . . . 1.55 106.582 177.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.684 ' O ' HG12 ' A' ' 51' ' ' ILE . 71.0 t60 -64.74 -60.12 3.47 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 107.016 -1.476 . . . . 0.45 107.016 176.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.511 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 54.2 p -47.46 -36.67 10.39 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 120.944 -1.098 . . . . 0.56 111.154 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.443 ' CD1' ' OE1' ' A' ' 55' ' ' GLU . 3.2 m-85 -69.3 -31.77 70.46 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.633 -1.292 . . . . 0.8 109.666 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.684 HG12 ' O ' ' A' ' 48' ' ' HIS . 3.0 pt -65.21 -32.49 58.49 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.236 0 C-N-CA 118.423 -1.311 . . . . 0.76 108.159 177.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.444 ' CE1' ' HB2' ' A' ' 34' ' ' TYR 0.251 60.6 m-70 -77.07 -33.88 57.08 Favored 'General case' 0 N--CA 1.537 3.879 0 O-C-N 120.492 -1.38 . . . . 0.84 111.054 177.48 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 49' ' ' THR . 73.9 p -79.66 -16.68 55.31 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 106.17 -1.789 . . . . 0.99 106.17 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 67.58 68.98 1.48 Allowed Glycine 0 C--O 1.203 -1.831 0 N-CA-C 104.396 -3.481 . . . . 1.09 104.396 -174.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.443 ' OE1' ' CD1' ' A' ' 50' ' ' PHE . 50.1 mt-10 -120.91 128.48 52.82 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.449 -0.945 . . . . 1.92 108.449 -179.078 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.9 mmtm -133.36 79.03 61.9 Favored Pre-proline 0 C--N 1.297 -1.702 0 C-N-CA 119.938 -0.705 . . . . 1.27 109.335 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.87 0.9 5.05 Favored 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 122.158 1.905 . . . . 0.77 112.801 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.5 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 56.7 m80 -112.85 89.86 3.19 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.101 -1.0 . . . . 0.75 108.851 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.434 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 62.3 mttp -94.5 133.43 38.12 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.092 -1.005 . . . . 1.79 112.268 -177.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.405 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -80.35 117.81 21.44 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 106.821 -1.548 . . . . 0.39 106.821 176.875 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.434 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 22.0 mm-40 -84.19 12.64 6.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.56 -0.713 . . . . 2.78 109.221 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.405 ' HB ' ' SG ' ' A' ' 60' ' ' CYS . 13.7 t -98.03 -65.67 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.888 0 C-N-CA 120.044 -0.662 . . . . 0.47 111.088 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.2 p -107.26 -7.62 16.68 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.504 -0.878 . . . . 0.59 113.179 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 111.25 -11.78 28.76 Favored Glycine 0 N--CA 1.515 3.963 0 C-N-CA 118.437 -1.84 . . . . 0.53 113.884 176.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -78.58 169.11 18.77 Favored 'General case' 0 N--CA 1.509 2.515 0 CA-C-N 120.171 1.986 . . . . 0.77 111.526 -177.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -138.42 150.67 46.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.374 -0.829 . . . . 0.65 109.487 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.573 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 35.9 m-85 -133.31 152.38 51.92 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 122.482 1.134 . . . . 0.56 112.794 -177.298 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.9 p -81.62 -29.94 33.04 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 115.055 -0.975 . . . . 1.64 108.537 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -117.28 146.91 43.0 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 122.114 0.959 . . . . 1.59 111.604 -178.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.451 ' O ' HG13 ' A' ' 74' ' ' ILE . 6.1 m -65.96 -44.07 86.06 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 118.792 -1.163 . . . . 1.23 107.937 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 t -49.13 -42.49 39.52 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.149 -0.969 . . . . 1.8 109.136 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.8 m-20 -71.48 -33.71 69.53 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 117.673 -1.611 . . . . 0.82 108.096 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 58' ' ' HIS . 11.1 tp -64.62 -52.43 57.51 Favored 'General case' 0 N--CA 1.504 2.23 0 N-CA-C 106.182 -1.784 . . . . 0.52 106.182 175.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 70' ' ' SER . 45.1 mt -52.13 -55.52 9.72 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 O-C-N 121.135 -0.978 . . . . 0.83 110.865 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.0 m -59.63 -41.52 90.63 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 119.778 -1.826 . . . . 0.7 107.725 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.573 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 42.0 t60 -62.04 -45.42 93.65 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.951 0.881 . . . . 0.42 109.726 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 38.8 t -68.11 -32.89 73.51 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.003 -1.11 . . . . 0.56 108.003 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -61.04 -38.79 87.4 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.768 -1.197 . . . . 1.7 107.768 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -44.86 95.03 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 118.185 -1.406 . . . . 1.93 107.331 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -57.83 -53.37 58.98 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 118.014 -1.474 . . . . 0.65 109.273 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 56.5 p -58.85 -48.02 82.85 Favored 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 118.391 -1.323 . . . . 1.03 108.999 -177.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.041 0 C-N-CA 118.948 -1.596 . . . . 1.85 109.797 179.102 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.46 ' HB3' HD22 ' A' ' 17' ' ' LEU . 6.1 m-85 . . . . . 0 N--CA 1.502 2.142 0 CA-C-O 121.279 0.561 . . . . 1.96 109.633 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -109.18 144.91 36.64 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 122.474 1.13 . . . . 2.6 111.579 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -84.69 127.93 34.35 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.03 -0.986 . . . . 2.37 109.998 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.8 mttp -94.97 37.24 1.16 Allowed 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.207 -0.933 . . . . 2.62 109.455 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.664 HG21 ' CG ' ' A' ' 24' ' ' HIS . 12.8 mm -131.5 -26.75 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.488 -1.382 . . . . 2.82 112.345 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.4 p -136.78 -35.6 0.71 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.6 -1.312 . . . . 3.03 110.233 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.04 46.08 0.39 Allowed Glycine 0 N--CA 1.509 3.504 0 O-C-N 120.553 -1.342 . . . . 2.97 113.549 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -136.89 159.62 41.33 Favored 'General case' 0 N--CA 1.511 2.618 0 CA-C-N 119.286 1.543 . . . . 3.12 110.611 177.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.9 p -116.76 154.5 30.54 Favored 'General case' 0 N--CA 1.512 2.671 0 N-CA-C 113.913 1.079 . . . . 2.96 113.913 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -131.81 131.75 43.15 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-O 122.144 0.973 . . . . 2.27 111.746 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.684 ' H ' ' NH1' ' A' ' 13' ' ' ARG . 37.2 mmtm -74.61 -22.56 58.88 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 122.187 0.994 . . . . 3.79 109.259 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.684 ' NH1' ' H ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -118.21 136.12 53.84 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 115.172 -0.922 . . . . 2.93 111.39 -177.239 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 t -65.2 -34.34 78.15 Favored 'General case' 0 C--O 1.195 -1.809 0 C-N-CA 118.379 -1.328 . . . . 1.38 108.917 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 p -59.37 -37.48 78.0 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.318 -1.489 . . . . 1.5 109.718 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 29.8 m -73.77 -29.83 62.43 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.622 -1.298 . . . . 1.81 107.612 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.46 HD22 ' HB3' ' A' ' 2' ' ' PHE . 14.1 tp -72.45 -50.39 26.53 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 106.239 -1.764 . . . . 1.44 106.239 176.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.682 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 75.8 m -49.04 -61.27 2.16 Favored 'General case' 0 C--N 1.289 -2.044 0 O-C-N 120.835 -1.166 . . . . 1.27 109.071 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.657 HG23 ' NE2' ' A' ' 40' ' ' HIS . 27.3 m -52.78 -36.38 58.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.039 -1.038 . . . . 1.16 109.094 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -68.16 -44.76 75.25 Favored 'General case' 0 C--N 1.294 -1.807 0 O-C-N 121.303 -0.873 . . . . 2.02 109.17 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.0 mt -60.71 -29.25 69.23 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 105.532 -2.025 . . . . 1.55 105.532 177.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.682 ' HG ' ' O ' ' A' ' 18' ' ' SER . 27.3 mt -71.22 -27.34 63.41 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.745 -1.205 . . . . 1.16 107.745 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.546 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 66.8 mt -62.57 -44.4 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 120.086 -1.634 . . . . 1.98 108.268 178.15 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.664 ' CG ' HG21 ' A' ' 6' ' ' ILE . 77.2 m-70 -69.84 -59.35 2.99 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.455 -1.298 . . . . 2.25 108.99 177.696 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.4 m -58.5 -12.39 3.92 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.664 -1.272 . . . . 1.8 110.783 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.546 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 5.0 m-20 50.19 57.94 6.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.652 -0.655 . . . . 1.58 109.614 -178.251 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.8 m -90.42 105.66 17.97 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.31 -0.869 . . . . 2.67 109.596 179.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -122.74 80.56 48.78 Favored Pre-proline 0 N--CA 1.497 1.918 0 O-C-N 121.256 -0.902 . . . . 2.83 109.63 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -84.0 15.76 2.07 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 123.114 2.543 . . . . 1.56 114.361 -179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.489 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 85.8 m-85 -118.86 86.53 30.98 Favored Pre-proline 0 N--CA 1.501 2.114 0 O-C-N 120.963 -1.086 . . . . 1.4 108.476 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -82.93 128.85 5.24 Favored 'Trans proline' 0 C--N 1.31 -1.469 0 C-N-CA 122.739 2.293 . . . . 1.21 112.844 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.617 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 0.4 OUTLIER -47.94 142.6 4.84 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 122.426 1.108 . . . . 0.98 109.722 178.879 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.444 ' CG ' HG22 ' A' ' 49' ' ' THR . 0.0 OUTLIER -82.9 -11.83 57.87 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.549 -0.751 . . . . 1.62 109.925 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.541 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 22.9 m-85 -118.13 -73.88 0.63 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.429 -1.42 . . . . 0.85 111.168 -179.328 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.575 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 14.2 p -84.02 19.48 1.76 Allowed 'General case' 0 N--CA 1.515 2.813 0 CA-C-O 121.889 0.852 . . . . 1.04 110.242 -179.163 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.482 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 42.87 10.42 0.01 OUTLIER Glycine 0 N--CA 1.503 3.123 0 CA-C-N 114.095 -1.411 . . . . 1.17 114.407 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.617 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 69.6 tttt -52.42 172.84 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 121.977 2.888 . . . . 2.07 105.698 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.5 mtp85 -131.03 142.1 50.28 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 119.427 -2.046 . . . . 2.27 110.683 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.503 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 60.0 m-85 -126.6 167.47 15.62 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.748 -0.834 . . . . 1.16 108.748 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.657 ' NE2' HG23 ' A' ' 19' ' ' THR . 0.0 OUTLIER -100.59 -24.2 14.5 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.859 -0.526 . . . . 1.56 111.239 -178.764 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.456 ' O ' ' C ' ' A' ' 42' ' ' LYS . 46.8 mt-30 -118.02 116.8 27.62 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.277 -1.515 . . . . 1.75 111.607 -178.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.542 ' HZ3' ' HE2' ' A' ' 46' ' ' LYS . 62.6 tttm -34.02 -66.2 0.17 Allowed 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.058 -1.026 . . . . 2.19 112.32 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 93.4 p -48.62 -31.2 6.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.971 -1.081 . . . . 1.33 110.366 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.449 ' N ' ' O ' ' A' ' 41' ' ' GLN . 96.7 m-20 -70.09 -44.07 69.81 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.66 -1.275 . . . . 1.31 107.652 177.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.562 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 18.9 ttp -64.98 -46.16 82.63 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 120.696 -1.252 . . . . 1.01 107.976 177.567 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.542 ' HE2' ' HZ3' ' A' ' 42' ' ' LYS . 5.3 tppt? -53.31 -37.96 62.72 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.367 -1.346 . . . . 2.44 107.367 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.569 ' O ' HG23 ' A' ' 51' ' ' ILE . 9.4 mtpt -64.25 -33.18 75.23 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 106.25 -1.759 . . . . 2.65 106.25 177.494 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.717 ' O ' HG12 ' A' ' 51' ' ' ILE . 58.7 t60 -69.06 -62.61 1.31 Allowed 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 107.702 -1.221 . . . . 0.85 107.702 177.27 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.444 HG22 ' CG ' ' A' ' 33' ' ' GLN . 75.8 p -43.61 -36.05 1.98 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 120.639 -1.288 . . . . 0.78 110.329 178.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.619 ' CZ ' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-30 -68.59 -32.45 72.36 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 108.416 -0.957 . . . . 0.99 108.416 179.092 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.717 HG12 ' O ' ' A' ' 48' ' ' HIS . 7.1 pt -64.6 -31.81 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 C-N-CA 118.058 -1.457 . . . . 0.85 108.846 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 -77.74 -33.47 52.91 Favored 'General case' 0 N--CA 1.521 3.079 0 O-C-N 120.729 -1.232 . . . . 0.8 110.404 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.4 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 73.5 p -87.54 -6.98 58.1 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.92 0.867 . . . . 0.8 109.66 -179.182 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 52.71 69.84 1.08 Allowed Glycine 0 C--N 1.292 -1.881 0 N-CA-C 106.139 -2.784 . . . . 0.62 106.139 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.619 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 33.0 mt-10 -115.24 130.1 56.82 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 105.319 -2.104 . . . . 1.97 105.319 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.7 mttm -138.74 80.98 23.99 Favored Pre-proline 0 C--N 1.304 -1.373 0 O-C-N 120.911 -1.118 . . . . 2.28 110.467 -177.041 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -73.31 13.7 0.66 Allowed 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.863 2.375 . . . . 0.92 112.615 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -116.2 83.44 1.95 Allowed 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.045 -1.035 . . . . 1.23 110.064 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -87.18 138.41 31.51 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.122 -0.986 . . . . 1.73 111.434 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.576 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -99.27 120.05 38.92 Favored 'General case' 0 C--N 1.289 -2.053 0 N-CA-C 107.383 -1.34 . . . . 0.94 107.383 177.537 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -85.36 16.46 3.69 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 108.619 -0.882 . . . . 2.73 108.619 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.764 HG11 ' CG ' ' A' ' 80' ' ' HIS . 20.1 t -95.25 -57.16 4.58 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.746 0 CA-C-O 121.622 0.725 . . . . 1.44 109.151 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.8 p -115.16 -7.65 12.42 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.495 -0.753 . . . . 0.98 111.775 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.4 -3.42 56.51 Favored Glycine 0 N--CA 1.509 3.503 0 O-C-N 120.143 -1.598 . . . . 0.69 112.779 177.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.7 tttp -84.26 153.44 23.57 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.266 -1.726 . . . . 2.33 111.885 -177.103 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -121.03 145.09 48.14 Favored 'General case' 0 N--CA 1.514 2.768 0 O-C-N 121.753 -0.592 . . . . 1.07 110.935 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.443 ' HZ ' ' CE1' ' A' ' 76' ' ' HIS . 31.3 m-85 -128.05 161.85 28.22 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 122.128 0.966 . . . . 1.67 112.689 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.9 t -84.86 -35.7 22.05 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 115.536 -0.756 . . . . 1.7 110.239 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -113.87 141.69 47.02 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 120.929 -1.107 . . . . 2.23 110.746 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.5 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.4 OUTLIER -63.04 -46.23 88.53 Favored 'General case' 0 C--O 1.202 -1.414 0 N-CA-C 108.03 -1.1 . . . . 2.66 108.03 178.219 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.457 ' C ' ' O ' ' A' ' 70' ' ' SER . 91.9 p -44.16 -39.59 4.43 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.023 -1.048 . . . . 2.76 108.695 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -76.29 -32.97 59.07 Favored 'General case' 0 C--N 1.293 -1.856 0 C-N-CA 118.783 -1.167 . . . . 2.42 108.721 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.5 ' N ' ' O ' ' A' ' 70' ' ' SER . 26.4 tp -70.33 -53.36 17.02 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 106.491 -1.67 . . . . 2.03 106.491 175.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.52 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 86.9 mt -46.97 -54.58 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 O-C-N 121.029 -1.045 . . . . 2.95 109.065 177.308 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.519 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 21.1 m -60.06 -46.64 88.89 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-O 122.539 1.161 . . . . 3.09 108.97 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.443 ' CE1' ' HZ ' ' A' ' 67' ' ' PHE . 26.4 t60 -56.02 -48.07 76.62 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.655 -0.702 . . . . 2.35 109.613 -179.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -33.02 73.56 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 119.932 -1.73 . . . . 2.39 107.621 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 35.0 mtp85 -54.34 -31.32 54.1 Favored 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 105.985 -1.857 . . . . 4.98 105.985 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -73.46 -49.89 24.48 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.223 -0.991 . . . . 3.18 108.765 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.764 ' CG ' HG11 ' A' ' 62' ' ' VAL . 61.5 m-70 -56.23 -61.67 2.23 Favored 'General case' 0 N--CA 1.501 2.08 0 C-N-CA 116.841 -1.943 . . . . 2.47 108.785 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 31.7 m -57.57 -53.1 61.99 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.264 -1.013 . . . . 3.27 108.264 -179.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.514 0 N-CA-C 109.363 -1.495 . . . . 3.59 109.363 179.862 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.538 ' CE1' ' N ' ' A' ' 14' ' ' SER . 0.9 OUTLIER . . . . . 0 N--CA 1.499 2.01 0 N-CA-C 108.517 -0.92 . . . . 2.01 108.517 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -107.53 135.61 48.7 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 122.539 1.161 . . . . 2.25 112.33 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.736 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 4.1 t -60.5 121.35 11.91 Favored 'General case' 0 N--CA 1.499 2.021 0 CA-C-N 114.625 -1.171 . . . . 1.74 109.432 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.7 mttp -94.8 28.5 2.67 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.204 -0.935 . . . . 2.44 108.828 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.3 mm -128.86 -63.38 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 N-CA-C 107.538 -1.282 . . . . 2.36 107.538 -178.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.636 ' N ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -126.4 45.98 2.55 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 124.015 1.864 . . . . 2.54 110.0 179.29 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 20.45 60.73 0.01 OUTLIER Glycine 0 CA--C 1.568 3.403 0 N-CA-C 121.525 3.37 . . . . 2.38 121.525 172.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.736 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 9.9 ttmm -115.07 139.89 49.5 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 105.663 -1.977 . . . . 2.27 105.663 171.166 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.3 t -93.52 145.05 24.8 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-O 122.438 1.113 . . . . 2.56 112.715 -177.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.519 ' HZ ' ' ND1' ' A' ' 20' ' ' HIS . 77.3 m-85 -127.16 130.27 49.46 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.912 0.863 . . . . 2.14 110.204 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -68.92 -27.93 66.21 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.948 -0.76 . . . . 3.29 108.948 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.459 ' HD3' HH11 ' A' ' 13' ' ' ARG . 0.4 OUTLIER -121.65 140.51 52.18 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 121.699 0.762 . . . . 3.55 109.624 -178.928 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.538 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 0.6 OUTLIER -60.2 -32.73 71.37 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 118.042 -1.463 . . . . 2.01 108.088 179.202 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 97.5 p -55.7 -60.95 2.72 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.192 -0.942 . . . . 2.71 109.069 -178.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.0 m -53.36 -32.12 47.82 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.517 -0.92 . . . . 2.37 108.517 179.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 tp -72.08 -39.72 68.76 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 118.077 -1.449 . . . . 1.37 107.657 177.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.736 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 58.6 m -53.01 -50.86 63.36 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.965 -1.084 . . . . 1.5 108.479 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.3 m -59.57 -36.63 76.58 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.975 0.893 . . . . 2.12 108.876 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.519 ' ND1' ' HZ ' ' A' ' 11' ' ' PHE . 23.4 t60 -69.01 -38.38 79.2 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 107.552 -1.277 . . . . 1.1 107.552 179.006 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.423 ' O ' ' N ' ' A' ' 24' ' ' HIS . 87.3 mt -67.41 -38.4 84.54 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 119.853 -1.78 . . . . 1.28 106.397 177.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.736 ' HG ' ' O ' ' A' ' 18' ' ' SER . 28.9 mt -56.17 -35.35 67.12 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 105.953 -1.869 . . . . 2.14 105.953 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.487 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 82.3 mt -61.07 -31.41 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 N-CA-C 107.256 -1.387 . . . . 1.18 107.256 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.423 ' N ' ' O ' ' A' ' 21' ' ' LEU . 87.8 m-70 -88.4 -19.51 26.49 Favored 'General case' 0 N--CA 1.514 2.774 0 C-N-CA 118.472 -1.291 . . . . 2.07 111.231 179.09 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.417 ' O ' ' C ' ' A' ' 26' ' ' ASP . 61.1 m -101.16 3.76 41.41 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 107.441 -1.318 . . . . 2.46 107.441 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.576 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER 41.03 53.97 3.31 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.875 -0.787 . . . . 1.96 108.875 -179.218 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.616 HG22 ' HD3' ' A' ' 29' ' ' PRO . 1.3 m -97.3 110.74 23.23 Favored 'General case' 0 N--CA 1.485 1.285 0 O-C-N 121.528 -0.732 . . . . 2.4 109.393 -179.123 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.431 ' HD3' ' O ' ' A' ' 27' ' ' THR . 19.2 mmt180 -129.51 63.33 67.47 Favored Pre-proline 0 N--CA 1.49 1.538 0 N-CA-C 107.996 -1.113 . . . . 2.94 107.996 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.616 ' HD3' HG22 ' A' ' 27' ' ' THR . 50.8 Cg_endo -72.56 17.63 0.36 Allowed 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 121.803 1.669 . . . . 1.45 113.973 -177.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -113.72 80.85 5.28 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 120.876 -1.14 . . . . 1.35 108.991 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.34 131.54 8.66 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 C-N-CA 122.109 1.873 . . . . 2.12 113.888 -178.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.429 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -58.94 149.29 27.58 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 121.696 0.76 . . . . 2.29 109.868 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -82.34 -15.44 52.85 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.77 -0.581 . . . . 3.89 112.45 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.545 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 3.9 m-85 -113.95 -50.67 2.81 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.224 -1.548 . . . . 2.88 113.37 -178.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 16.1 p -103.72 7.09 37.25 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.487 -1.383 . . . . 3.03 111.16 -177.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.542 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 73.85 -1.6 45.7 Favored Glycine 0 N--CA 1.492 2.427 0 O-C-N 121.29 -0.881 . . . . 2.64 114.312 176.411 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.542 ' O ' ' O ' ' A' ' 36' ' ' GLY . 11.8 mttp -41.89 166.0 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.212 0 CA-C-N 120.679 2.24 . . . . 3.06 108.85 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.423 ' N ' ' HE ' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -128.81 133.13 47.93 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.401 -0.963 . . . . 3.4 108.401 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -126.71 174.34 8.81 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.34 -0.85 . . . . 1.49 109.255 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.573 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -115.36 -7.26 12.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 122.0 -0.437 . . . . 2.07 110.505 -179.383 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.416 ' O ' ' C ' ' A' ' 42' ' ' LYS . 85.0 mt-30 -132.13 124.0 28.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.694 -1.254 . . . . 2.11 109.358 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.416 ' C ' ' O ' ' A' ' 41' ' ' GLN . 84.6 tttt -42.05 -65.15 0.49 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.129 -0.982 . . . . 1.95 110.257 -178.045 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.8 p -49.2 -32.98 11.39 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.733 -0.604 . . . . 1.09 111.101 -178.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.2 -48.63 70.01 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.752 -1.217 . . . . 1.9 107.744 177.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.541 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 10.8 tmm? -62.84 -46.84 86.05 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.472 -1.392 . . . . 0.95 108.617 177.596 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.499 ' O ' ' OG1' ' A' ' 49' ' ' THR . 35.1 mmtt -53.34 -41.21 65.53 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 120.87 -1.144 . . . . 2.03 108.711 -178.287 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -63.51 -32.82 74.38 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.168 -1.419 . . . . 1.65 107.168 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.703 ' O ' HG12 ' A' ' 51' ' ' ILE . 47.0 t60 -68.66 -61.25 1.9 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.896 -1.52 . . . . 1.78 106.896 176.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.501 ' O ' HG23 ' A' ' 53' ' ' THR . 24.1 p -41.9 -34.77 0.72 Allowed 'General case' 0 N--CA 1.486 1.35 0 O-C-N 120.323 -1.485 . . . . 1.07 109.281 178.5 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.605 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 5.2 m-30 -69.26 -32.27 71.35 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.806 -1.184 . . . . 0.86 108.918 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.703 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.0 pt -61.85 -34.16 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 C-N-CA 118.318 -1.353 . . . . 1.93 107.72 175.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -75.07 -27.72 60.06 Favored 'General case' 0 N--CA 1.51 2.548 0 C-N-CA 117.775 -1.57 . . . . 2.21 109.309 176.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.605 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 68.1 p -91.53 -2.06 57.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.16 -0.962 . . . . 1.31 110.279 -177.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.36 17.89 2.07 Favored Glycine 0 N--CA 1.502 3.038 0 N-CA-C 109.944 -1.262 . . . . 1.07 109.944 -177.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.611 ' O ' ' C ' ' A' ' 56' ' ' LYS . 77.4 mt-10 -75.74 20.27 0.18 Allowed 'General case' 0 N--CA 1.506 2.339 0 N-CA-C 115.836 1.791 . . . . 1.27 115.836 -176.092 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.611 ' C ' ' O ' ' A' ' 55' ' ' GLU . 3.0 mptp? -24.57 96.81 0.06 OUTLIER Pre-proline 0 N--CA 1.508 2.457 0 O-C-N 121.058 -1.026 . . . . 1.14 110.867 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.448 ' N ' ' O ' ' A' ' 55' ' ' GLU . 2.4 Cg_endo -78.86 -19.84 10.75 Favored 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 122.971 2.447 . . . . 0.73 112.431 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -81.65 102.65 10.82 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.908 -1.145 . . . . 0.74 107.908 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.672 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 86.5 mttt -104.55 118.02 35.55 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.915 -1.115 . . . . 0.94 111.595 -177.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 26.8 t -83.71 125.37 31.81 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.229 -0.919 . . . . 1.11 108.739 178.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.672 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 1.1 mm-40 -96.92 13.82 27.52 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.212 -0.93 . . . . 1.9 111.26 -177.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.728 HG11 ' CG ' ' A' ' 80' ' ' HIS . 97.1 t -87.13 -34.88 7.85 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.086 0 N-CA-C 106.338 -1.727 . . . . 1.65 106.338 178.22 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 26.6 p -123.58 -30.13 3.66 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 114.846 -1.07 . . . . 1.53 108.261 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.02 13.51 31.33 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 111.16 -0.776 . . . . 1.23 111.16 178.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -97.33 132.77 42.75 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.283 -1.716 . . . . 2.2 111.206 -177.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.19 148.24 23.07 Favored 'General case' 0 N--CA 1.508 2.456 0 CA-C-O 122.227 1.013 . . . . 0.76 113.685 -177.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.456 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 88.5 m-85 -128.92 151.13 49.98 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.992 0.901 . . . . 0.75 111.534 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.447 ' OG ' ' HG3' ' A' ' 69' ' ' GLN . 16.9 p -86.63 -10.35 54.04 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 115.798 -0.637 . . . . 1.19 109.768 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.447 ' HG3' ' OG ' ' A' ' 68' ' ' SER . 56.5 mt-30 -132.31 142.97 49.56 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.249 -0.907 . . . . 1.75 111.146 -177.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.7 p -66.51 -44.48 82.42 Favored 'General case' 0 C--O 1.198 -1.638 0 N-CA-C 107.174 -1.417 . . . . 1.12 107.174 177.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.2 t -52.41 -42.59 64.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.231 -0.918 . . . . 1.41 109.915 -179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.442 ' O ' ' HB3' ' A' ' 76' ' ' HIS . 2.9 m-20 -70.16 -30.29 67.4 Favored 'General case' 0 C--N 1.298 -1.674 0 C-N-CA 118.084 -1.446 . . . . 1.35 107.913 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.9 tp -73.49 -42.1 62.27 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.941 -1.133 . . . . 0.74 107.941 177.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 90.7 mt -59.67 -53.63 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 O-C-N 120.826 -1.171 . . . . 1.11 109.111 179.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 2.5 m -63.97 -48.98 74.33 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 122.374 1.083 . . . . 0.82 108.746 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.456 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 15.8 t60 -51.65 -45.47 63.38 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 123.079 1.418 . . . . 0.94 107.852 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 44.8 t -67.23 -35.61 79.93 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 120.581 -1.324 . . . . 1.21 108.288 178.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 82' ' ' GLY . 2.2 mmm180 -55.81 -35.14 66.0 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 106.986 -1.487 . . . . 2.36 106.986 178.835 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -63.98 -44.37 92.9 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.193 -1.403 . . . . 1.19 108.061 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.728 ' CG ' HG11 ' A' ' 62' ' ' VAL . 68.5 m-70 -57.44 -62.61 1.65 Allowed 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 116.139 -2.225 . . . . 1.5 108.304 178.047 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.446 ' O ' ' C ' ' A' ' 82' ' ' GLY . 29.4 p -80.19 21.48 0.59 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.516 -0.74 . . . . 1.56 109.509 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.494 2.548 0 N-CA-C 109.796 -1.321 . . . . 2.6 109.796 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.599 ' CB ' HD22 ' A' ' 17' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 CA-C-O 121.47 0.652 . . . . 1.15 109.569 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.505 ' OD2' ' N ' ' A' ' 5' ' ' LYS . 8.5 t70 -108.61 142.99 38.26 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 121.998 0.904 . . . . 2.37 110.269 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.522 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER -66.67 -36.48 82.63 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.142 -0.688 . . . . 2.2 109.142 179.212 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 4' ' ' CYS . 73.6 mttt 75.06 -23.81 0.23 Allowed 'General case' 0 N--CA 1.498 1.956 0 CA-C-O 121.037 0.446 . . . . 2.81 110.159 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.591 ' HB ' ' CD2' ' A' ' 24' ' ' HIS . 12.7 mm -67.84 -66.95 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 O-C-N 120.932 -1.105 . . . . 2.96 109.746 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.9 p -94.31 -24.5 17.39 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.275 -0.89 . . . . 3.14 109.95 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.94 38.51 1.69 Allowed Glycine 0 N--CA 1.496 2.695 0 C-N-CA 120.081 -1.057 . . . . 2.68 112.404 177.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.413 ' O ' ' OD1' ' A' ' 3' ' ' ASP . 19.0 ttmm -115.08 154.37 29.02 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.482 -1.599 . . . . 2.82 108.49 178.076 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.54 ' C ' ' CD1' ' A' ' 11' ' ' PHE . 44.8 m -112.04 163.7 13.98 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 122.112 0.958 . . . . 1.78 111.985 -177.191 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.636 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.2 m-85 -141.46 124.71 16.47 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 122.226 1.012 . . . . 1.25 110.738 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -68.67 -30.56 69.26 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 122.175 0.988 . . . . 2.04 109.158 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.95 132.79 56.37 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-N 115.646 -0.707 . . . . 2.51 109.296 -178.211 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.408 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 7.2 t -59.21 -30.41 68.21 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 118.741 -1.184 . . . . 1.65 109.903 -178.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.3 t -63.37 -47.53 81.71 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 120.278 -1.514 . . . . 2.34 109.365 -179.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.9 m -61.81 -30.73 71.01 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.312 -1.366 . . . . 1.36 107.312 179.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.599 HD22 ' CB ' ' A' ' 2' ' ' PHE . 11.5 tp -74.2 -35.84 63.95 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 107.022 -1.473 . . . . 1.04 107.022 177.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.6 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 32.7 t -56.42 -58.9 6.04 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.718 -1.239 . . . . 1.13 108.223 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.505 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 55.1 m -55.87 -38.77 70.57 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.726 0.774 . . . . 1.47 109.83 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.636 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 45.3 t60 -66.65 -44.37 82.07 Favored 'General case' 0 C--N 1.294 -1.843 0 O-C-N 120.742 -1.224 . . . . 1.68 108.247 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.7 mt -61.46 -29.75 70.16 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 106.363 -1.717 . . . . 1.28 106.363 178.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 18' ' ' SER . 21.9 mt -66.16 -29.9 70.27 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 106.621 -1.622 . . . . 1.04 106.621 177.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.432 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 88.4 mt -65.33 -36.58 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 O-C-N 120.577 -1.327 . . . . 2.13 108.304 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.591 ' CD2' ' HB ' ' A' ' 6' ' ' ILE . 72.1 m-70 -82.06 -28.99 32.11 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 118.149 -1.42 . . . . 2.15 110.563 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.449 ' OG ' ' OG1' ' A' ' 27' ' ' THR . 35.0 p -92.42 -1.82 56.74 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.681 -1.262 . . . . 1.07 108.22 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 48.4 m-20 44.5 65.35 1.08 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 115.95 -0.568 . . . . 1.04 110.134 -179.355 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.449 ' OG1' ' OG ' ' A' ' 25' ' ' SER . 0.6 OUTLIER -104.65 112.2 25.2 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.425 -0.954 . . . . 1.06 108.425 179.262 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.586 HH21 ' CG ' ' A' ' 40' ' ' HIS . 0.4 OUTLIER -124.16 72.7 56.53 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.311 -0.868 . . . . 2.36 108.81 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -74.43 9.77 1.74 Allowed 'Trans proline' 0 C--N 1.312 -1.38 0 C-N-CA 122.037 1.825 . . . . 1.61 113.514 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -114.49 81.73 7.11 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.005 -1.06 . . . . 1.92 108.656 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 50.0 Cg_endo -75.93 137.98 20.33 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.253 1.968 . . . . 1.84 113.037 -178.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.597 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -64.79 137.27 57.68 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 107.893 -1.151 . . . . 1.91 107.893 179.223 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.473 ' H ' ' CD ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -78.1 -15.04 59.23 Favored 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.497 -0.752 . . . . 2.78 110.663 -178.834 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.435 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 40.4 m-85 -110.97 -72.88 0.7 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.613 -1.304 . . . . 2.49 111.747 -178.402 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.554 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.9 p -85.16 2.04 45.38 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.071 -1.018 . . . . 2.69 111.472 -178.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.458 ' C ' ' HB3' ' A' ' 32' ' ' CYS . . . 80.84 -12.49 35.47 Favored Glycine 0 N--CA 1.504 3.19 0 O-C-N 120.94 -1.1 . . . . 2.24 114.289 175.038 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.597 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 1.8 mttm -47.58 119.39 2.71 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 119.561 1.68 . . . . 2.44 109.247 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.459 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 35.6 mtt180 -98.77 135.69 39.87 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.945 -1.097 . . . . 2.52 110.976 -178.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.516 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 28.2 m-85 -115.23 174.47 5.98 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.416 -0.803 . . . . 1.14 110.147 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.599 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -107.05 -19.68 13.54 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 116.306 -0.407 . . . . 1.76 110.751 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.53 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 48.8 mt-30 -114.46 110.48 19.91 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 120.718 -1.239 . . . . 2.83 110.032 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.491 ' C ' ' O ' ' A' ' 41' ' ' GLN . 44.6 tttp -34.33 -57.11 0.5 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.232 -0.917 . . . . 2.74 110.892 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.06 -33.79 63.03 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.408 -0.808 . . . . 2.53 111.073 -178.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.734 ' OD1' ' N ' ' A' ' 45' ' ' MET . 35.2 p30 -71.18 -37.5 72.15 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.181 -1.408 . . . . 2.2 108.072 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.734 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 9.9 ttp -67.71 -47.42 69.43 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 120.319 -1.488 . . . . 1.47 108.061 177.509 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.488 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 36.6 mttm -50.2 -41.23 49.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.636 -1.29 . . . . 2.66 107.565 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.592 ' O ' HG23 ' A' ' 51' ' ' ILE . 36.5 mttm -60.85 -35.06 75.6 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 106.709 -1.589 . . . . 3.38 106.709 178.01 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.712 ' O ' HG12 ' A' ' 51' ' ' ILE . 61.5 t60 -67.37 -67.64 0.44 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.494 -1.298 . . . . 1.42 107.494 177.494 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.488 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 32.0 p -40.75 -33.02 0.25 Allowed 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.657 -1.277 . . . . 0.84 110.546 178.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.566 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.4 m-85 -70.96 -35.83 72.31 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 120.804 -1.185 . . . . 1.68 109.352 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.712 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.1 pt -63.45 -29.19 46.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 C-N-CA 118.461 -1.295 . . . . 1.82 108.508 176.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -81.0 -29.44 35.21 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 120.315 -1.491 . . . . 1.74 109.92 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.566 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 75.0 p -91.29 2.29 56.49 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.237 -0.914 . . . . 0.83 112.181 -176.485 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 58.73 56.08 27.26 Favored Glycine 0 N--CA 1.486 2.033 0 N-CA-C 107.706 -2.157 . . . . 1.18 107.706 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.465 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 62.0 mt-10 -114.12 128.58 56.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.456 -1.026 . . . . 2.01 109.943 -178.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 68' ' ' SER . 38.1 mttm -143.29 67.27 16.72 Favored Pre-proline 0 C--N 1.304 -1.372 0 N-CA-C 108.754 -0.832 . . . . 1.69 108.754 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.48 -11.71 14.75 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 122.29 1.993 . . . . 1.56 112.532 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.537 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 62.5 m80 -101.19 90.61 4.19 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.996 -1.113 . . . . 1.53 107.996 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 26.3 mtpt -91.99 125.82 36.83 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 121.799 0.809 . . . . 2.42 110.778 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.661 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 1.7 t -43.48 -91.52 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.837 -0.539 . . . . 1.38 110.718 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.661 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 6.6 mm-40 122.31 -20.9 0.01 OUTLIER 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 121.604 0.716 . . . . 2.22 110.574 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.401 ' HB ' ' NE2' ' A' ' 80' ' ' HIS . 21.8 t -87.98 -43.26 15.42 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.136 0 CA-C-O 122.038 0.923 . . . . 1.86 109.274 -179.033 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 18.8 p -122.92 -6.15 8.48 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.675 -0.693 . . . . 2.1 109.966 -178.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.49 29.58 32.52 Favored Glycine 0 N--CA 1.496 2.682 0 O-C-N 120.942 -1.099 . . . . 1.83 111.858 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 60' ' ' CYS . 6.6 tttp -101.29 157.22 16.95 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 105.558 -2.016 . . . . 2.42 105.558 176.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -131.97 152.18 51.27 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.462 -1.399 . . . . 1.38 112.966 -176.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.611 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 60.6 m-85 -134.71 138.93 44.82 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 122.151 0.977 . . . . 1.51 112.369 -178.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 34.0 p -68.89 -26.38 65.08 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.738 -1.208 . . . . 1.74 107.738 177.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -116.51 151.62 35.74 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 122.002 0.906 . . . . 2.56 112.851 -176.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.627 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.9 OUTLIER -78.29 -47.27 18.21 Favored 'General case' 0 C--O 1.19 -2.037 0 N-CA-C 107.57 -1.27 . . . . 2.11 107.57 175.399 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.577 ' C ' ' O ' ' A' ' 70' ' ' SER . 15.7 p -39.75 -41.4 1.09 Allowed 'General case' 0 C--N 1.301 -1.519 0 O-C-N 120.441 -1.412 . . . . 2.32 107.782 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -79.79 -31.99 40.82 Favored 'General case' 0 C--N 1.291 -1.94 0 C-N-CA 119.65 -0.82 . . . . 2.16 108.916 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.627 ' N ' ' O ' ' A' ' 70' ' ' SER . 30.7 tp -72.76 -40.78 65.73 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.601 -1.312 . . . . 1.38 108.553 177.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 97.2 mt -59.92 -52.19 64.04 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 O-C-N 120.937 -1.102 . . . . 2.1 108.255 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.2 m -60.33 -47.32 86.56 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.866 -1.146 . . . . 2.41 109.511 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.611 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 19.4 t60 -56.86 -39.95 75.25 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 122.419 1.104 . . . . 1.8 108.191 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 53.4 p -71.51 -34.39 70.06 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.898 -1.127 . . . . 1.74 108.684 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -57.83 -32.67 67.83 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.428 -1.323 . . . . 2.71 107.428 178.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -69.16 -48.26 62.75 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.904 -1.147 . . . . 3.5 107.904 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.401 ' NE2' ' HB ' ' A' ' 62' ' ' VAL . 50.9 m-70 -58.39 -55.25 37.42 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 117.283 -1.767 . . . . 2.34 109.247 178.676 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 60.6 m -56.98 -52.79 63.83 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.114 -1.034 . . . . 2.64 108.895 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.63 -1.388 . . . . 2.98 109.63 179.55 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.31 0.576 . . . . 2.41 109.828 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.622 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.2 m-85 -96.47 122.24 39.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.414 -0.804 . . . . 1.84 109.105 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.599 ' OD1' ' N ' ' A' ' 4' ' ' CYS . 45.5 t0 -107.25 133.38 51.9 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-O 123.013 1.387 . . . . 1.54 110.166 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.599 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 1.7 t -66.56 131.0 45.05 Favored 'General case' 0 C--N 1.288 -2.083 0 CA-C-N 113.682 -1.599 . . . . 1.01 110.327 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.33 32.11 1.82 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.409 -0.807 . . . . 2.54 110.162 -178.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.0 mm -126.81 -71.17 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 120.871 -1.143 . . . . 1.84 109.554 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.533 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 30.6 p -84.34 -50.67 7.61 Favored 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 119.325 -0.95 . . . . 2.08 108.479 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.533 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 123.34 52.24 0.2 Allowed Glycine 0 N--CA 1.496 2.661 0 C-N-CA 120.83 -0.7 . . . . 1.69 112.437 177.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -127.98 164.12 23.04 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.82 -1.4 . . . . 1.94 109.623 178.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.4 t -112.81 159.09 19.35 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.686 1.232 . . . . 2.02 113.198 -176.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 51.9 m-85 -139.16 125.36 20.13 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 114.968 -1.014 . . . . 1.73 109.784 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -68.29 -22.37 64.73 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 108.869 -0.789 . . . . 2.69 108.869 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.683 HH21 ' N ' ' A' ' 15' ' ' SER . 0.0 OUTLIER -119.5 133.45 55.68 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.034 -0.728 . . . . 3.61 109.034 -178.62 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.622 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 40.5 t -57.42 -33.36 67.81 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.004 -1.06 . . . . 1.87 108.259 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.683 ' N ' HH21 ' A' ' 13' ' ' ARG . 30.5 t -66.44 -39.41 88.88 Favored 'General case' 0 C--N 1.308 -1.213 0 O-C-N 121.626 -0.671 . . . . 2.18 110.301 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -34.35 77.89 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 106.473 -1.677 . . . . 2.02 106.473 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.0 tp -70.6 -43.44 69.34 Favored 'General case' 0 C--O 1.202 -1.411 0 N-CA-C 106.256 -1.757 . . . . 1.19 106.256 176.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.635 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 16.4 t -49.93 -62.62 1.46 Allowed 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.529 -1.357 . . . . 2.24 109.451 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 88.0 m -54.19 -36.57 63.57 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 122.414 1.102 . . . . 1.49 108.757 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 49.9 t60 -65.47 -46.38 80.03 Favored 'General case' 0 C--N 1.284 -2.243 0 O-C-N 121.097 -1.002 . . . . 1.09 109.311 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 78.5 mt -60.91 -27.69 68.37 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 106.861 -1.533 . . . . 0.52 106.861 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 18' ' ' SER . 27.4 mt -70.03 -27.35 64.59 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 107.253 -1.388 . . . . 1.01 107.253 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.423 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 95.3 mt -65.41 -39.96 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 O-C-N 120.507 -1.37 . . . . 1.22 108.111 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -73.22 -47.31 44.44 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 117.813 -1.555 . . . . 1.29 108.763 177.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.506 ' OG ' ' OG1' ' A' ' 27' ' ' THR . 25.7 p -73.89 -3.31 28.07 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 120.564 -1.335 . . . . 1.71 110.033 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 44.4 63.51 1.63 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.575 -0.703 . . . . 1.82 109.786 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.506 ' OG1' ' OG ' ' A' ' 25' ' ' SER . 1.3 m -101.27 111.86 24.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.968 -1.082 . . . . 1.02 108.651 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.423 ' HE ' ' HB3' ' A' ' 40' ' ' HIS . 4.6 mmt85 -126.0 71.98 69.59 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.432 -0.792 . . . . 1.31 109.989 -178.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -73.94 12.15 1.02 Allowed 'Trans proline' 0 C--N 1.308 -1.583 0 C-N-CA 121.954 1.769 . . . . 1.26 113.789 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.411 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 61.6 m-85 -117.23 87.11 22.71 Favored Pre-proline 0 N--CA 1.501 2.108 0 N-CA-C 108.046 -1.094 . . . . 1.57 108.046 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -84.96 131.12 4.29 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.642 2.228 . . . . 1.15 113.047 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.582 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 1.1 t -51.51 140.59 17.67 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 121.927 0.87 . . . . 0.97 108.799 177.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.476 HE21 HG21 ' A' ' 49' ' ' THR . 0.1 OUTLIER -80.16 -17.32 52.79 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.861 -0.792 . . . . 3.19 108.861 179.632 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.569 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 30.5 m-85 -110.58 -76.75 0.6 Allowed 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 119.101 -1.04 . . . . 1.15 112.424 -178.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.544 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 14.8 p -81.77 20.98 0.88 Allowed 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 122.406 1.098 . . . . 1.07 110.714 -177.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.432 ' O ' ' C ' ' A' ' 37' ' ' LYS . . . 48.48 9.53 0.09 OUTLIER Glycine 0 N--CA 1.508 3.458 0 N-CA-C 115.513 0.965 . . . . 0.9 115.513 176.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.582 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 13.1 mttp -54.35 174.95 0.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 122.503 3.152 . . . . 0.82 107.802 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 83.8 mtm-85 -134.13 131.64 38.94 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.977 -1.077 . . . . 1.77 109.853 -178.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.404 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 55.5 m-85 -123.44 165.08 17.67 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.74 -0.837 . . . . 0.85 108.74 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.611 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -108.96 12.76 25.13 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.772 -0.58 . . . . 1.17 109.98 179.78 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -144.77 113.35 6.67 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.868 -1.145 . . . . 1.74 109.74 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.411 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 57.8 tttm -37.88 -72.2 0.06 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.324 -0.86 . . . . 2.81 112.984 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 85.5 p -47.37 -34.98 7.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.367 -0.833 . . . . 1.45 111.205 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -67.92 -40.3 83.41 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 117.524 -1.67 . . . . 1.17 107.395 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.691 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 11.1 tmm? -66.55 -47.15 73.75 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 120.711 -1.243 . . . . 1.35 107.974 176.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.497 ' O ' ' OG1' ' A' ' 49' ' ' THR . 6.0 tptp -54.07 -37.61 64.4 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.012 -1.055 . . . . 1.6 108.531 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.506 ' NZ ' ' CB ' ' A' ' 47' ' ' LYS . 8.2 mtmp? -67.25 -29.19 68.74 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 106.14 -1.8 . . . . 2.17 106.14 177.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.691 ' HB3' ' O ' ' A' ' 45' ' ' MET . 61.4 t60 -68.22 -66.31 0.58 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 106.776 -1.564 . . . . 0.47 106.776 175.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 41.1 p -38.92 -33.04 0.1 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.732 -1.23 . . . . 0.78 111.667 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.602 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.9 m-30 -75.16 -37.85 61.13 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.224 -0.658 . . . . 0.89 109.224 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.688 HD13 ' OP2' ' B' ' 106' ' ' ' DA' . 14.9 pt -59.07 -24.1 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 105.017 -2.216 . . . . 0.61 105.017 176.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.914 ' O ' ' N ' ' A' ' 54' ' ' GLY . 83.4 m-70 -80.11 -103.12 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 101.514 -3.513 . . . . 0.77 101.514 170.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.602 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 72.7 p -8.68 -37.03 0.0 OUTLIER 'General case' 0 N--CA 1.518 2.927 0 C-N-CA 124.134 0.974 . . . . 0.77 112.6 -175.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.914 ' N ' ' O ' ' A' ' 52' ' ' HIS . . . 98.99 21.18 16.31 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 110.591 -1.004 . . . . 0.51 110.591 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.483 ' HB2' ' CG ' ' A' ' 50' ' ' PHE . 30.1 mt-10 -82.51 125.64 31.34 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.481 -1.011 . . . . 1.6 112.673 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -134.71 73.92 66.09 Favored Pre-proline 0 N--CA 1.504 2.248 0 N-CA-C 108.493 -0.929 . . . . 2.61 108.493 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -61.11 -11.13 17.37 Favored 'Trans proline' 0 N--CA 1.496 1.619 0 C-N-CA 124.131 3.221 . . . . 0.64 113.964 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -99.65 93.21 5.72 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 118.852 -1.139 . . . . 0.85 109.603 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -93.94 123.27 37.19 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.662 -0.815 . . . . 2.29 111.752 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.502 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -80.4 121.07 25.26 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 106.052 -1.833 . . . . 0.67 106.052 176.478 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -85.58 14.83 5.15 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 120.761 -1.212 . . . . 1.71 108.194 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.691 HG11 ' CG ' ' A' ' 80' ' ' HIS . 21.2 t -93.77 -56.94 4.72 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.723 0 C-N-CA 120.083 -0.647 . . . . 1.03 110.136 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.0 p -121.24 25.65 9.39 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.273 -0.892 . . . . 1.14 111.024 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 58.49 30.94 65.78 Favored Glycine 0 N--CA 1.494 2.524 0 O-C-N 120.856 -1.152 . . . . 0.97 112.706 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -107.3 152.7 23.77 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-N 118.998 1.399 . . . . 1.46 108.511 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -126.5 150.51 48.7 Favored 'General case' 0 N--CA 1.502 2.156 0 CA-C-O 121.807 0.813 . . . . 0.69 111.738 -177.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.539 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 82.7 m-85 -134.34 153.41 51.9 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 122.425 1.107 . . . . 0.97 113.404 -177.402 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.0 m -78.29 -41.1 34.88 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 115.47 -0.786 . . . . 1.51 108.907 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -103.78 144.75 31.07 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.926 0.869 . . . . 2.75 110.56 -177.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.537 ' O ' ' N ' ' A' ' 73' ' ' LEU . 27.9 p -70.61 -45.66 64.85 Favored 'General case' 0 C--O 1.195 -1.804 0 N-CA-C 106.951 -1.5 . . . . 1.14 106.951 178.312 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.58 ' OG ' ' N7 ' ' C' ' 210' ' ' ' DA' . 0.4 OUTLIER -47.01 -43.15 19.25 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.237 -1.023 . . . . 1.47 108.237 179.164 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -69.66 -32.87 71.77 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 107.383 -1.34 . . . . 1.41 107.383 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 70' ' ' SER . 16.2 tp -68.91 -57.54 5.37 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 106.436 -1.69 . . . . 0.68 106.436 176.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.431 ' N ' ' O ' ' A' ' 70' ' ' SER . 79.2 mt -42.9 -57.38 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 O-C-N 121.0 -1.062 . . . . 1.05 110.185 178.236 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.7 m -59.21 -41.82 89.48 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.015 -1.053 . . . . 1.24 108.659 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.539 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 22.7 t60 -59.93 -43.74 94.76 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 122.216 1.007 . . . . 0.84 108.37 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.9 t -68.29 -36.4 79.32 Favored 'General case' 0 C--N 1.309 -1.164 0 O-C-N 120.875 -1.141 . . . . 0.59 108.123 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 85.5 mtt-85 -54.75 -38.57 67.33 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 107.597 -1.26 . . . . 1.98 107.597 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 34.7 mttp -64.99 -43.88 91.12 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 118.714 -1.195 . . . . 2.09 107.98 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.691 ' CG ' HG11 ' A' ' 62' ' ' VAL . 49.9 m-70 -62.15 -44.37 96.77 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 117.186 -1.806 . . . . 0.91 108.713 177.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.1 m -51.64 -57.08 10.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.625 -0.672 . . . . 0.95 109.564 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 109.513 -1.435 . . . . 1.87 109.513 179.876 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.956 0 O4'-C4'-C3' 107.262 1.662 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.858 0 O4'-C4'-C3' 107.122 1.522 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 103' ' ' ' DT' . . . . . 0.462 ' O4 ' ' N6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.732 0 C1'-O4'-C4' 106.19 -2.507 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' ' DA' . . . . . 0.577 ' C6 ' ' C5 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.031 0 O4'-C4'-C3' 107.083 1.483 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 105' ' ' ' DA' . . . . . 0.577 ' C5 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.221 0 C1'-O4'-C4' 107.584 -1.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.688 ' OP2' HD13 ' A' ' 51' ' ' ILE . . . . . . . . 0 C5'--C4' 1.526 1.925 0 P-O3'-C3' 122.493 2.328 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.54 2.219 0 C1'-O4'-C4' 106.364 -2.383 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 108' ' ' ' DC' . . . . . 0.566 ' O2 ' ' H2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.79 0 O4'-C4'-C3' 107.154 1.554 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 109' ' ' ' DA' . . . . . 0.596 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.515 0 C1'-O4'-C4' 107.524 -1.554 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 110' ' ' ' DC' . . . . . 0.596 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.038 0 P-O3'-C3' 121.986 1.905 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.538 1.977 0 C1'-O4'-C4' 107.41 -1.636 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 112' ' ' ' DG' . . . . . 0.51 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.777 0 O4'-C4'-C3' 107.392 1.792 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.51 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.991 0 O4'-C4'-C3' 107.049 1.449 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.906 0 C4'-C3'-C2' 104.936 1.736 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.815 0 C4'-C3'-C2' 104.826 1.626 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.953 0 O4'-C4'-C3' 107.272 1.672 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.835 0 O4'-C4'-C3' 107.225 1.625 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.828 0 C4'-C3'-C2' 104.862 1.662 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.9 0 C1'-O4'-C4' 107.194 -1.79 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.988 0 C1'-O4'-C4' 107.451 -1.607 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.751 0 C4'-C3'-C2' 104.794 1.594 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.888 0 O4'-C4'-C3' 107.392 1.792 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.959 0 O4'-C4'-C3' 107.292 1.692 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.005 0 C1'-O4'-C4' 106.846 -2.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 209' ' ' ' DG' . . . . . 0.57 ' N2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.535 1.698 0 C4'-C3'-C2' 104.881 1.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 210' ' ' ' DA' . . . . . 0.595 ' C2 ' ' C2 ' ' C' ' 211' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.531 1.307 0 O4'-C4'-C3' 107.319 1.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 211' ' ' ' DT' . . . . . 0.595 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.425 -1.937 0 C1'-O4'-C4' 106.278 -2.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 212' ' ' ' DT' . . . . . 0.439 ' C2 ' ' C6 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.534 1.59 0 C1'-O4'-C4' 106.685 -2.153 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 213' ' ' ' DT' . . . . . 0.455 ' O4 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.75 0 C1'-O4'-C4' 107.089 -1.865 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 214' ' ' ' DA' . . . . . 0.455 ' N6 ' ' O4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.139 0 O4'-C4'-C3' 107.169 1.569 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 215' ' ' ' DT' . . . . . 0.409 ' C4 ' ' C5 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.023 0 C1'-O4'-C4' 107.195 -1.789 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.024 0 O4'-C4'-C3' 107.287 1.687 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 78.1 p . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.352 -0.611 . . . . 1.46 109.352 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.62 ' CE1' ' N ' ' A' ' 14' ' ' SER . 4.2 m-85 -85.88 128.42 34.82 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.183 -0.948 . . . . 1.18 108.723 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.618 ' OD1' ' N ' ' A' ' 4' ' ' CYS . 61.3 t0 -108.19 136.55 47.66 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.816 1.294 . . . . 1.38 110.85 -179.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.618 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 1.7 t -68.54 126.57 30.08 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 114.589 -1.187 . . . . 0.5 109.386 178.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.524 ' HD2' ' H ' ' A' ' 5' ' ' LYS . 2.3 mptt -92.59 26.69 2.56 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.359 -0.838 . . . . 1.53 109.308 -178.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.438 HD12 ' CD2' ' A' ' 24' ' ' HIS . 74.7 mt -125.27 -72.04 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.37 -0.831 . . . . 1.05 111.247 -179.066 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 29.7 p -86.54 -45.73 10.81 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.694 -1.254 . . . . 0.83 110.899 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.401 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 126.17 45.5 0.23 Allowed Glycine 0 N--CA 1.5 2.905 0 O-C-N 121.1 -1.0 . . . . 0.54 112.267 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -127.28 156.0 42.62 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.972 -1.311 . . . . 1.25 108.918 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.433 ' C ' ' CD1' ' A' ' 11' ' ' PHE . 54.4 m -113.32 165.15 12.71 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.64 -1.288 . . . . 0.86 112.579 -176.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.553 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 46.4 m-85 -142.12 124.81 15.91 Favored 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 121.665 0.745 . . . . 0.93 110.72 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -62.44 -24.57 67.5 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.775 -0.824 . . . . 1.99 108.775 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.431 ' NH2' ' O6 ' ' C' ' 204' ' ' ' DG' . 2.9 mmm180 -119.64 138.39 53.28 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.182 -0.673 . . . . 2.89 109.182 -179.115 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.62 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 1.0 OUTLIER -64.44 -37.79 88.77 Favored 'General case' 0 C--N 1.301 -1.504 0 C-N-CA 118.991 -1.084 . . . . 1.09 108.834 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.4 p -55.81 -48.89 74.62 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 107.799 -1.186 . . . . 1.18 107.799 178.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -36.53 70.27 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 107.671 -1.233 . . . . 1.07 107.671 178.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 tp -70.95 -34.85 71.87 Favored 'General case' 0 C--O 1.201 -1.472 0 N-CA-C 107.312 -1.366 . . . . 0.63 107.312 177.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.588 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 18.5 p -58.98 -60.6 3.61 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.038 -1.038 . . . . 1.16 108.888 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.481 ' N ' ' OG ' ' A' ' 18' ' ' SER . 68.3 m -52.8 -34.39 53.31 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 122.063 0.935 . . . . 0.74 108.518 179.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.553 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 63.1 t60 -68.39 -45.81 71.71 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-O 122.809 1.29 . . . . 0.65 108.323 178.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 21' ' ' LEU . 38.1 mt -58.05 -35.82 71.89 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 106.753 -1.573 . . . . 0.65 106.753 178.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 18' ' ' SER . 13.3 mt -62.86 -35.63 80.61 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.466 -0.939 . . . . 0.84 108.466 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.692 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 67.9 mt -57.58 -34.93 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 O-C-N 120.322 -1.486 . . . . 1.05 108.548 177.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.438 ' CD2' HD12 ' A' ' 6' ' ' ILE . 88.9 m-70 -81.15 -36.08 30.69 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.431 -1.308 . . . . 1.15 111.497 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.637 ' O ' ' CG ' ' A' ' 26' ' ' ASP . 1.3 m -83.56 -59.86 2.31 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.421 -1.424 . . . . 1.22 108.649 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.637 ' CG ' ' O ' ' A' ' 25' ' ' SER . 3.3 p-10 97.66 54.63 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.966 0 CA-C-O 122.039 0.923 . . . . 2.33 110.19 178.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.583 HG21 HD13 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -63.84 -46.83 83.28 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.3 -0.875 . . . . 1.04 108.944 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.499 ' NH1' ' ND1' ' A' ' 40' ' ' HIS . 0.4 OUTLIER 36.33 65.83 2.05 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.558 -0.714 . . . . 0.94 110.374 179.586 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -88.94 12.29 2.78 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.595 2.197 . . . . 0.7 113.752 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.414 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 69.8 m-85 -117.45 86.15 21.88 Favored Pre-proline 0 N--CA 1.498 1.973 0 O-C-N 121.009 -1.057 . . . . 0.63 109.354 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -84.99 130.96 4.22 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 123.043 2.495 . . . . 0.85 114.063 -178.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.53 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -53.04 139.43 28.16 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 122.1 0.952 . . . . 0.83 110.376 179.025 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.433 ' CD ' ' N ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -81.64 -20.96 38.56 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.485 -0.779 . . . . 1.13 110.201 179.711 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.53 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 22.4 m-85 -103.95 -73.38 0.67 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.632 -1.292 . . . . 0.99 111.993 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.465 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 20.4 p -78.83 -19.48 51.94 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.849 -1.157 . . . . 1.04 112.139 -177.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.27 -7.67 58.51 Favored Glycine 0 N--CA 1.509 3.562 0 O-C-N 120.405 -1.434 . . . . 0.91 115.18 175.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -51.15 168.42 0.06 Allowed 'General case' 0 N--CA 1.502 2.155 0 CA-C-N 121.126 2.463 . . . . 2.38 109.522 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.463 ' N ' ' NE ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -125.8 133.21 52.09 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.719 -1.238 . . . . 1.47 109.08 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -118.95 166.53 12.73 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.482 -0.761 . . . . 0.51 109.885 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.521 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -102.81 2.71 35.87 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.796 -0.565 . . . . 0.79 111.036 -179.601 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' A' ' 42' ' ' LYS . 38.8 mt-30 -146.62 118.08 7.96 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.467 -1.395 . . . . 1.15 111.055 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 41' ' ' GLN . 37.4 tttm -37.08 -69.46 0.11 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.458 -0.776 . . . . 2.07 111.895 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.1 m -48.07 -27.79 2.5 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.843 -1.16 . . . . 1.35 110.682 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -74.75 -40.18 61.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.994 -1.066 . . . . 0.83 108.172 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.672 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 4.8 tmm? -68.6 -47.44 66.69 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.379 -1.451 . . . . 0.64 107.472 176.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -52.56 -37.55 58.09 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.416 -1.327 . . . . 1.68 107.416 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.52 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.5 mtpt -63.13 -32.84 74.32 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 105.351 -2.092 . . . . 1.12 105.351 176.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.672 ' HB3' ' O ' ' A' ' 45' ' ' MET . 65.0 t60 -69.54 -63.83 1.0 Allowed 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 107.813 -1.18 . . . . 0.61 107.813 177.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.469 ' C ' ' O ' ' A' ' 48' ' ' HIS . 70.5 p -39.9 -38.31 0.67 Allowed 'General case' 0 N--CA 1.482 1.154 0 O-C-N 120.4 -1.438 . . . . 0.51 110.249 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.613 ' CE1' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-85 -70.26 -35.17 73.6 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.166 -0.959 . . . . 0.51 109.503 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.629 HD13 ' OP2' ' B' ' 106' ' ' ' DA' . 4.4 pt -57.45 -21.25 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 C-N-CA 118.158 -1.417 . . . . 0.7 107.392 176.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . 0.286 77.9 m-70 -94.22 -35.86 12.28 Favored 'General case' 0 N--CA 1.53 3.556 0 O-C-N 120.917 -1.115 . . . . 0.77 112.998 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.465 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 68.6 p -74.67 -17.67 60.64 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.748 0.785 . . . . 0.65 109.094 -176.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.63 7.6 68.8 Favored Glycine 0 C--N 1.292 -1.876 0 N-CA-C 107.941 -2.064 . . . . 0.59 107.941 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.613 ' OE1' ' CE1' ' A' ' 50' ' ' PHE . 91.8 mt-10 -73.48 115.41 12.83 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 122.313 1.054 . . . . 1.53 112.409 -177.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.0 mttm -125.2 68.77 58.46 Favored Pre-proline 0 N--CA 1.495 1.818 0 N-CA-C 108.597 -0.89 . . . . 1.67 108.597 177.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.461 ' HD3' ' C ' ' A' ' 55' ' ' GLU . 31.6 Cg_exo -56.69 -10.55 5.45 Favored 'Trans proline' 0 N--CA 1.503 2.074 0 C-N-CA 123.425 2.75 . . . . 0.75 114.487 -179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.436 ' HB3' HD22 ' A' ' 73' ' ' LEU . 62.6 m80 -99.42 85.84 3.25 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.474 -1.391 . . . . 1.02 109.288 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -84.41 124.76 31.67 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.368 -0.833 . . . . 2.52 110.072 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.673 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 0.5 OUTLIER -54.41 -89.02 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.785 0 O-C-N 121.864 -0.523 . . . . 0.89 110.02 179.24 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.673 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 3.9 mm-40 120.06 -10.17 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.372 0 CA-C-O 121.79 0.805 . . . . 1.85 110.238 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.493 HG11 ' CG ' ' A' ' 80' ' ' HIS . 14.5 t -94.69 -53.21 8.6 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-O 122.006 0.908 . . . . 1.35 108.631 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 26.8 p -108.48 -8.67 15.5 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.913 -0.585 . . . . 1.48 110.135 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.68 33.39 16.21 Favored Glycine 0 N--CA 1.498 2.795 0 O-C-N 121.17 -0.956 . . . . 1.06 113.123 177.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.474 ' NZ ' ' OP1' ' B' ' 104' ' ' ' DA' . 11.1 tttm -109.32 174.53 5.82 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.356 -1.673 . . . . 2.5 108.117 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -137.41 156.36 48.29 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.398 -1.439 . . . . 0.8 111.79 -177.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -137.75 147.77 45.01 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 122.522 1.153 . . . . 0.99 113.758 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.0 m -81.21 -27.15 35.41 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 115.023 -0.99 . . . . 1.39 109.428 178.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -120.67 144.15 48.34 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 118.916 -1.114 . . . . 3.01 111.0 -178.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.415 ' HG ' ' CD2' ' A' ' 58' ' ' HIS . 17.1 m -65.12 -42.6 93.77 Favored 'General case' 0 C--O 1.197 -1.674 0 C-N-CA 119.248 -0.981 . . . . 1.45 108.831 178.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.8 m -50.34 -44.26 54.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.038 -1.039 . . . . 1.71 108.524 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -69.04 -33.61 73.87 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 118.48 -1.288 . . . . 2.21 108.731 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.436 HD22 ' HB3' ' A' ' 58' ' ' HIS . 21.2 tp -73.05 -47.16 47.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.414 -1.429 . . . . 0.85 108.907 177.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.451 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 67.8 mt -55.01 -52.68 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.544 -1.347 . . . . 1.54 108.307 178.166 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.668 HG22 ' NZ ' ' A' ' 79' ' ' LYS . 91.8 m -59.14 -47.96 83.37 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 118.878 -1.129 . . . . 1.51 108.182 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.2 t60 -54.75 -49.23 71.36 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.752 0.787 . . . . 0.82 109.84 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.0 t -67.89 -31.22 70.85 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.382 -1.449 . . . . 0.66 108.928 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 44.5 mtp180 -61.42 -31.63 71.57 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 106.805 -1.554 . . . . 2.75 106.805 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.668 ' NZ ' HG22 ' A' ' 75' ' ' THR . 61.5 mttp -67.42 -46.32 73.51 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 107.255 -1.387 . . . . 2.64 107.255 177.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.493 ' CG ' HG11 ' A' ' 62' ' ' VAL . 58.1 m-70 -59.98 -65.94 0.6 Allowed 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 117.383 -1.727 . . . . 0.83 109.275 178.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.5 m -54.74 -55.25 31.92 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.714 -0.616 . . . . 0.75 110.03 -178.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.518 0 N-CA-C 109.243 -1.543 . . . . 1.46 109.243 179.828 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.803 0 C4'-C3'-C2' 104.883 1.683 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 102' ' ' ' DA' . . . . . 0.498 ' N6 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.965 0 O4'-C4'-C3' 107.509 1.909 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' ' DT' . . . . . 0.544 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.747 0 C1'-O4'-C4' 105.801 -2.785 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 104' ' ' ' DA' . . . . . 0.544 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.97 0 C1'-O4'-C4' 107.577 -1.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 105' ' ' ' DA' . . . . . 0.429 ' C4 ' ' C2 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.116 0 O4'-C4'-C3' 107.151 1.551 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.629 ' OP2' HD13 ' A' ' 51' ' ' ILE . . . . . . . . 0 C5'--C4' 1.525 1.72 0 O4'-C4'-C3' 107.1 1.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' ' DT' . . . . . 0.406 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.902 0 C1'-O4'-C4' 106.279 -2.444 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' ' DC' . . . . . 0.692 " H3'" HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C5'--C4' 1.526 1.891 0 C1'-O4'-C4' 107.334 -1.69 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 109' ' ' ' DA' . . . . . 0.565 ' C2 ' ' N2 ' ' C' ' 209' ' ' ' DG' . . . . . . . . 0 P--O5' 1.605 1.186 0 P-O3'-C3' 121.309 1.341 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 110' ' ' ' DC' . . . . . 0.555 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.823 0 O4'-C4'-C3' 107.174 1.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.971 0 C1'-O4'-C4' 106.619 -2.201 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 112' ' ' ' DG' . . . . . 0.477 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.994 0 O4'-C4'-C3' 107.468 1.868 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.477 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O4'-C4'-C3' 107.318 1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.877 0 C4'-C3'-C2' 104.783 1.583 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.766 0 O4'-C4'-C3' 107.26 1.66 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.085 0 O4'-C4'-C3' 107.277 1.677 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.828 0 O4'-C4'-C3' 107.176 1.576 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.964 0 C4'-C3'-C2' 104.848 1.648 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 203' ' ' ' DG' . . . . . 0.554 ' C2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.906 0 C4'-C3'-C2' 104.828 1.628 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 204' ' ' ' DG' . . . . . 0.554 ' C4 ' ' C2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.899 0 C4'-C3'-C2' 104.806 1.606 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.853 0 O4'-C4'-C3' 107.321 1.721 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.702 0 O4'-C4'-C3' 107.218 1.618 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.915 0 O4'-C4'-C3' 107.125 1.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.779 0 C4'-C3'-C2' 104.792 1.592 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 209' ' ' ' DG' . . . . . 0.565 ' N2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.701 0 C1'-O4'-C4' 107.549 -1.536 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 210' ' ' ' DA' . . . . . 0.592 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.754 0 O4'-C4'-C3' 107.498 1.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 211' ' ' ' DT' . . . . . 0.533 ' C4 ' ' C6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.423 -2.092 0 C1'-O4'-C4' 106.676 -2.16 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.869 0 C1'-O4'-C4' 106.927 -1.98 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 213' ' ' ' DT' . . . . . 0.43 ' O4 ' ' O4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.426 -1.799 0 C4'-C3'-C2' 104.968 1.768 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 214' ' ' ' DA' . . . . . 0.498 ' N6 ' ' N6 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.861 0 O4'-C4'-C3' 107.383 1.783 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.89 0 C1'-O4'-C4' 107.189 -1.793 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.936 0 O4'-C4'-C3' 107.252 1.652 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 94.8 p . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.464 0.65 . . . . 1.16 110.349 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.598 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.5 m-85 -94.23 126.98 39.81 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.711 -0.848 . . . . 0.88 108.711 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.14 112.08 21.17 Favored 'General case' 0 N--CA 1.512 2.627 0 CA-C-O 122.797 1.284 . . . . 1.78 113.5 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 0.1 OUTLIER -48.1 131.33 15.94 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-N 114.372 -1.286 . . . . 0.82 111.478 179.362 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -90.61 -22.36 21.26 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.649 -0.657 . . . . 2.42 112.003 -178.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.753 ' N ' HD12 ' A' ' 6' ' ' ILE . 1.1 mp -74.82 -69.29 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 O-C-N 120.253 -1.529 . . . . 0.91 111.479 -177.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.0 p -92.14 -18.77 23.05 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.727 -1.233 . . . . 0.87 110.018 -178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.86 51.59 2.8 Favored Glycine 0 N--CA 1.502 3.074 0 C-N-CA 119.999 -1.096 . . . . 0.83 114.552 175.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.401 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 27.9 mttp -121.63 160.89 23.45 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 119.603 1.702 . . . . 1.27 108.251 176.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 36.8 m -112.42 149.83 31.99 Favored 'General case' 0 N--CA 1.51 2.566 0 CA-C-O 122.51 1.148 . . . . 1.33 113.7 -175.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.543 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.6 m-85 -130.33 123.3 29.67 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.176 -0.92 . . . . 0.77 110.484 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.496 ' N ' ' CD ' ' A' ' 12' ' ' LYS . 11.6 mptt -63.46 -20.64 65.75 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 109.091 -0.707 . . . . 3.25 109.091 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.69 ' HB2' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -121.26 137.25 54.77 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.679 -0.638 . . . . 1.27 109.625 -178.231 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.598 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 0.0 OUTLIER -61.36 -34.7 75.74 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 118.887 -1.125 . . . . 0.69 107.99 179.575 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.8 t -63.32 -44.58 94.56 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.682 -0.636 . . . . 1.07 110.139 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.69 ' OG1' ' HB2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -62.27 -32.8 73.56 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 106.637 -1.616 . . . . 0.56 106.637 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.9 tp -72.63 -35.87 67.91 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.527 -1.286 . . . . 0.64 107.527 177.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.458 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 18.5 m -59.31 -59.13 5.95 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.802 -1.186 . . . . 0.55 108.726 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 80.4 m -53.71 -35.73 61.47 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.102 -1.073 . . . . 0.46 108.102 178.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.543 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 55.1 t60 -66.34 -47.65 72.79 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 122.262 1.029 . . . . 0.45 108.719 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 49.3 mt -58.42 -29.97 66.52 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 107.545 -1.28 . . . . 0.58 107.545 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 18' ' ' SER . 86.7 mt -73.3 -27.76 61.72 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 107.724 -1.213 . . . . 0.5 107.724 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.438 HG12 HH22 ' A' ' 28' ' ' ARG . 72.4 mt -63.02 -33.78 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 106.988 -1.486 . . . . 0.53 106.988 177.234 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.485 ' ND1' HG21 ' A' ' 6' ' ' ILE . 79.7 m-70 -79.57 -44.08 21.76 Favored 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 119.805 -0.758 . . . . 0.72 111.168 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.418 ' O ' ' C ' ' A' ' 26' ' ' ASP . 1.2 m -85.86 2.97 43.76 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.201 -1.562 . . . . 0.84 108.57 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.418 ' C ' ' O ' ' A' ' 25' ' ' SER . 4.6 m-20 36.31 57.42 1.05 Allowed 'General case' 0 N--CA 1.498 1.975 0 CA-C-O 121.719 0.771 . . . . 1.4 111.155 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 58.2 m -68.85 -52.25 31.79 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.794 -0.817 . . . . 0.61 108.794 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.481 ' HD2' ' N ' ' A' ' 28' ' ' ARG . 5.5 mpt_? 43.12 61.1 10.1 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.318 -0.864 . . . . 0.6 110.503 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.47 19.75 0.31 Allowed 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.085 1.856 . . . . 0.55 113.731 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -126.8 88.92 53.37 Favored Pre-proline 0 N--CA 1.503 2.184 0 O-C-N 120.611 -1.306 . . . . 0.66 109.338 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.94 136.97 9.57 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.817 2.345 . . . . 0.56 114.095 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.602 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -60.56 129.74 43.06 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.536 -0.913 . . . . 0.36 108.536 179.399 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -74.06 -11.67 60.39 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-N 116.058 -0.519 . . . . 1.34 110.772 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.501 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 40.5 m-85 -113.86 -70.45 0.8 Allowed 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.507 -1.37 . . . . 0.48 112.541 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.602 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 18.0 p -89.28 -7.54 55.21 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.893 -1.129 . . . . 0.34 111.18 -178.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.501 ' C ' ' HB3' ' A' ' 32' ' ' CYS . . . 87.88 -3.78 85.85 Favored Glycine 0 N--CA 1.5 2.901 0 N-CA-C 115.821 1.088 . . . . 0.39 115.821 175.039 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.569 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 19.4 mttm -48.08 148.07 1.9 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-N 121.795 2.797 . . . . 0.7 106.93 178.115 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -117.45 134.79 54.45 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.068 -1.645 . . . . 1.69 109.449 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 17.9 m-85 -119.19 175.48 5.77 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.433 -0.792 . . . . 0.53 109.016 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.532 ' CD2' ' H ' ' A' ' 40' ' ' HIS . 5.0 p80 -113.31 8.56 18.07 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.639 -0.663 . . . . 0.98 111.362 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.507 ' O ' ' C ' ' A' ' 42' ' ' LYS . 28.1 mt-30 -143.1 111.51 6.24 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.453 -1.404 . . . . 1.48 110.421 179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' A' ' 45' ' ' MET . 49.4 tttm -30.95 -80.59 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.527 -0.733 . . . . 1.1 111.05 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 42' ' ' LYS . 10.8 p -36.12 -31.15 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.144 -0.973 . . . . 0.77 111.718 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -75.55 -40.9 56.18 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 118.359 -1.337 . . . . 0.81 108.349 179.796 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.617 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.5 tmm? -65.28 -46.23 81.27 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.434 -1.691 . . . . 0.69 106.434 177.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.569 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 52.9 mmtt -50.7 -36.83 38.07 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 107.476 -1.305 . . . . 1.44 107.476 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.626 ' O ' HG23 ' A' ' 51' ' ' ILE . 5.4 mtmp? -63.33 -32.09 73.41 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 106.395 -1.706 . . . . 1.92 106.395 177.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.637 ' O ' HG12 ' A' ' 51' ' ' ILE . 66.3 t60 -72.6 -67.32 0.56 Allowed 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.273 -1.38 . . . . 0.33 107.273 177.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.569 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 41.7 p -40.68 -32.28 0.2 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 120.136 -1.602 . . . . 0.42 109.61 177.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.553 ' CZ ' ' OE1' ' A' ' 55' ' ' GLU . 3.9 m-30 -70.41 -32.82 70.6 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 121.074 -1.016 . . . . 0.47 108.955 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.637 HG12 ' O ' ' A' ' 48' ' ' HIS . 15.6 pt -71.1 -16.75 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 C-N-CA 118.409 -1.316 . . . . 0.37 109.264 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.467 ' NE2' ' HB2' ' A' ' 34' ' ' TYR . 67.1 m-70 -90.86 -30.68 16.81 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.403 -1.436 . . . . 0.32 109.061 176.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 62.8 p -85.23 -11.2 55.43 Favored 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 112.608 0.596 . . . . 0.56 112.608 -176.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 83.15 14.75 73.86 Favored Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.071 -1.612 . . . . 0.45 109.071 -178.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.553 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 85.2 mt-10 -74.5 130.51 39.75 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.282 -1.128 . . . . 1.77 111.031 -177.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.1 mmtt -139.46 67.42 37.82 Favored Pre-proline 0 N--CA 1.487 1.418 0 N-CA-C 108.581 -0.896 . . . . 1.39 108.581 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.55 -7.7 11.35 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.9 2.4 . . . . 0.47 113.122 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.42 ' HB3' HD22 ' A' ' 73' ' ' LEU . 80.2 m-70 -105.73 93.19 4.51 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.734 -1.229 . . . . 0.54 109.019 179.213 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.464 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 91.5 mttt -94.31 123.72 37.88 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.068 -1.02 . . . . 1.34 110.761 -178.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.02 119.09 24.52 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.532 -1.284 . . . . 0.8 107.532 177.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.464 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 38.6 mm-40 -74.79 -16.17 60.72 Favored 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 112.439 0.533 . . . . 1.39 112.439 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.478 HG11 ' CG ' ' A' ' 80' ' ' HIS . 40.7 t -69.54 -55.97 13.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.039 0 O-C-N 120.187 -1.571 . . . . 1.04 111.469 -178.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.8 p -112.11 -0.07 15.74 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 119.305 -0.958 . . . . 0.92 110.83 -177.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.79 31.8 55.17 Favored Glycine 0 N--CA 1.498 2.803 0 C-N-CA 119.768 -1.206 . . . . 0.74 112.516 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -102.16 168.72 9.18 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 106.203 -1.777 . . . . 1.67 106.203 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -139.09 149.19 44.26 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.436 -1.415 . . . . 0.6 110.836 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.431 ' HZ ' ' CE1' ' A' ' 76' ' ' HIS . 31.2 m-85 -133.46 151.53 51.8 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 122.061 0.934 . . . . 0.54 112.905 -177.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 79.7 p -79.08 -27.39 43.02 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.717 -0.674 . . . . 0.64 109.777 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -116.72 140.13 49.77 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.877 -1.139 . . . . 2.25 111.189 -178.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.449 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -64.18 -45.28 89.05 Favored 'General case' 0 C--O 1.2 -1.538 0 N-CA-C 108.223 -1.028 . . . . 0.82 108.223 178.194 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.0 t -49.75 -35.87 23.85 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.299 -0.876 . . . . 0.99 108.923 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -74.96 -31.21 61.42 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.193 -1.41 . . . . 0.84 107.193 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' A' ' 70' ' ' SER . 43.7 tp -72.73 -54.52 8.72 Favored 'General case' 0 C--O 1.199 -1.582 0 N-CA-C 107.288 -1.375 . . . . 0.76 107.288 176.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.531 HD13 " H3'" ' C' ' 209' ' ' ' DG' . 72.0 mt -45.34 -51.14 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 O-C-N 120.438 -1.414 . . . . 1.02 108.549 178.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 57.2 m -62.43 -45.84 91.24 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 120.8 -1.188 . . . . 0.96 109.313 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.431 ' CE1' ' HZ ' ' A' ' 67' ' ' PHE . 22.1 t60 -60.84 -43.34 98.43 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 122.141 0.972 . . . . 0.8 109.593 -179.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -69.33 -32.55 71.71 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 120.779 -1.2 . . . . 1.34 108.283 178.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 82' ' ' GLY . 93.0 mtt180 -62.83 -31.88 72.98 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 106.673 -1.602 . . . . 2.35 106.673 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.03 -43.55 87.27 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 118.134 -1.426 . . . . 1.76 107.29 178.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.478 ' CG ' HG11 ' A' ' 62' ' ' VAL . 68.3 m-70 -66.12 -33.41 75.72 Favored 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 118.099 -1.44 . . . . 1.12 109.506 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 17.5 p -103.0 16.79 25.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.303 -0.873 . . . . 1.57 111.265 -177.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.488 2.129 0 C-N-CA 119.237 -1.459 . . . . 1.59 109.686 179.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.729 0 O4'-C4'-C3' 107.223 1.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 102' ' ' ' DA' . . . . . 0.537 ' N6 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.825 0 O4'-C4'-C3' 107.204 1.604 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' ' DT' . . . . . 0.519 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.774 0 C1'-O4'-C4' 106.243 -2.469 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' ' DA' . . . . . 0.519 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.868 0 C1'-O4'-C4' 107.542 -1.541 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.039 0 O4'-C4'-C3' 107.139 1.539 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.607 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.086 0 C1'-O4'-C4' 107.216 -1.775 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' ' DT' . . . . . 0.449 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.142 0 C1'-O4'-C4' 106.628 -2.195 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.074 0 O4'-C4'-C3' 107.407 1.807 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 109' ' ' ' DA' . . . . . 0.625 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.556 0 N19-C1'-C2' 116.768 1.605 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 110' ' ' ' DC' . . . . . 0.625 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.931 0 P-O3'-C3' 121.853 1.794 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.034 0 C1'-O4'-C4' 107.09 -1.864 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 112' ' ' ' DG' . . . . . 0.51 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.023 0 O4'-C4'-C3' 107.224 1.624 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.51 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.034 0 O4'-C4'-C3' 107.295 1.695 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 114' ' ' ' DC' . . . . . 0.444 ' O2 ' ' N2 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.423 -2.056 0 C4'-C3'-C2' 104.869 1.669 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.822 0 O4'-C4'-C3' 107.154 1.554 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.93 0 O4'-C4'-C3' 107.314 1.714 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.863 0 O4'-C4'-C3' 107.156 1.556 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.106 0 O4'-C4'-C3' 107.434 1.834 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 203' ' ' ' DG' . . . . . 0.555 ' C2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.966 0 C1'-O4'-C4' 107.488 -1.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 204' ' ' ' DG' . . . . . 0.555 ' C4 ' ' C2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.931 0 C1'-O4'-C4' 107.217 -1.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 205' ' ' ' DC' . . . . . 0.417 ' N4 ' ' N6 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.051 0 C1'-O4'-C4' 107.411 -1.635 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 206' ' ' ' DA' . . . . . 0.417 ' N6 ' ' N4 ' ' C' ' 205' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.789 0 O4'-C4'-C3' 107.404 1.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.966 0 O4'-C4'-C3' 107.192 1.592 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.943 0 C4'-C3'-C2' 104.924 1.724 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 209' ' ' ' DG' . . . . . 0.58 ' C2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.895 0 O4'-C4'-C3' 107.29 1.69 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 210' ' ' ' DA' . . . . . 0.607 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.583 0 O4'-C4'-C3' 107.459 1.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 211' ' ' ' DT' . . . . . 0.552 ' C4 ' ' C6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.425 -1.924 0 C1'-O4'-C4' 106.542 -2.256 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.727 0 C1'-O4'-C4' 106.966 -1.953 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.732 0 C4'-C3'-C2' 104.85 1.65 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 214' ' ' ' DA' . . . . . 0.537 ' N6 ' ' N6 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O4'-C4'-C3' 107.115 1.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 215' ' ' ' DT' . . . . . 0.432 ' C4 ' ' C5 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.015 0 C1'-O4'-C4' 107.344 -1.683 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.131 0 O4'-C4'-C3' 107.281 1.681 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 N--CA 1.495 1.816 0 CA-C-O 121.815 0.816 . . . . 65.13 110.719 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.621 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.2 m-85 -101.12 128.65 47.1 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.113 -0.699 . . . . 70.07 109.113 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -113.72 120.79 42.04 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 122.526 1.155 . . . . 83.59 112.414 -177.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.506 ' O ' ' HA2' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -52.62 126.61 20.27 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 108.377 -0.972 . . . . 50.89 108.377 177.257 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.457 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.3 OUTLIER -86.31 -17.33 34.87 Favored 'General case' 0 C--N 1.289 -2.053 0 O-C-N 120.846 -1.159 . . . . 99.16 111.939 -177.895 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.9 mm -77.91 -72.75 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 120.822 -1.174 . . . . 112.28 112.592 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.5 p -87.3 -32.0 19.91 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 106.516 -1.661 . . . . 82.08 106.516 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.506 ' HA2' ' O ' ' A' ' 4' ' ' CYS . . . 95.94 53.77 1.47 Allowed Glycine 0 N--CA 1.496 2.652 0 C-N-CA 118.513 -1.803 . . . . 195.93 114.54 174.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -115.71 164.56 14.18 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 104.438 -2.43 . . . . 114.22 104.438 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 90.2 p -115.7 149.19 38.8 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 119.826 -1.796 . . . . 78.05 113.847 -175.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 17.3 m-85 -129.21 129.69 45.36 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.682 0.753 . . . . 54.66 110.453 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.3 mtpt -73.31 -22.2 60.4 Favored 'General case' 0 N--CA 1.497 1.894 0 CA-C-O 121.785 0.803 . . . . 101.13 109.562 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.479 ' CB ' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -113.63 131.03 56.28 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.693 -0.855 . . . . 74.89 108.693 -177.516 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.621 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 98.3 p -58.63 -32.44 69.04 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.771 -1.206 . . . . 25.87 107.899 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 76.0 p -64.68 -41.48 96.02 Favored 'General case' 0 N--CA 1.485 1.315 0 O-C-N 121.541 -0.724 . . . . 23.45 110.337 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.479 ' OG1' ' CB ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -65.38 -33.5 76.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.078 -1.452 . . . . 32.27 107.078 179.816 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 tp -72.83 -36.36 67.49 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 107.509 -1.293 . . . . 97.78 107.509 177.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.594 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 20.7 t -57.84 -60.44 3.71 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.067 -1.021 . . . . 34.23 108.794 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.488 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 58.3 m -52.36 -40.55 62.15 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 122.526 1.155 . . . . 30.69 109.32 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 61.8 t60 -63.31 -46.05 88.5 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 108.116 -1.068 . . . . 81.83 108.116 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.7 mt -58.44 -31.4 67.73 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 106.638 -1.616 . . . . 156.93 106.638 178.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 18' ' ' SER . 35.7 mt -70.02 -24.49 63.29 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 115.278 -0.874 . . . . 64.07 108.685 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 86.9 mt -68.32 -33.3 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 107.13 -1.433 . . . . 150.1 107.13 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.5 m-70 -80.71 -38.31 29.09 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.434 -1.307 . . . . 55.94 109.744 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 m -84.78 -3.63 58.7 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 120.596 -1.315 . . . . 89.1 108.846 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 22' ' ' LEU . 53.7 m-20 47.94 51.3 14.62 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 121.385 0.612 . . . . 62.89 110.248 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -91.55 130.67 37.34 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.354 -0.841 . . . . 115.68 109.509 179.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.0 mtt-85 -144.84 76.06 14.07 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 120.98 -1.075 . . . . 115.33 109.374 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.46 10.23 1.3 Allowed 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 121.843 1.695 . . . . 90.27 113.385 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.466 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 73.5 m-85 -115.19 81.72 8.33 Favored Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 120.985 -1.072 . . . . 131.19 108.434 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.81 126.07 7.06 Favored 'Trans proline' 0 C--N 1.312 -1.342 0 C-N-CA 122.509 2.139 . . . . 108.54 112.746 -178.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.501 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.1 OUTLIER -48.32 142.88 5.14 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.174 0.988 . . . . 43.4 110.08 178.204 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -83.36 -11.79 57.26 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.691 -0.631 . . . . 113.04 110.831 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.501 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 52.6 m-85 -117.67 -73.42 0.64 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.242 -1.536 . . . . 118.47 112.187 -178.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 18.3 p -79.21 -27.32 42.53 Favored 'General case' 0 N--CA 1.504 2.242 0 C-N-CA 119.088 -1.045 . . . . 56.06 110.634 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 104.94 1.46 42.23 Favored Glycine 0 N--CA 1.488 2.125 0 C-N-CA 119.405 -1.379 . . . . 19.15 114.218 175.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.483 ' NZ ' ' P ' ' B' ' 107' ' ' ' DT' . 2.8 mttm -54.73 153.32 6.09 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 121.12 2.46 . . . . 73.47 106.023 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -117.28 138.94 51.41 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.305 -1.497 . . . . 160.56 109.681 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.446 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 51.6 m-85 -120.18 160.53 22.73 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.078 -1.014 . . . . 72.45 110.153 -179.406 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.544 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -99.91 -7.67 24.96 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 116.234 -0.439 . . . . 97.77 110.542 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.517 ' O ' ' C ' ' A' ' 42' ' ' LYS . 88.3 mt-30 -130.3 109.24 10.61 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.885 -1.135 . . . . 106.11 109.32 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.585 ' O ' ' N ' ' A' ' 45' ' ' MET . 85.5 tttt -29.74 -82.47 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.781 -0.574 . . . . 136.29 111.199 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 42' ' ' LYS . 2.1 m -37.71 -30.42 0.03 OUTLIER 'General case' 0 C--N 1.291 -1.938 0 O-C-N 121.204 -0.935 . . . . 65.22 111.879 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 41' ' ' GLN . 57.6 t0 -72.35 -36.31 68.75 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.108 -1.62 . . . . 40.66 107.314 178.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.597 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.1 tmm? -71.31 -47.3 57.54 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.326 -1.361 . . . . 31.66 107.326 176.525 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.534 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 7.7 tptp -50.54 -39.06 48.01 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.21 -1.404 . . . . 103.12 107.21 -179.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.512 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.8 mtmt -64.41 -34.97 79.42 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 106.178 -1.786 . . . . 48.51 106.178 176.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.662 ' O ' HG12 ' A' ' 51' ' ' ILE . 64.8 t60 -65.38 -65.49 0.67 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 107.426 -1.324 . . . . 65.66 107.426 176.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.534 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 31.9 p -42.2 -33.32 0.59 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.227 -1.545 . . . . 47.02 109.9 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.508 ' CE2' ' OE1' ' A' ' 55' ' ' GLU . 2.6 m-85 -71.69 -27.65 63.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.86 -1.15 . . . . 54.63 109.572 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 48' ' ' HIS . 15.0 pt -74.96 -17.55 16.23 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 121.058 -1.026 . . . . 99.09 109.149 176.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.426 ' CE1' ' HB2' ' A' ' 34' ' ' TYR . 59.2 m-70 -89.34 -30.27 18.53 Favored 'General case' 0 N--CA 1.516 2.847 0 C-N-CA 118.065 -1.454 . . . . 59.33 107.916 176.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.465 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 38.6 p -77.18 -23.16 51.56 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.654 0.74 . . . . 97.33 109.061 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.69 22.64 35.9 Favored Glycine 0 N--CA 1.485 1.966 0 N-CA-C 108.276 -1.93 . . . . 23.68 108.276 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.508 ' OE1' ' CE2' ' A' ' 50' ' ' PHE . 86.5 mt-10 -85.66 127.1 34.4 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 122.394 1.092 . . . . 47.26 112.026 -177.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -137.76 78.83 35.58 Favored Pre-proline 0 C--N 1.296 -1.731 0 N-CA-C 107.588 -1.264 . . . . 86.79 107.588 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -67.37 -13.02 37.91 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 C-N-CA 123.101 2.534 . . . . 151.44 112.782 -178.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 67.4 m80 -96.34 91.32 5.79 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 118.437 -1.305 . . . . 42.67 108.623 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.404 ' O ' ' OE1' ' A' ' 61' ' ' GLN . 91.5 mttt -93.0 122.07 34.98 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.214 -0.929 . . . . 72.96 110.014 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.422 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -72.93 121.66 20.41 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.006 -1.109 . . . . 38.91 108.006 178.592 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.404 ' OE1' ' O ' ' A' ' 59' ' ' LYS . 1.6 mm100 -84.25 7.99 17.37 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.297 -0.877 . . . . 124.0 109.855 -178.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.788 HG11 ' CG ' ' A' ' 80' ' ' HIS . 21.7 t -91.65 -59.66 2.83 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 C-N-CA 119.566 -0.854 . . . . 56.07 109.546 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.1 p -111.22 -12.63 14.09 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.285 0.846 . . . . 63.83 113.285 -178.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.47 12.4 51.25 Favored Glycine 0 N--CA 1.505 3.247 0 O-C-N 120.057 -1.652 . . . . 23.81 112.867 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -86.18 166.79 15.47 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.087 -1.82 . . . . 120.74 106.087 177.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -132.41 144.76 50.73 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.481 -1.387 . . . . 39.51 109.702 -178.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.459 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 82.3 m-85 -128.49 147.03 50.65 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 122.237 1.018 . . . . 62.57 112.183 -177.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.1 m -74.31 -36.79 63.73 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.631 -0.713 . . . . 84.84 109.089 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -116.19 141.62 47.91 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.403 1.097 . . . . 93.39 111.751 -178.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.4 p -59.6 -40.83 88.79 Favored 'General case' 0 C--O 1.197 -1.664 0 N-CA-C 107.842 -1.169 . . . . 67.34 107.842 178.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.2 t -48.18 -41.9 28.27 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.374 -0.829 . . . . 68.68 110.004 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 -76.19 -29.73 57.76 Favored 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 118.321 -1.351 . . . . 33.83 108.307 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' A' ' 74' ' ' ILE . 48.3 tp -70.44 -55.65 8.5 Favored 'General case' 0 C--O 1.195 -1.804 0 N-CA-C 107.517 -1.29 . . . . 75.65 107.517 176.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.403 ' C ' ' O ' ' A' ' 73' ' ' LEU . 79.9 mt -45.91 -52.23 3.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 O-C-N 120.666 -1.271 . . . . 27.72 108.985 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.3 m -61.45 -45.87 92.45 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.985 -1.072 . . . . 95.2 109.702 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.459 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 11.6 t60 -64.56 -38.07 89.73 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 122.496 1.141 . . . . 66.3 109.09 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.53 -31.93 70.45 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 107.332 -1.358 . . . . 87.23 107.332 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 82' ' ' GLY . 10.0 mmt85 -63.36 -38.9 92.94 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 107.709 -1.219 . . . . 73.27 107.709 177.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.4 ' CD ' ' OP2' ' B' ' 103' ' ' ' DT' . 47.0 mttm -60.41 -44.07 96.07 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 118.014 -1.474 . . . . 80.85 107.403 178.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.788 ' CG ' HG11 ' A' ' 62' ' ' VAL . 59.3 m-70 -61.3 -35.73 78.15 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 117.002 -1.879 . . . . 46.01 107.898 177.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.467 HG22 ' O ' ' A' ' 81' ' ' THR . 20.4 m -98.26 24.16 7.53 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 107.918 -1.142 . . . . 89.5 107.918 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 109.476 -1.45 . . . . 8.65 109.476 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.013 0 O4'-C4'-C3' 107.249 1.649 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 102' ' ' ' DA' . . . . . 0.532 ' N6 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.861 0 O4'-C4'-C3' 107.196 1.596 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' ' DT' . . . . . 0.572 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.572 0 C1'-O4'-C4' 106.012 -2.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' ' DA' . . . . . 0.572 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.789 0 O4'-C4'-C3' 107.056 1.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 105' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.965 0 O4'-C4'-C3' 107.219 1.619 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.583 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.752 0 C1'-O4'-C4' 107.283 -1.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' ' DT' . . . . . 0.499 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.068 0 C1'-O4'-C4' 106.586 -2.224 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' ' DC' . . . . . 0.458 ' N4 ' ' N6 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O4'-C4'-C3' 107.249 1.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' ' DA' . . . . . 0.678 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.442 0 N19-C1'-C2' 116.582 1.489 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 110' ' ' ' DC' . . . . . 0.678 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.987 0 P-O3'-C3' 121.979 1.899 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.996 0 C1'-O4'-C4' 107.144 -1.826 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 112' ' ' ' DG' . . . . . 0.464 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.845 0 O4'-C4'-C3' 107.49 1.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.464 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.938 0 O4'-C4'-C3' 107.326 1.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 114' ' ' ' DC' . . . . . 0.451 ' O2 ' ' N2 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.722 0 C4'-C3'-C2' 104.897 1.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.775 0 O4'-C4'-C3' 107.392 1.792 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.923 0 O4'-C4'-C3' 107.036 1.436 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.963 0 C1'-O4'-C4' 107.427 -1.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.996 0 O4'-C4'-C3' 107.159 1.559 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 203' ' ' ' DG' . . . . . 0.551 ' C2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.991 0 C4'-C3'-C2' 104.873 1.673 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 204' ' ' ' DG' . . . . . 0.551 ' C4 ' ' C2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.779 0 C4'-C3'-C2' 104.781 1.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 205' ' ' ' DC' . . . . . 0.534 ' N4 ' ' N6 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.043 0 C1'-O4'-C4' 107.269 -1.737 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 206' ' ' ' DA' . . . . . 0.534 ' N6 ' ' N4 ' ' C' ' 205' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.794 0 O4'-C4'-C3' 107.1 1.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.854 0 O4'-C4'-C3' 107.112 1.512 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.948 0 C4'-C3'-C2' 104.776 1.576 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 209' ' ' ' DG' . . . . . 0.557 ' C2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.721 0 O4'-C4'-C3' 107.226 1.626 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 210' ' ' ' DA' . . . . . 0.583 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.523 1.501 0 O4'-C4'-C3' 107.487 1.887 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 211' ' ' ' DT' . . . . . 0.556 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -1.963 0 C1'-O4'-C4' 106.709 -2.136 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.864 0 C1'-O4'-C4' 106.748 -2.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.849 0 C4'-C3'-C2' 104.782 1.582 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 214' ' ' ' DA' . . . . . 0.532 ' N6 ' ' N6 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.082 0 O4'-C4'-C3' 107.066 1.466 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 215' ' ' ' DT' . . . . . 0.441 ' N3 ' ' C6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.963 0 C1'-O4'-C4' 106.935 -1.975 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.058 0 O4'-C4'-C3' 107.35 1.75 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.9 p . . . . . 0 N--CA 1.489 1.478 0 N-CA-C 109.456 -0.572 . . . . 65.13 109.456 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.666 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.6 m-85 -102.52 124.87 48.86 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.229 -0.919 . . . . 70.07 109.152 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.7 139.56 40.93 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 122.272 1.034 . . . . 83.59 110.844 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -72.53 130.24 40.18 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 122.046 0.927 . . . . 50.89 110.593 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -92.95 22.89 4.55 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 109.311 -0.626 . . . . 99.16 109.311 -177.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.3 mm -123.72 -58.24 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.055 -1.028 . . . . 112.28 113.603 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.9 p -103.79 -38.5 7.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.706 -1.246 . . . . 82.08 110.537 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 133.04 13.58 1.54 Allowed Glycine 0 N--CA 1.506 3.362 0 CA-C-O 118.727 -1.041 . . . . 195.93 114.463 177.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -104.01 164.11 11.92 Favored 'General case' 0 N--CA 1.516 2.837 0 CA-C-N 121.167 2.483 . . . . 114.22 113.805 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.5 t -117.36 160.06 21.75 Favored 'General case' 0 N--CA 1.511 2.593 0 CA-C-O 122.511 1.148 . . . . 78.05 113.195 -176.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.539 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.9 m-85 -140.06 127.9 21.95 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-N 115.455 -0.793 . . . . 54.66 110.401 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -72.59 -23.63 60.98 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 122.612 1.196 . . . . 101.13 109.217 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.732 ' HE ' ' N ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -119.17 115.5 24.36 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 114.784 -1.098 . . . . 74.89 110.158 -177.275 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.666 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 1.3 t -50.39 -33.69 21.59 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 118.4 -1.32 . . . . 25.87 109.303 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 p -56.28 -39.96 73.5 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.262 -1.524 . . . . 23.45 109.304 -178.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.706 HG21 H2'' ' B' ' 109' ' ' ' DA' . 23.1 m -72.64 -32.02 65.56 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.389 -0.967 . . . . 32.27 108.389 178.524 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.7 tp -72.73 -44.98 60.99 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 106.395 -1.706 . . . . 97.78 106.395 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.621 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 45.1 m -44.35 -53.96 6.28 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.84 -1.17 . . . . 34.23 107.84 178.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.7 m -59.63 -41.33 90.22 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.911 0.863 . . . . 30.69 109.008 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.539 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 56.6 t60 -63.18 -35.73 81.26 Favored 'General case' 0 C--N 1.291 -1.94 0 CA-C-O 122.423 1.106 . . . . 81.83 108.602 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.2 mt -70.73 -34.69 72.16 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.103 -1.814 . . . . 156.93 106.103 178.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 18' ' ' SER . 22.2 mt -65.4 -21.48 66.67 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.215 -1.402 . . . . 64.07 107.215 177.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.581 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 80.2 mt -74.89 -41.05 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 120.864 -1.148 . . . . 150.1 109.262 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -76.01 -27.71 57.48 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 118.027 -1.469 . . . . 55.94 108.865 178.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -86.91 -25.75 24.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.3 -0.875 . . . . 89.1 108.694 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 64.64 50.9 2.01 Favored 'General case' 0 C--N 1.29 -1.998 0 O-C-N 121.404 -0.81 . . . . 62.89 109.56 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.454 ' C ' HH11 ' A' ' 28' ' ' ARG . 2.3 m -98.23 127.46 44.17 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.445 -0.784 . . . . 115.68 109.261 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.454 HH11 ' C ' ' A' ' 27' ' ' THR . 1.7 mpt_? -136.36 80.04 40.81 Favored Pre-proline 0 N--CA 1.495 1.783 0 O-C-N 121.147 -0.971 . . . . 115.33 109.878 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -75.69 17.88 0.65 Allowed 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 122.296 1.997 . . . . 90.27 114.13 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.498 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 61.9 m-85 -124.1 82.73 56.4 Favored Pre-proline 0 N--CA 1.497 1.9 0 N-CA-C 107.657 -1.238 . . . . 131.19 107.657 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 5.4 Cg_endo -79.41 147.49 20.23 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 C-N-CA 122.689 2.259 . . . . 108.54 114.396 -177.355 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.625 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.5 OUTLIER -71.78 137.29 47.54 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-O 121.674 0.75 . . . . 43.4 109.826 -179.029 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.429 ' HG2' ' H ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -81.56 -15.68 54.04 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 120.414 -0.515 . . . . 113.04 110.476 -179.435 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.413 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 25.0 m-85 -119.09 -51.82 2.32 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 115.185 1.55 . . . . 118.47 115.185 -175.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.625 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.6 p -100.54 -18.62 16.55 Favored 'General case' 0 N--CA 1.517 2.917 0 O-C-N 120.414 -1.429 . . . . 56.06 113.843 -175.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 124.54 -32.58 4.04 Favored Glycine 0 N--CA 1.512 3.744 0 O-C-N 119.597 -1.94 . . . . 19.15 114.548 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -51.67 160.69 0.61 Allowed 'General case' 0 C--N 1.292 -1.915 0 O-C-N 120.895 -1.356 . . . . 73.47 112.698 -177.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.46 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 0.3 OUTLIER -131.97 152.96 50.78 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 107.801 -1.185 . . . . 160.56 107.801 179.846 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.467 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 35.4 m-85 -135.02 162.18 33.19 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-O 121.979 0.895 . . . . 72.45 110.36 -178.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.492 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -94.17 -11.92 29.4 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 115.598 -0.728 . . . . 97.77 110.863 -178.796 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' C ' ' A' ' 42' ' ' LYS . 65.7 mt-30 -131.86 116.24 16.95 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.928 -1.107 . . . . 106.11 110.126 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.499 ' O ' ' N ' ' A' ' 45' ' ' MET . 81.9 tttt -34.32 -74.21 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.197 -0.939 . . . . 136.29 111.384 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -43.98 -34.43 1.7 Allowed 'General case' 0 C--N 1.295 -1.775 0 O-C-N 121.566 -0.709 . . . . 65.22 111.287 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -68.36 -40.74 81.39 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.332 -1.729 . . . . 40.66 106.332 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.662 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 9.1 tmm? -69.45 -47.61 63.46 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 119.965 -1.709 . . . . 31.66 108.05 176.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.556 ' O ' ' OG1' ' A' ' 49' ' ' THR . 31.7 ttmt -50.9 -35.97 35.75 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.681 -1.229 . . . . 103.12 107.681 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.519 ' O ' HG23 ' A' ' 51' ' ' ILE . 25.9 mtmm -67.9 -32.78 73.5 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 105.596 -2.002 . . . . 48.51 105.596 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.824 ' O ' HG12 ' A' ' 51' ' ' ILE . 73.9 t60 -64.67 -65.21 0.7 Allowed 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 106.121 -1.807 . . . . 65.66 106.121 174.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.556 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 41.0 p -40.79 -37.05 0.7 Allowed 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.934 -1.104 . . . . 47.02 110.521 178.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.485 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 4.0 m-30 -65.52 -36.99 85.46 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.034 -1.042 . . . . 54.63 109.082 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.824 HG12 ' O ' ' A' ' 48' ' ' HIS . 10.5 pt -59.91 -36.58 67.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 N-CA-C 106.857 -1.535 . . . . 99.09 106.857 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -74.4 -32.08 62.57 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.452 -1.405 . . . . 59.33 110.852 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.485 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 69.3 p -85.56 -8.7 58.14 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.551 -1.343 . . . . 97.33 111.626 -176.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 74.0 13.78 80.71 Favored Glycine 0 N--CA 1.49 2.284 0 O-C-N 120.761 -1.212 . . . . 23.68 110.082 -178.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -75.82 107.78 8.23 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.98 0.895 . . . . 47.26 110.657 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -115.49 79.66 7.32 Favored Pre-proline 0 C--N 1.292 -1.912 0 N-CA-C 108.241 -1.022 . . . . 86.79 108.241 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -75.06 -13.31 21.33 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.488 2.126 . . . . 151.44 114.125 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -90.73 82.08 5.77 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 120.267 -1.521 . . . . 42.67 109.421 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -77.31 140.03 39.92 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 122.003 0.906 . . . . 72.96 111.404 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.481 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -103.11 115.4 30.52 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.621 -1.992 . . . . 38.91 105.621 177.569 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -85.12 14.05 5.53 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.34 -1.475 . . . . 124.0 109.934 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.675 HG11 ' CG ' ' A' ' 80' ' ' HIS . 46.8 t -95.47 -38.93 9.22 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 O-C-N 121.255 -0.903 . . . . 56.07 110.439 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.7 p -131.3 -8.01 3.78 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 122.139 0.971 . . . . 63.83 108.877 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.16 31.94 33.2 Favored Glycine 0 C--N 1.29 -2.024 0 O-C-N 120.837 -1.164 . . . . 23.81 111.195 176.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -96.36 -172.4 2.52 Favored 'General case' 0 C--N 1.287 -2.127 0 N-CA-C 103.216 -2.883 . . . . 120.74 103.216 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -165.74 148.13 7.44 Favored 'General case' 0 C--N 1.265 -3.077 0 N-CA-C 105.739 -1.949 . . . . 39.51 105.739 -176.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.55 ' CZ ' ' CG ' ' A' ' 76' ' ' HIS . 2.7 m-85 -129.22 146.77 51.06 Favored 'General case' 0 C--N 1.28 -2.419 0 C-N-CA 117.79 -1.564 . . . . 62.57 113.401 -175.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.446 ' OG ' ' HG3' ' A' ' 69' ' ' GLN . 4.9 p -70.7 -8.03 49.06 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 115.277 -0.874 . . . . 84.84 108.993 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.446 ' HG3' ' OG ' ' A' ' 68' ' ' SER . 24.7 mt-30 -145.4 130.82 18.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.036 -1.04 . . . . 93.39 111.312 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.596 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -51.1 -48.9 61.59 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.767 -1.208 . . . . 67.34 109.3 177.224 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.436 ' C ' ' O ' ' A' ' 70' ' ' SER . 0.3 OUTLIER -44.6 -44.87 9.18 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.969 -1.082 . . . . 68.68 108.7 -179.304 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.407 ' O ' ' CB ' ' A' ' 76' ' ' HIS . 63.0 m-20 -70.66 -28.1 64.53 Favored 'General case' 0 C--N 1.291 -1.976 0 C-N-CA 118.187 -1.405 . . . . 33.83 108.145 178.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.596 ' N ' ' O ' ' A' ' 70' ' ' SER . 37.6 tp -70.19 -59.33 2.95 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 106.778 -1.564 . . . . 75.65 106.778 175.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.486 HD13 " H3'" ' C' ' 209' ' ' ' DG' . 91.5 mt -46.78 -54.34 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.376 -1.452 . . . . 27.72 109.875 178.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 3.2 m -61.96 -43.27 99.19 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 119.631 -1.918 . . . . 95.2 109.004 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.55 ' CG ' ' CZ ' ' A' ' 67' ' ' PHE . 16.2 t60 -58.94 -45.65 89.91 Favored 'General case' 0 C--N 1.296 -1.76 0 O-C-N 121.12 -0.988 . . . . 66.3 109.39 -178.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.6 t -69.15 -33.78 73.95 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 120.244 -1.535 . . . . 87.23 107.997 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.449 ' HB2' ' O ' ' A' ' 75' ' ' THR . 4.3 mtt85 -50.83 -41.04 57.3 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 106.49 -1.67 . . . . 73.27 106.49 178.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -64.6 -45.02 88.75 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 118.252 -1.379 . . . . 80.85 108.582 178.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.675 ' CG ' HG11 ' A' ' 62' ' ' VAL . 63.7 m-70 -62.49 -35.28 78.85 Favored 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 116.52 -2.072 . . . . 46.01 108.52 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 50.6 p -96.09 19.1 12.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.085 -1.01 . . . . 89.5 109.786 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.552 0 N-CA-C 109.381 -1.487 . . . . 8.65 109.381 178.971 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.797 0 O4'-C4'-C3' 107.158 1.558 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.758 0 C1'-O4'-C4' 107.427 -1.624 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 103' ' ' ' DT' . . . . . 0.563 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.745 0 C1'-O4'-C4' 105.973 -2.662 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 104' ' ' ' DA' . . . . . 0.563 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.03 0 O4'-C4'-C3' 107.16 1.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' ' DA' . . . . . 0.457 ' C6 ' ' C5 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.021 0 O4'-C4'-C3' 107.114 1.514 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.607 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.812 0 C1'-O4'-C4' 106.885 -2.01 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' ' DT' . . . . . 0.549 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.942 0 C1'-O4'-C4' 106.233 -2.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' ' DC' . . . . . 0.581 " H3'" HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C3'--C2' 1.537 1.919 0 C1'-O4'-C4' 107.019 -1.915 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 109' ' ' ' DA' . . . . . 0.706 H2'' HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 P--O5' 1.608 1.493 0 N19-C1'-C2' 117.421 2.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 110' ' ' ' DC' . . . . . 0.548 ' C4 ' ' C5 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.942 0 P-O3'-C3' 121.687 1.656 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.886 0 C1'-O4'-C4' 107.152 -1.82 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 112' ' ' ' DG' . . . . . 0.568 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.818 0 O4'-C4'-C3' 107.416 1.816 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.568 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.873 0 O4'-C4'-C3' 107.095 1.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 114' ' ' ' DC' . . . . . 0.441 ' O2 ' ' N2 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.952 0 C4'-C3'-C2' 104.755 1.555 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.788 0 C1'-O4'-C4' 107.655 -1.46 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.054 0 O4'-C4'-C3' 107.222 1.622 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 201' ' ' ' DT' . . . . . 0.535 ' C2 ' ' N7 ' ' C' ' 202' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.893 0 O4'-C4'-C3' 107.087 1.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 202' ' ' ' DA' . . . . . 0.535 ' N7 ' ' C2 ' ' C' ' 201' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.053 0 O4'-C4'-C3' 107.513 1.913 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 203' ' ' ' DG' . . . . . 0.553 ' N2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.944 0 C4'-C3'-C2' 104.78 1.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 204' ' ' ' DG' . . . . . 0.553 ' C4 ' ' N2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.002 0 C1'-O4'-C4' 107.502 -1.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.018 0 C1'-O4'-C4' 107.317 -1.702 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.856 0 O4'-C4'-C3' 107.417 1.817 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.909 0 C4'-C3'-C2' 104.756 1.556 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.93 0 C4'-C3'-C2' 104.737 1.537 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 209' ' ' ' DG' . . . . . 0.559 ' N2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.986 0 O4'-C4'-C3' 107.184 1.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 210' ' ' ' DA' . . . . . 0.607 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.702 0 O4'-C4'-C3' 107.252 1.652 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 211' ' ' ' DT' . . . . . 0.545 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -2.032 0 C1'-O4'-C4' 106.83 -2.05 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.536 1.838 0 C1'-O4'-C4' 106.951 -1.964 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 213' ' ' ' DT' . . . . . 0.408 ' O4 ' ' O4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.426 -1.795 0 C4'-C3'-C2' 104.908 1.708 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 214' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.859 0 O4'-C4'-C3' 107.166 1.566 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.874 0 C1'-O4'-C4' 106.989 -1.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.127 0 O4'-C4'-C3' 107.287 1.687 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 p . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 121.399 0.618 . . . . 65.13 109.452 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.576 ' CE2' ' N ' ' A' ' 14' ' ' SER . 3.7 m-85 -103.39 121.51 42.95 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.473 -0.767 . . . . 70.07 109.158 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.904 ' O ' ' O ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -108.68 103.24 12.29 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 122.009 0.909 . . . . 83.59 110.761 -178.558 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.904 ' O ' ' O ' ' A' ' 3' ' ' ASP . 19.4 t -13.88 157.21 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.214 0 CA-C-N 114.621 -1.172 . . . . 50.89 109.573 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.7 mttp -120.36 20.44 11.92 Favored 'General case' 0 N--CA 1.507 2.385 0 N-CA-C 106.474 -1.676 . . . . 99.16 106.474 174.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.541 ' HB ' ' NE2' ' A' ' 24' ' ' HIS . 6.3 mm -126.13 -80.35 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 CA-C-N 115.333 -0.848 . . . . 112.28 110.361 -178.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.8 p -81.45 -36.2 29.66 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.269 -1.519 . . . . 82.08 109.384 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.88 43.44 1.12 Allowed Glycine 0 N--CA 1.506 3.302 0 C-N-CA 119.696 -1.24 . . . . 195.93 113.521 177.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.49 ' HG2' ' N ' ' A' ' 10' ' ' SER . 49.5 tttm -112.19 160.39 17.64 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.503 -1.586 . . . . 114.22 107.856 178.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.49 ' N ' ' HG2' ' A' ' 9' ' ' LYS . 57.6 p -112.32 146.96 37.34 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 123.499 1.619 . . . . 78.05 114.708 -174.048 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.531 ' HZ ' ' ND1' ' A' ' 20' ' ' HIS . 49.4 m-85 -130.22 125.69 35.52 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 113.35 -1.75 . . . . 54.66 110.047 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.1 mttp -70.82 -21.21 62.49 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 122.631 1.205 . . . . 101.13 108.507 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.563 ' NH2' ' H ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -114.68 136.82 52.64 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 114.893 -1.049 . . . . 74.89 110.19 -177.178 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.576 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 19.3 t -65.62 -36.4 83.6 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.041 -1.037 . . . . 25.87 108.978 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -38.99 90.01 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.186 -0.946 . . . . 23.45 110.293 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.602 ' CG2' H2'' ' B' ' 109' ' ' ' DA' . 3.8 m -66.11 -31.31 72.1 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 105.854 -1.906 . . . . 32.27 105.854 178.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 2' ' ' PHE . 14.9 tp -73.19 -35.14 66.33 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 106.712 -1.588 . . . . 97.78 106.712 176.329 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.635 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 40.3 p -57.91 -57.16 14.0 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.782 -1.199 . . . . 34.23 108.308 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.9 m -53.53 -41.17 66.12 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 122.439 1.114 . . . . 30.69 108.863 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.531 ' ND1' ' HZ ' ' A' ' 11' ' ' PHE . 55.3 t60 -62.78 -47.47 83.35 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-O 122.511 1.148 . . . . 81.83 108.411 178.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 37.9 mt -58.19 -30.72 66.65 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.025 -1.472 . . . . 156.93 107.025 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 18' ' ' SER . 61.3 mt -72.41 -26.69 61.96 Favored 'General case' 0 C--O 1.205 -1.246 0 N-CA-C 107.967 -1.123 . . . . 64.07 107.967 178.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.544 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 49.5 mt -64.07 -34.0 65.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 O-C-N 120.046 -1.659 . . . . 150.1 107.028 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.541 ' NE2' ' HB ' ' A' ' 6' ' ' ILE . 89.7 m-70 -81.21 -37.29 28.88 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 118.697 -1.201 . . . . 55.94 110.477 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.51 ' O ' ' C ' ' A' ' 26' ' ' ASP . 57.4 m -93.6 1.87 56.54 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.387 -1.446 . . . . 89.1 109.043 -179.299 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.51 ' C ' ' O ' ' A' ' 25' ' ' SER . 1.1 p30 32.47 59.86 0.38 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.436 0.636 . . . . 62.89 110.164 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 91.5 m -70.65 -54.54 11.53 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 108.077 -1.083 . . . . 115.68 108.077 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.431 HH11 ' HG2' ' A' ' 28' ' ' ARG . 23.3 mtt-85 40.69 67.64 2.76 Favored Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.731 -0.605 . . . . 115.33 110.843 179.029 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -89.1 26.24 0.57 Allowed 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.639 2.226 . . . . 90.27 113.847 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.531 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 63.9 m-85 -122.73 76.54 47.54 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 120.694 -1.254 . . . . 131.19 107.634 179.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.29 125.81 12.28 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 122.696 2.264 . . . . 108.54 114.507 -176.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.9 OUTLIER -52.92 135.24 36.8 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.636 -0.876 . . . . 43.4 108.636 177.914 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.7 -11.57 58.24 Favored 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.372 -0.931 . . . . 113.04 109.652 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.519 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 85.6 m-85 -104.71 -74.29 0.65 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.798 -1.189 . . . . 118.47 111.659 -178.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.555 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 28.4 p -85.98 -19.82 29.83 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 118.614 -1.234 . . . . 56.06 111.487 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.71 0.16 55.33 Favored Glycine 0 N--CA 1.498 2.771 0 O-C-N 120.409 -1.432 . . . . 19.15 114.867 175.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.413 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 25.5 mttp -54.57 164.84 0.66 Allowed 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 121.737 2.769 . . . . 73.47 107.42 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -123.85 107.56 11.52 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.454 -1.404 . . . . 160.56 109.132 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.608 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 31.6 m-85 -89.44 170.63 10.37 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.334 -0.854 . . . . 72.45 111.15 -178.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.776 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -117.1 40.25 3.05 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 115.651 -0.704 . . . . 97.77 111.037 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.776 ' HG3' ' O ' ' A' ' 40' ' ' HIS . 5.1 mt-30 179.72 105.73 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 108.473 -0.936 . . . . 106.11 108.473 177.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 33.8 tttp -32.35 -65.37 0.15 Allowed 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 112.627 0.603 . . . . 136.29 112.627 -178.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.1 m -52.89 -39.15 62.46 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.502 -0.749 . . . . 65.22 111.11 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -64.74 -42.1 95.43 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.309 -1.367 . . . . 40.66 107.309 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.609 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 61.9 ttp -63.32 -44.9 93.62 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.33 -1.481 . . . . 31.66 107.22 177.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.638 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 22.9 mttm -51.41 -42.44 61.46 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 107.547 -1.279 . . . . 103.12 107.547 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.514 ' O ' HG23 ' A' ' 51' ' ' ILE . 51.7 mtmt -59.63 -30.99 69.11 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 106.361 -1.718 . . . . 48.51 106.361 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.614 ' O ' HG12 ' A' ' 51' ' ' ILE . 76.3 t60 -71.19 -65.14 0.78 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 107.419 -1.326 . . . . 65.66 107.419 176.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.638 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 19.4 p -43.99 -31.07 0.82 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.586 -1.321 . . . . 47.02 110.003 178.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -71.39 -34.02 70.02 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.457 -0.777 . . . . 54.63 109.198 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.0 pt -65.95 -36.64 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 C-N-CA 118.029 -1.468 . . . . 99.09 108.362 176.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.505 ' NE2' ' HB2' ' A' ' 34' ' ' TYR . 78.1 m-70 -69.48 -32.04 70.69 Favored 'General case' 0 N--CA 1.524 3.232 0 O-C-N 120.142 -1.599 . . . . 59.33 110.368 178.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 63.1 p -82.27 -17.48 45.76 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.506 -0.746 . . . . 97.33 109.599 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 84.13 17.38 65.08 Favored Glycine 0 N--CA 1.481 1.697 0 N-CA-C 107.359 -2.297 . . . . 23.68 107.359 -177.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -76.48 116.97 17.65 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 122.143 0.973 . . . . 47.26 110.348 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -125.72 78.47 69.03 Favored Pre-proline 0 N--CA 1.49 1.575 0 N-CA-C 108.76 -0.83 . . . . 86.79 108.76 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -65.0 -10.66 26.36 Favored 'Trans proline' 0 C--N 1.309 -1.548 0 C-N-CA 122.589 2.193 . . . . 151.44 112.804 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -112.34 95.79 5.65 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 117.762 -1.575 . . . . 42.67 109.434 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -97.96 129.49 44.86 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.22 -0.925 . . . . 72.96 110.219 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.405 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -71.84 120.55 17.59 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 107.147 -1.427 . . . . 38.91 107.147 178.523 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -88.2 9.7 22.01 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.275 -1.009 . . . . 124.0 108.275 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.457 HG11 ' CG ' ' A' ' 80' ' ' HIS . 14.2 t -94.56 -59.89 2.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 C-N-CA 119.929 -0.709 . . . . 56.07 111.026 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.4 p -114.56 -17.87 11.59 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 113.987 1.106 . . . . 63.83 113.987 -177.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.86 -11.75 7.37 Favored Glycine 0 N--CA 1.514 3.891 0 CA-C-N 122.112 2.233 . . . . 23.81 114.765 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.5 tttp -86.8 166.0 15.56 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.077 -1.837 . . . . 120.74 112.024 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.52 151.82 48.98 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.19 -0.944 . . . . 39.51 112.228 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.552 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 90.6 m-85 -132.49 144.18 50.27 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 122.264 1.03 . . . . 62.57 112.922 -177.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.9 t -78.47 -40.03 36.68 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.293 -1.003 . . . . 84.84 108.293 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -106.29 140.66 38.88 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.965 0.888 . . . . 93.39 110.747 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 75.2 p -62.33 -40.37 96.12 Favored 'General case' 0 C--O 1.195 -1.796 0 N-CA-C 107.86 -1.163 . . . . 67.34 107.86 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.621 ' OG ' ' N7 ' ' C' ' 210' ' ' ' DA' . 0.4 OUTLIER -51.66 -35.1 41.02 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.621 -0.674 . . . . 68.68 110.078 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -80.57 -32.77 36.5 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.012 -1.075 . . . . 33.83 108.581 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.6 tp -73.71 -35.21 65.1 Favored 'General case' 0 C--O 1.202 -1.402 0 N-CA-C 106.914 -1.513 . . . . 75.65 106.914 176.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.5 ' O ' ' OG ' ' A' ' 77' ' ' SER . 66.6 mt -59.25 -54.16 38.14 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 O-C-N 120.486 -1.384 . . . . 27.72 107.732 177.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.65 ' O ' ' N ' ' A' ' 78' ' ' ARG . 55.2 m -57.98 -61.76 2.31 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 122.705 1.24 . . . . 95.2 107.91 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.552 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 13.0 t60 -45.59 -40.7 9.13 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.079 -1.082 . . . . 66.3 108.079 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.5 ' OG ' ' O ' ' A' ' 74' ' ' ILE . 95.6 p -69.45 -32.07 70.77 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 107.207 -1.405 . . . . 87.23 107.207 177.135 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.65 ' N ' ' O ' ' A' ' 75' ' ' THR . 51.8 mtp85 -61.41 -39.76 91.9 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.071 -1.018 . . . . 73.27 108.915 178.478 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.523 ' NZ ' ' OP2' ' B' ' 103' ' ' ' DT' . 30.3 mttt -59.17 -45.72 90.27 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 105.622 -1.992 . . . . 80.85 105.622 178.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.457 ' CG ' HG11 ' A' ' 62' ' ' VAL . 47.7 m-70 -60.06 -43.13 95.62 Favored 'General case' 0 C--N 1.295 -1.78 0 C-N-CA 117.211 -1.796 . . . . 46.01 109.305 175.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 75.4 p -91.82 22.13 4.39 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.379 -1.45 . . . . 89.5 108.919 -179.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.486 2.002 0 N-CA-C 109.875 -1.29 . . . . 8.65 109.875 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.001 0 C1'-O4'-C4' 107.513 -1.562 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.896 0 C1'-O4'-C4' 107.574 -1.518 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 103' ' ' ' DT' . . . . . 0.523 ' OP2' ' NZ ' ' A' ' 79' ' ' LYS . . . . . . . . 0 O4'--C4' 1.425 -1.866 0 C1'-O4'-C4' 105.751 -2.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' ' DA' . . . . . 0.593 ' C6 ' ' C5 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.994 0 O4'-C4'-C3' 107.203 1.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' ' DA' . . . . . 0.602 ' C2 ' ' C4 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.179 0 O4'-C4'-C3' 107.078 1.478 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.602 ' C4 ' ' C2 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.844 0 P-O3'-C3' 123.102 2.835 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' ' DT' . . . . . 0.534 ' C4 ' ' C4 ' ' B' ' 108' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.537 1.944 0 C1'-O4'-C4' 106.427 -2.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' ' DC' . . . . . 0.544 " H3'" HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C3'--C2' 1.536 1.797 0 C1'-O4'-C4' 106.696 -2.146 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' ' DA' . . . . . 0.602 H2'' ' CG2' ' A' ' 16' ' ' THR . . . . . . . . 0 O4'--C1' 1.436 1.236 0 N19-C1'-C2' 116.752 1.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 110' ' ' ' DC' . . . . . 0.562 ' C5 ' ' C5 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.136 0 P-O3'-C3' 122.084 1.987 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.856 0 C1'-O4'-C4' 107.434 -1.619 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 112' ' ' ' DG' . . . . . 0.551 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.832 0 O4'-C4'-C3' 107.195 1.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.551 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.059 0 O4'-C4'-C3' 107.049 1.449 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.001 0 O4'-C4'-C3' 107.058 1.458 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.847 0 C1'-O4'-C4' 107.633 -1.477 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 116' ' ' ' DA' . . . . . 0.527 ' C2 ' ' C2 ' ' C' ' 202' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O4'-C4'-C3' 107.36 1.76 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.821 0 O4'-C4'-C3' 107.291 1.691 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 202' ' ' ' DA' . . . . . 0.527 ' C2 ' ' C2 ' ' B' ' 116' ' ' ' DA' . . . . . . . . 0 P--O5' 1.611 1.847 0 O4'-C4'-C3' 107.107 1.507 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.902 0 C1'-O4'-C4' 107.064 -1.883 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.001 0 C1'-O4'-C4' 107.342 -1.685 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.966 0 O4'-C4'-C3' 107.362 1.762 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 206' ' ' ' DA' . . . . . 0.513 ' N1 ' ' C6 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 P--O5' 1.612 1.873 0 O4'-C4'-C3' 107.355 1.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 207' ' ' ' DG' . . . . . 0.513 ' C6 ' ' N1 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.063 0 O4'-C4'-C3' 107.28 1.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.771 0 C1'-O4'-C4' 107.015 -1.918 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 209' ' ' ' DG' . . . . . 0.579 ' N2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.716 0 C4'-C3'-C2' 104.83 1.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 210' ' ' ' DA' . . . . . 0.621 ' N7 ' ' OG ' ' A' ' 71' ' ' SER . . . . . . . . 0 C5'--C4' 1.524 1.684 0 O4'-C4'-C3' 107.428 1.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 211' ' ' ' DT' . . . . . 0.6 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -2.011 0 C1'-O4'-C4' 106.167 -2.523 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 212' ' ' ' DT' . . . . . 0.404 ' N3 ' ' C4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.523 1.561 0 C1'-O4'-C4' 106.835 -2.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 213' ' ' ' DT' . . . . . 0.554 ' C4 ' ' C6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.808 0 C1'-O4'-C4' 107.288 -1.723 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 214' ' ' ' DA' . . . . . 0.554 ' C6 ' ' C4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.276 0 O4'-C4'-C3' 107.203 1.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.125 0 C1'-O4'-C4' 106.887 -2.009 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.092 0 O4'-C4'-C3' 107.268 1.668 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.8 m . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.345 -0.613 . . . . 65.13 109.345 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.474 ' CE2' ' N ' ' A' ' 14' ' ' SER . 1.7 m-85 -96.79 120.8 37.79 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.44 -0.948 . . . . 70.07 108.44 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.5 p-10 -103.23 128.42 50.24 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 122.483 1.135 . . . . 83.59 110.341 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.34 123.88 19.41 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 108.123 -1.066 . . . . 50.89 108.123 178.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -83.43 -8.7 59.34 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.297 -0.877 . . . . 99.16 109.758 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.404 ' HB ' ' CD2' ' A' ' 24' ' ' HIS . 6.3 mm -83.14 -70.0 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.767 -1.208 . . . . 112.28 110.618 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 24.2 p -94.42 -23.9 17.56 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 120.816 -1.177 . . . . 82.08 111.215 -178.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 101.93 37.32 3.44 Favored Glycine 0 N--CA 1.504 3.226 0 C-N-CA 119.214 -1.47 . . . . 195.93 114.047 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -113.86 161.87 17.05 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.556 -1.556 . . . . 114.22 107.512 177.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.3 t -114.02 166.3 11.74 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.377 -1.452 . . . . 78.05 112.739 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.544 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 53.0 m-85 -143.18 127.94 18.22 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 114.643 -1.162 . . . . 54.66 109.775 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.632 ' NZ ' ' NH1' ' A' ' 13' ' ' ARG . 7.0 mtmp? -70.36 -24.45 62.97 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.609 0.719 . . . . 101.13 109.433 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.884 ' HE ' ' H ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -118.5 138.24 52.65 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.611 -0.681 . . . . 74.89 109.309 -178.642 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.474 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 22.9 t -59.87 -34.13 72.74 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 120.95 -1.094 . . . . 25.87 108.706 -179.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.46 -44.18 97.03 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 121.245 -0.909 . . . . 23.45 109.004 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.546 ' OG1' ' HB2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -61.51 -32.72 72.77 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 106.977 -1.49 . . . . 32.27 106.977 179.675 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.422 HD22 ' HB3' ' A' ' 2' ' ' PHE . 18.5 tp -73.83 -37.64 64.79 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.112 -1.44 . . . . 97.78 107.112 177.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.649 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 31.9 p -57.6 -58.53 7.93 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.796 -1.19 . . . . 34.23 109.195 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.429 ' N ' ' OG ' ' A' ' 18' ' ' SER . 97.0 m -57.07 -34.96 68.81 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 122.026 0.917 . . . . 30.69 108.961 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 62.1 t60 -65.94 -49.55 67.52 Favored 'General case' 0 C--N 1.295 -1.761 0 O-C-N 121.003 -1.061 . . . . 81.83 108.488 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 71.1 mt -55.25 -30.27 59.71 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 106.743 -1.577 . . . . 156.93 106.743 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 18' ' ' SER . 26.0 mt -70.9 -29.2 65.2 Favored 'General case' 0 C--O 1.208 -1.088 0 N-CA-C 108.178 -1.045 . . . . 64.07 108.178 178.623 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.69 HD11 ' P ' ' B' ' 109' ' ' ' DA' . 65.4 mt -62.14 -36.1 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 O-C-N 119.877 -1.764 . . . . 150.1 107.728 177.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.404 ' CD2' ' HB ' ' A' ' 6' ' ' ILE . 88.7 m-70 -80.97 -31.15 34.92 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 118.765 -1.174 . . . . 55.94 111.192 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.8 m -92.98 -5.0 51.66 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.173 -1.579 . . . . 89.1 108.875 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 46.21 73.22 0.18 Allowed 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 109.245 -0.65 . . . . 62.89 109.245 -178.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.5 m -107.84 122.59 47.08 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.53 -0.915 . . . . 115.68 108.53 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -139.02 85.55 15.86 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.078 -1.014 . . . . 115.33 109.974 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -83.07 7.84 4.97 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 122.498 2.132 . . . . 90.27 113.388 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -112.27 93.94 24.38 Favored Pre-proline 0 N--CA 1.499 1.982 0 O-C-N 120.988 -1.07 . . . . 131.19 109.036 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.485 ' CB ' ' HE ' ' A' ' 38' ' ' ARG . 93.0 Cg_endo -85.78 129.29 3.5 Favored 'Trans proline' 0 N--CA 1.491 1.325 0 C-N-CA 122.636 2.224 . . . . 108.54 115.099 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.577 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -55.43 135.11 50.66 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.017 -1.105 . . . . 43.4 108.017 177.374 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -80.55 -16.27 54.62 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 121.826 -0.546 . . . . 113.04 110.954 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.48 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 13.9 m-85 -109.77 -66.61 1.05 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.603 -1.311 . . . . 118.47 112.333 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.577 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.9 p -91.01 12.72 18.84 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.602 -1.311 . . . . 56.06 112.209 -178.482 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 37' ' ' LYS . . . 69.79 -11.44 1.84 Allowed Glycine 0 N--CA 1.511 3.651 0 O-C-N 121.099 -1.001 . . . . 19.15 115.581 175.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.417 ' C ' ' O ' ' A' ' 36' ' ' GLY . 21.9 tttp -46.55 154.44 0.3 Allowed 'General case' 0 N--CA 1.507 2.411 0 CA-C-N 120.423 2.111 . . . . 73.47 108.717 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.485 ' HE ' ' CB ' ' A' ' 31' ' ' PRO . 1.1 mmt85 -120.23 147.6 44.74 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 120.081 -1.637 . . . . 160.56 109.785 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.541 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 77.5 m-85 -128.7 171.86 11.79 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.537 -0.727 . . . . 72.45 109.373 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.592 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 2.8 p-80 -109.58 -8.43 14.99 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.828 -0.545 . . . . 97.77 111.108 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -128.52 123.13 32.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.745 -1.222 . . . . 106.11 109.708 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -43.88 -66.1 0.42 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.887 -1.133 . . . . 136.29 111.177 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 21.9 t -47.18 -33.28 5.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.356 -0.84 . . . . 65.22 111.094 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -69.09 -45.2 70.86 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.129 -1.029 . . . . 40.66 108.28 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.554 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 35.7 ttp -63.03 -46.18 88.8 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.215 -1.402 . . . . 31.66 107.215 177.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.557 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 3.9 mmpt? -52.04 -40.74 61.54 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.33 -0.989 . . . . 103.12 108.33 -179.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.6 mtmt -63.14 -32.83 74.31 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 107.272 -1.381 . . . . 48.51 107.272 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.554 ' HB3' ' O ' ' A' ' 45' ' ' MET . 53.6 t60 -69.4 -65.82 0.66 Allowed 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 106.753 -1.573 . . . . 65.66 106.753 177.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.557 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 25.6 p -42.38 -30.43 0.33 Allowed 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.832 -1.168 . . . . 47.02 109.936 177.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.56 ' CD1' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-30 -73.46 -34.99 65.66 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.301 -0.875 . . . . 54.63 110.283 -179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 48' ' ' HIS . 19.2 pt -69.13 -22.28 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 C-N-CA 118.191 -1.404 . . . . 99.09 107.583 177.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.458 ' CE1' ' HB2' ' A' ' 34' ' ' TYR . 45.0 m-70 -79.72 -32.48 41.2 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.022 -1.048 . . . . 59.33 108.86 176.21 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.505 HG23 ' O ' ' A' ' 49' ' ' THR . 76.3 p -87.88 -11.98 46.13 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.709 -0.62 . . . . 97.33 112.175 -177.14 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.57 19.58 65.83 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 107.87 -2.092 . . . . 23.68 107.87 -177.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.56 ' OE1' ' CD1' ' A' ' 50' ' ' PHE . 32.3 mt-10 -79.14 130.24 35.29 Favored 'General case' 0 C--N 1.306 -1.3 0 O-C-N 121.379 -1.071 . . . . 47.26 110.922 -177.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -145.85 62.47 8.41 Favored Pre-proline 0 N--CA 1.49 1.567 0 N-CA-C 109.065 -0.717 . . . . 86.79 109.065 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -53.1 -15.47 5.09 Favored 'Trans proline' 0 N--CA 1.501 1.962 0 C-N-CA 123.132 2.554 . . . . 151.44 113.314 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.465 ' CD2' ' HG ' ' A' ' 70' ' ' SER . 60.0 m80 -94.54 96.16 9.28 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.85 -1.156 . . . . 42.67 108.86 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.444 ' O ' ' C ' ' A' ' 60' ' ' CYS . 95.9 mttt -93.6 120.46 33.9 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.035 -1.041 . . . . 72.96 110.615 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.664 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 3.9 t -38.47 -86.68 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.728 -0.607 . . . . 38.91 109.765 179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.664 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 8.7 mm100 117.1 -16.51 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.732 0 CA-C-O 122.173 0.987 . . . . 124.0 108.804 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.47 HG11 ' CG ' ' A' ' 80' ' ' HIS . 5.6 t -95.86 -63.04 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 CA-C-O 121.776 0.798 . . . . 56.07 109.994 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 23.8 p -101.42 -14.05 17.72 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.856 -0.528 . . . . 63.83 111.647 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.71 27.43 9.04 Favored Glycine 0 N--CA 1.504 3.207 0 O-C-N 120.372 -1.455 . . . . 23.81 111.709 178.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -105.37 164.0 12.19 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.514 -1.58 . . . . 120.74 107.41 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.444 ' C ' ' CD2' ' A' ' 67' ' ' PHE . . . -134.27 163.22 30.11 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.897 -1.127 . . . . 39.51 111.518 -177.301 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.444 ' CD2' ' C ' ' A' ' 66' ' ' ALA . 66.2 m-85 -145.5 147.18 31.87 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 122.569 1.176 . . . . 62.57 113.548 -177.115 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 78.6 p -81.6 -10.72 59.36 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 115.266 -0.879 . . . . 84.84 109.193 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -133.63 145.06 49.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.214 -0.928 . . . . 93.39 110.646 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.465 ' HG ' ' CD2' ' A' ' 58' ' ' HIS . 10.0 m -71.2 -47.44 57.42 Favored 'General case' 0 C--O 1.197 -1.685 0 C-N-CA 119.45 -0.9 . . . . 67.34 109.135 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.616 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.6 OUTLIER -50.45 -33.22 20.26 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.193 -0.942 . . . . 68.68 108.58 179.675 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -77.37 -34.09 55.12 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.976 -1.078 . . . . 33.83 108.347 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.0 tp -73.28 -39.41 65.39 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.105 -1.072 . . . . 75.65 108.105 177.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' A' ' 71' ' ' SER . 93.0 mt -57.86 -53.79 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 O-C-N 120.768 -1.207 . . . . 27.72 108.666 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.475 ' HA ' ' HE ' ' A' ' 78' ' ' ARG . 97.4 m -59.08 -43.86 91.83 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.865 -1.147 . . . . 95.2 108.372 179.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.409 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 31.8 t60 -58.54 -43.34 89.22 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 122.563 1.173 . . . . 66.3 108.149 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 36.4 t -68.38 -34.51 76.18 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.173 -0.955 . . . . 87.23 109.279 178.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.475 ' HE ' ' HA ' ' A' ' 75' ' ' THR . 28.1 mtm180 -61.38 -33.68 74.07 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 107.948 -1.13 . . . . 73.27 107.948 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.431 ' NZ ' ' OP2' ' B' ' 103' ' ' ' DT' . 0.0 OUTLIER -64.34 -47.9 77.59 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 107.19 -1.411 . . . . 80.85 107.19 178.339 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.47 ' CG ' HG11 ' A' ' 62' ' ' VAL . 53.3 m-70 -61.05 -44.96 96.61 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 117.834 -1.547 . . . . 46.01 109.077 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 33.8 m -50.31 -54.8 18.85 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.442 -0.786 . . . . 89.5 110.383 -177.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.65 -1.38 . . . . 8.65 109.65 179.995 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.946 0 C4'-C3'-C2' 104.737 1.537 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.794 0 O4'-C4'-C3' 107.212 1.612 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 103' ' ' ' DT' . . . . . 0.446 ' O4 ' ' O4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.848 0 C1'-O4'-C4' 106.506 -2.281 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 104' ' ' ' DA' . . . . . 0.562 ' C6 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.861 0 O4'-C4'-C3' 107.212 1.612 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' ' DA' . . . . . 0.58 ' C2 ' ' C4 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.12 0 O4'-C4'-C3' 107.163 1.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.58 ' C4 ' ' C2 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.93 0 O4'-C4'-C3' 107.551 1.951 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.539 2.059 0 C1'-O4'-C4' 106.547 -2.252 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.821 0 C1'-O4'-C4' 106.708 -2.137 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 109' ' ' ' DA' . . . . . 0.69 ' P ' HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C5'--C4' 1.521 1.252 0 O4'-C4'-C3' 107.04 1.44 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 110' ' ' ' DC' . . . . . 0.429 ' OP2' ' NH2' ' A' ' 13' ' ' ARG . . . . . . . . 0 C5'--C4' 1.526 1.888 0 O4'-C4'-C3' 107.109 1.509 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' ' DT' . . . . . 0.472 ' O2 ' ' C2 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.988 0 C1'-O4'-C4' 106.874 -2.018 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 112' ' ' ' DG' . . . . . 0.545 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.78 0 O4'-C4'-C3' 107.3 1.7 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.545 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.096 0 C1'-O4'-C4' 107.656 -1.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.825 0 C1'-O4'-C4' 107.162 -1.813 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.909 0 C4'-C3'-C2' 104.751 1.551 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.937 0 O4'-C4'-C3' 107.385 1.785 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.94 0 O4'-C4'-C3' 107.074 1.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.976 0 C1'-O4'-C4' 107.34 -1.685 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 203' ' ' ' DG' . . . . . 0.401 ' H8 ' ' HG ' ' A' ' 14' ' ' SER . . . . . . . . 0 O4'--C4' 1.425 -1.933 0 C1'-O4'-C4' 106.831 -2.05 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.051 0 C1'-O4'-C4' 107.362 -1.67 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.657 0 O4'-C4'-C3' 107.418 1.818 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 206' ' ' ' DA' . . . . . 0.524 ' C2 ' ' C5 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.809 0 O4'-C4'-C3' 107.352 1.752 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 207' ' ' ' DG' . . . . . 0.524 ' C5 ' ' C2 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.913 0 O4'-C4'-C3' 107.149 1.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.823 0 C1'-O4'-C4' 107.243 -1.755 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 209' ' ' ' DG' . . . . . 0.546 ' N2 ' ' N3 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.807 0 O4'-C4'-C3' 107.415 1.815 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 210' ' ' ' DA' . . . . . 0.584 ' C2 ' ' C2 ' ' C' ' 211' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.523 1.555 0 O4'-C4'-C3' 107.476 1.876 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 211' ' ' ' DT' . . . . . 0.584 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -1.984 0 C1'-O4'-C4' 106.714 -2.133 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.686 0 C1'-O4'-C4' 106.703 -2.141 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 213' ' ' ' DT' . . . . . 0.514 ' C4 ' ' C6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.883 0 C1'-O4'-C4' 107.133 -1.833 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 214' ' ' ' DA' . . . . . 0.514 ' C6 ' ' C4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.238 0 O4'-C4'-C3' 107.275 1.675 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.968 0 C1'-O4'-C4' 107.006 -1.924 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.983 0 O4'-C4'-C3' 107.122 1.522 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.6 t . . . . . 0 N--CA 1.491 1.617 0 N-CA-C 109.089 -0.708 . . . . 65.13 109.089 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.548 ' CE1' ' N ' ' A' ' 14' ' ' SER . 13.7 m-85 -119.13 126.9 52.7 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.222 -0.924 . . . . 70.07 108.834 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -104.96 137.36 42.83 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 122.287 1.041 . . . . 83.59 112.016 -178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.41 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 0.5 OUTLIER -75.57 130.26 38.52 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-N 115.199 -0.91 . . . . 50.89 110.34 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -98.82 32.12 2.72 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 121.216 0.532 . . . . 99.16 109.617 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.473 HG21 ' CG ' ' A' ' 24' ' ' HIS . 5.2 mm -126.92 -78.38 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.293 -0.879 . . . . 112.28 108.82 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.54 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 31.7 p -83.26 -52.07 6.9 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.559 -1.645 . . . . 82.08 106.559 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.54 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 121.46 62.77 0.23 Allowed Glycine 0 N--CA 1.496 2.659 0 C-N-CA 119.761 -1.209 . . . . 195.93 113.401 176.6 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.41 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 34.6 tttt -131.11 161.6 31.73 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 106.357 -1.72 . . . . 114.22 106.357 176.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.3 p -115.37 167.91 10.44 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.094 -1.629 . . . . 78.05 112.466 -176.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.508 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 55.3 m-85 -145.43 131.95 19.79 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 115.078 -0.965 . . . . 54.66 110.966 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -19.57 63.07 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 115.788 -0.642 . . . . 101.13 110.035 -179.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.426 ' O ' ' OG1' ' A' ' 16' ' ' THR . 0.1 OUTLIER -124.9 136.81 54.12 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.32 -0.863 . . . . 74.89 109.975 -178.32 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.548 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 30.5 t -56.07 -33.12 64.72 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 118.975 -1.09 . . . . 25.87 108.337 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.5 p -65.22 -42.06 93.81 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.039 -0.726 . . . . 23.45 109.039 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.464 HG22 " C2'" ' B' ' 109' ' ' ' DA' . 0.2 OUTLIER -63.44 -33.25 75.14 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.336 -1.357 . . . . 32.27 107.336 179.555 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.444 HD22 ' HB3' ' A' ' 2' ' ' PHE . 16.7 tp -72.37 -46.32 55.91 Favored 'General case' 0 C--O 1.199 -1.59 0 N-CA-C 106.009 -1.848 . . . . 97.78 106.009 177.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.65 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 19.1 t -48.74 -58.84 4.16 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.162 -0.961 . . . . 34.23 108.505 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.501 HG23 ' CD2' ' A' ' 40' ' ' HIS . 87.4 m -54.61 -36.49 64.51 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.06 0.933 . . . . 30.69 109.163 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.508 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 64.4 t60 -68.21 -47.08 68.85 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-O 122.5 1.143 . . . . 81.83 108.269 179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 21' ' ' LEU . 72.9 mt -59.97 -34.35 73.18 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 106.448 -1.686 . . . . 156.93 106.448 179.221 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.658 HD12 ' CE1' ' A' ' 40' ' ' HIS . 7.0 mt -62.36 -31.18 71.79 Favored 'General case' 0 C--O 1.205 -1.246 0 N-CA-C 107.237 -1.394 . . . . 64.07 107.237 178.121 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.432 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 65.1 mt -63.01 -34.88 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.38 -1.45 . . . . 150.1 108.112 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.473 ' CG ' HG21 ' A' ' 6' ' ' ILE . 97.2 m-70 -85.59 -14.39 45.89 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.248 -0.981 . . . . 55.94 109.434 178.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.537 ' O ' ' C ' ' A' ' 26' ' ' ASP . 4.9 p -108.62 0.24 20.59 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.945 -1.097 . . . . 89.1 109.457 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.537 ' C ' ' O ' ' A' ' 25' ' ' SER . 9.9 m-20 27.88 51.5 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.323 0.582 . . . . 62.89 109.845 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.581 HG21 HD13 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -66.53 -47.09 74.01 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.882 -0.784 . . . . 115.68 108.882 179.601 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.434 ' H ' ' HD2' ' A' ' 28' ' ' ARG . 9.6 mpt_? 37.33 65.76 2.42 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.694 -0.629 . . . . 115.33 111.354 178.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 40' ' ' HIS . 70.7 Cg_endo -83.07 31.58 0.52 Allowed 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.998 2.465 . . . . 90.27 113.378 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -136.13 76.23 51.79 Favored Pre-proline 0 N--CA 1.5 2.066 0 O-C-N 120.795 -1.191 . . . . 131.19 108.605 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.43 ' HB3' ' HE ' ' A' ' 38' ' ' ARG . 18.5 Cg_exo -66.09 160.4 44.84 Favored 'Trans proline' 0 N--CA 1.502 2.028 0 C-N-CA 123.331 2.688 . . . . 108.54 114.681 -178.008 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.565 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -83.79 136.53 34.11 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 122.058 0.932 . . . . 43.4 108.633 178.215 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -79.23 -16.92 55.77 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 115.842 -0.617 . . . . 113.04 109.772 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.538 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 18.1 m-85 -111.89 -71.02 0.78 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.779 -1.201 . . . . 118.47 112.634 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.565 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 20.1 p -83.03 -18.72 38.73 Favored 'General case' 0 N--CA 1.517 2.883 0 O-C-N 120.331 -1.481 . . . . 56.06 113.7 -177.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.567 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 114.05 -35.01 4.68 Favored Glycine 0 N--CA 1.511 3.65 0 O-C-N 120.189 -1.569 . . . . 19.15 113.518 176.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.567 ' O ' ' O ' ' A' ' 36' ' ' GLY . 5.8 mtpm? -26.57 149.34 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.862 0 O-C-N 121.075 -1.25 . . . . 73.47 110.772 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.433 ' NH2' ' O ' ' A' ' 36' ' ' GLY . 3.2 mmp_? -116.89 136.61 52.81 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.823 -1.176 . . . . 160.56 107.823 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.424 ' CZ ' ' CG ' ' A' ' 48' ' ' HIS . 34.1 m-85 -124.91 176.78 6.41 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.311 -0.996 . . . . 72.45 108.311 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.658 ' CE1' HD12 ' A' ' 22' ' ' LEU . 2.1 t60 -113.34 -19.38 11.76 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.73 -0.788 . . . . 97.77 111.563 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.558 ' HG3' ' CD2' ' A' ' 40' ' ' HIS . 67.5 mt-30 -121.88 128.43 51.59 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.728 -1.232 . . . . 106.11 111.635 -178.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.42 ' C ' ' O ' ' A' ' 41' ' ' GLN . 35.1 tptt -41.98 -71.05 0.09 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.227 -0.921 . . . . 136.29 110.109 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.411 ' C ' ' O ' ' A' ' 42' ' ' LYS . 26.0 p -43.5 -29.26 0.44 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.909 -1.12 . . . . 65.22 110.619 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 41' ' ' GLN . 4.8 m-20 -70.57 -47.59 59.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.377 -1.452 . . . . 40.66 107.822 178.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.497 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.0 tmm? -63.98 -48.01 78.12 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.425 -1.422 . . . . 31.66 107.796 178.046 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.579 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 90.2 mttt -51.1 -36.02 38.25 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.041 -1.096 . . . . 103.12 108.041 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.638 ' O ' HG23 ' A' ' 51' ' ' ILE . 30.3 mtpt -68.49 -34.52 76.06 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.106 -1.442 . . . . 48.51 107.106 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.813 ' O ' HG12 ' A' ' 51' ' ' ILE . 66.3 t60 -70.94 -64.49 0.89 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 106.9 -1.518 . . . . 65.66 106.9 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.579 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 16.9 p -42.66 -33.6 0.75 Allowed 'General case' 0 C--N 1.31 -1.148 0 O-C-N 120.414 -1.429 . . . . 47.02 108.775 177.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.531 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.1 m-85 -69.54 -28.06 65.69 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.057 -1.027 . . . . 54.63 108.233 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.813 HG12 ' O ' ' A' ' 48' ' ' HIS . 12.6 pt -73.34 -19.12 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 120.74 -1.225 . . . . 99.09 109.32 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.439 ' CD2' ' HB2' ' A' ' 34' ' ' TYR . 69.4 m-70 -89.9 -31.49 17.27 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.367 -1.458 . . . . 59.33 108.754 177.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.531 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 41.3 p -84.65 -20.73 30.84 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-N 115.345 -0.843 . . . . 97.33 109.329 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 71.72 49.06 25.41 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 108.606 -1.798 . . . . 23.68 108.606 -177.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.42 110.49 22.5 Favored 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.515 -0.991 . . . . 47.26 109.025 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -117.86 70.75 7.51 Favored Pre-proline 0 N--CA 1.494 1.725 0 O-C-N 121.5 -0.75 . . . . 86.79 110.556 -178.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -60.76 -8.2 8.91 Favored 'Trans proline' 0 N--CA 1.505 2.163 0 C-N-CA 123.841 3.027 . . . . 151.44 114.082 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.553 ' HB3' HD22 ' A' ' 73' ' ' LEU . 96.7 m-70 -101.83 93.0 5.07 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.549 -1.345 . . . . 42.67 108.315 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.457 ' CB ' ' NZ ' ' A' ' 59' ' ' LYS . 7.3 mtpm? -94.78 128.12 41.27 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.281 -0.887 . . . . 72.96 110.151 -178.682 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -79.43 124.64 28.64 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.702 0.763 . . . . 38.91 109.586 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -85.66 11.26 11.23 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.254 -0.904 . . . . 124.0 110.046 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.827 HG11 ' CG ' ' A' ' 80' ' ' HIS . 22.3 t -98.81 -58.1 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 120.865 -1.147 . . . . 56.07 111.049 -178.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 31.8 p -107.15 -25.5 11.52 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.157 -0.964 . . . . 63.83 109.76 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 109.39 10.85 22.96 Favored Glycine 0 N--CA 1.5 2.94 0 O-C-N 120.901 -1.125 . . . . 23.81 111.687 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 tttm -88.81 174.54 7.92 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.446 -1.62 . . . . 120.74 108.765 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -137.65 150.38 47.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.761 -1.212 . . . . 39.51 111.419 -177.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.508 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 63.8 m-85 -132.09 147.68 52.45 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 122.167 0.984 . . . . 62.57 111.534 -178.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.8 m -83.55 -19.6 35.33 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 108.934 -0.765 . . . . 84.84 108.934 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -122.53 146.1 47.71 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.121 -1.032 . . . . 93.39 111.697 -177.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 10.6 m -65.45 -40.82 93.69 Favored 'General case' 0 C--O 1.199 -1.571 0 N-CA-C 106.794 -1.558 . . . . 67.34 106.794 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.444 ' OG ' ' H72' ' C' ' 211' ' ' ' DT' . 29.5 t -50.24 -45.69 54.23 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.479 -0.763 . . . . 68.68 109.356 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -73.25 -30.99 63.84 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 118.72 -1.192 . . . . 33.83 109.459 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.553 HD22 ' HB3' ' A' ' 58' ' ' HIS . 18.2 tp -74.4 -39.76 62.47 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.869 -1.144 . . . . 75.65 108.987 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.453 HD13 " H3'" ' C' ' 209' ' ' ' DG' . 97.3 mt -63.6 -50.4 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 120.254 -1.529 . . . . 27.72 107.67 177.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.7 m -57.98 -49.8 75.58 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 122.286 1.041 . . . . 95.2 108.64 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.508 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 28.3 t60 -58.64 -48.7 80.15 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.783 0.801 . . . . 66.3 110.717 -178.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.1 t -70.09 -34.29 72.97 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 120.136 -1.602 . . . . 87.23 108.656 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.406 ' CG ' ' O ' ' A' ' 74' ' ' ILE . 19.8 mmt180 -55.9 -32.13 63.46 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 107.083 -1.451 . . . . 73.27 107.083 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -69.29 -47.9 63.21 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.946 -1.131 . . . . 80.85 107.946 177.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.827 ' CG ' HG11 ' A' ' 62' ' ' VAL . 60.1 m-70 -56.98 -58.04 9.9 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 117.078 -1.849 . . . . 46.01 107.9 178.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 49.5 m -49.12 -52.27 27.11 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.102 -1.073 . . . . 89.5 108.102 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 109.392 -1.483 . . . . 8.65 109.392 179.928 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.973 0 C1'-O4'-C4' 107.391 -1.649 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.134 0 C4'-C3'-C2' 104.962 1.762 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 103' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.679 0 C1'-O4'-C4' 106.599 -2.215 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 104' ' ' ' DA' . . . . . 0.555 ' C6 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.064 0 O4'-C4'-C3' 107.009 1.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' ' DA' . . . . . 0.578 ' C6 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.935 0 C1'-O4'-C4' 107.362 -1.67 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.578 ' C6 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.431 -1.353 0 O4'-C4'-C3' 107.638 2.038 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.044 0 C1'-O4'-C4' 106.305 -2.425 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.135 0 C1'-O4'-C4' 106.721 -2.128 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 109' ' ' ' DA' . . . . . 0.533 ' C2 ' ' C2 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.441 0 O4'-C4'-C3' 107.067 1.467 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 110' ' ' ' DC' . . . . . 0.533 ' C2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.062 0 O4'-C4'-C3' 107.169 1.569 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' ' DT' . . . . . 0.496 ' C4 ' ' C4 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.844 0 C1'-O4'-C4' 107.213 -1.777 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' ' DG' . . . . . 0.606 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.835 0 O4'-C4'-C3' 106.795 1.195 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.606 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.984 0 O4'-C4'-C3' 107.074 1.474 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.046 0 C1'-O4'-C4' 107.399 -1.644 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.989 0 C1'-O4'-C4' 107.273 -1.733 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.99 0 O4'-C4'-C3' 107.344 1.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.01 0 C4'-C3'-C2' 104.738 1.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.859 0 O4'-C4'-C3' 107.178 1.578 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.009 0 C1'-O4'-C4' 107.095 -1.86 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.085 0 C1'-O4'-C4' 107.309 -1.708 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.846 0 O4'-C4'-C3' 107.124 1.524 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.757 0 O4'-C4'-C3' 107.311 1.711 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 207' ' ' ' DG' . . . . . 0.438 ' N2 ' ' O2 ' ' B' ' 111' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.865 0 O4'-C4'-C3' 107.319 1.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 208' ' ' ' DT' . . . . . 0.419 ' C2 ' ' C2 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.987 0 C1'-O4'-C4' 107.153 -1.819 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 209' ' ' ' DG' . . . . . 0.453 " H3'" HD13 ' A' ' 74' ' ' ILE . . . . . . . . 0 C5'--C4' 1.526 1.924 0 O4'-C4'-C3' 107.153 1.553 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 210' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.892 0 O4'-C4'-C3' 107.399 1.799 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 211' ' ' ' DT' . . . . . 0.444 ' H72' ' OG ' ' A' ' 71' ' ' SER . . . . . . . . 0 O4'--C4' 1.425 -1.864 0 C1'-O4'-C4' 106.378 -2.373 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.765 0 C1'-O4'-C4' 106.472 -2.306 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.912 0 C1'-O4'-C4' 106.895 -2.003 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 214' ' ' ' DA' . . . . . 0.451 ' C5 ' ' C4 ' ' C' ' 215' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.996 0 O4'-C4'-C3' 107.362 1.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 215' ' ' ' DT' . . . . . 0.451 ' C4 ' ' C5 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -2.044 0 C1'-O4'-C4' 107.227 -1.766 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.915 0 O4'-C4'-C3' 107.028 1.428 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.2 t . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.397 -0.594 . . . . 2.19 109.397 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 2' ' ' PHE . 0.4 OUTLIER -111.55 127.88 55.86 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 107.51 -1.293 . . . . 1.35 107.51 178.872 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.573 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 0.5 OUTLIER -110.63 132.99 53.71 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 122.532 1.158 . . . . 1.67 110.95 -178.755 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.29 129.82 41.88 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 113.886 -1.506 . . . . 0.92 111.037 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -103.64 30.6 4.93 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.276 -0.89 . . . . 2.46 109.315 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.615 HD12 ' CD2' ' A' ' 24' ' ' HIS . 29.0 mt -121.45 -29.59 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 119.754 -0.778 . . . . 1.51 111.0 -178.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.5 p -142.07 -27.75 0.63 Allowed 'General case' 0 C--N 1.298 -1.667 0 C-N-CA 118.995 -1.082 . . . . 1.5 109.784 -179.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 112.06 61.58 0.46 Allowed Glycine 0 N--CA 1.498 2.792 0 C-N-CA 119.489 -1.338 . . . . 1.27 114.1 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.0 tttm -142.83 150.95 40.6 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.543 -1.563 . . . . 1.33 107.817 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 3' ' ' ASP . 3.6 p -109.86 158.8 17.8 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.731 -1.231 . . . . 0.8 111.911 -176.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.629 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 63.1 m-85 -136.68 128.17 28.55 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 115.275 -0.875 . . . . 0.7 111.335 -178.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -69.99 -21.1 63.26 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 115.447 -0.797 . . . . 2.61 108.96 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.401 ' HB2' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -127.82 140.82 51.8 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 122.123 0.964 . . . . 2.04 109.976 -177.762 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.5 t -59.49 -33.36 71.24 Favored 'General case' 0 C--N 1.289 -2.029 0 O-C-N 120.48 -1.388 . . . . 1.27 107.411 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.1 p -61.55 -52.0 66.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 119.94 -0.704 . . . . 1.48 109.462 -178.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.468 HG22 H2'' ' B' ' 109' ' ' ' DA' . 0.0 OUTLIER -58.2 -36.02 72.5 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.184 -1.043 . . . . 0.95 108.184 -179.865 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.8 tp -69.62 -40.51 76.55 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 107.128 -1.434 . . . . 0.62 107.128 177.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.674 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.5 t -53.12 -50.25 64.88 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.283 -0.886 . . . . 0.74 109.389 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 74.9 m -65.09 -38.26 90.17 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.948 -1.095 . . . . 1.2 108.816 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.629 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 43.8 t60 -61.27 -41.95 97.8 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.218 -1.03 . . . . 0.8 108.218 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 54.2 mt -62.51 -35.34 79.08 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 106.969 -1.493 . . . . 0.82 106.969 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 18' ' ' SER . 31.9 mt -65.5 -30.05 70.77 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.643 -1.243 . . . . 1.16 107.643 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.525 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 67.8 mt -59.87 -40.11 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 O-C-N 120.102 -1.624 . . . . 1.38 106.64 177.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.615 ' CD2' HD12 ' A' ' 6' ' ' ILE . 77.7 m-70 -72.76 -60.88 2.02 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 118.432 -1.307 . . . . 1.29 109.44 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.424 ' O ' ' C ' ' A' ' 26' ' ' ASP . 20.2 m -62.11 -5.7 2.45 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.835 -1.165 . . . . 1.63 112.148 -178.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 25' ' ' SER . 65.3 m-20 43.73 63.18 1.66 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.844 -1.16 . . . . 1.45 109.132 -177.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.546 ' C ' HH11 ' A' ' 28' ' ' ARG . 1.8 m -99.4 111.26 23.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.424 -0.797 . . . . 1.22 109.294 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.546 HH11 ' C ' ' A' ' 27' ' ' THR . 1.7 mpt_? -125.45 79.22 67.25 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.47 -0.769 . . . . 0.97 110.225 -179.101 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -78.54 9.08 3.33 Favored 'Trans proline' 0 C--N 1.313 -1.314 0 C-N-CA 122.682 2.255 . . . . 1.1 112.437 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.507 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 60.0 m-85 -117.92 84.94 21.98 Favored Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 121.303 -0.873 . . . . 0.8 109.435 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -83.43 143.03 10.85 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.321 2.014 . . . . 0.85 112.943 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.478 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -67.15 149.72 50.11 Favored 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 119.298 -0.961 . . . . 0.51 109.796 -179.307 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.447 HE21 HG21 ' A' ' 49' ' ' THR . 0.4 OUTLIER -87.42 -23.54 24.48 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.93 -0.708 . . . . 1.31 111.633 -178.53 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.491 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 5.2 m-85 -102.91 -69.78 0.78 Allowed 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 117.364 -1.734 . . . . 0.76 111.289 -179.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 15.3 p -81.15 -23.34 38.34 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.559 -1.338 . . . . 0.51 111.728 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.609 ' O ' ' NH1' ' A' ' 38' ' ' ARG . . . 102.72 -4.33 50.05 Favored Glycine 0 N--CA 1.514 3.855 0 O-C-N 120.201 -1.562 . . . . 0.54 116.441 174.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.5 ' C ' ' O ' ' A' ' 36' ' ' GLY . 36.0 mttp -47.14 156.91 0.2 Allowed 'General case' 0 N--CA 1.509 2.489 0 CA-C-N 122.39 3.095 . . . . 1.38 108.649 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.609 ' NH1' ' O ' ' A' ' 36' ' ' GLY . 9.6 mmt-85 -111.09 123.54 50.4 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 107.465 -1.309 . . . . 2.11 107.465 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.459 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 82.9 m-85 -113.85 164.62 13.52 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.712 -1.242 . . . . 0.69 109.889 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.512 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -103.19 -6.64 21.94 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 116.243 -0.435 . . . . 1.03 111.073 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -133.33 119.67 20.03 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.538 -1.351 . . . . 1.03 110.201 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.507 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 71.8 tttt -41.61 -61.32 1.1 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.521 -0.737 . . . . 0.59 110.895 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.4 p -53.7 -30.14 42.28 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.254 -0.904 . . . . 1.42 111.971 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 47' ' ' LYS . 51.4 m-20 -76.67 -39.71 51.3 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 117.385 -1.726 . . . . 1.48 107.588 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.655 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 7.6 tmm? -60.81 -46.72 89.44 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 105.728 -1.953 . . . . 0.48 105.728 176.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.511 ' O ' ' OG1' ' A' ' 49' ' ' THR . 59.8 tttp -54.2 -38.0 65.16 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.105 -1.072 . . . . 2.61 108.105 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.576 ' O ' HG23 ' A' ' 51' ' ' ILE . 47.5 mtpt -66.47 -32.65 74.14 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 106.582 -1.636 . . . . 1.55 106.582 177.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.684 ' O ' HG12 ' A' ' 51' ' ' ILE . 71.0 t60 -64.74 -60.12 3.47 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 107.016 -1.476 . . . . 0.45 107.016 176.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.511 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 54.2 p -47.46 -36.67 10.39 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 120.944 -1.098 . . . . 0.56 111.154 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.443 ' CD1' ' OE1' ' A' ' 55' ' ' GLU . 3.2 m-85 -69.3 -31.77 70.46 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.633 -1.292 . . . . 0.8 109.666 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.684 HG12 ' O ' ' A' ' 48' ' ' HIS . 3.0 pt -65.21 -32.49 58.49 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.236 0 C-N-CA 118.423 -1.311 . . . . 0.76 108.159 177.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.444 ' CE1' ' HB2' ' A' ' 34' ' ' TYR 0.251 60.6 m-70 -77.07 -33.88 57.08 Favored 'General case' 0 N--CA 1.537 3.879 0 O-C-N 120.492 -1.38 . . . . 0.84 111.054 177.48 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 49' ' ' THR . 73.9 p -79.66 -16.68 55.31 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 106.17 -1.789 . . . . 0.99 106.17 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 67.58 68.98 1.48 Allowed Glycine 0 C--O 1.203 -1.831 0 N-CA-C 104.396 -3.481 . . . . 1.09 104.396 -174.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.443 ' OE1' ' CD1' ' A' ' 50' ' ' PHE . 50.1 mt-10 -120.91 128.48 52.82 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.449 -0.945 . . . . 1.92 108.449 -179.078 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.9 mmtm -133.36 79.03 61.9 Favored Pre-proline 0 C--N 1.297 -1.702 0 C-N-CA 119.938 -0.705 . . . . 1.27 109.335 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.87 0.9 5.05 Favored 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 122.158 1.905 . . . . 0.77 112.801 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.5 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 56.7 m80 -112.85 89.86 3.19 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.101 -1.0 . . . . 0.75 108.851 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.434 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 62.3 mttp -94.5 133.43 38.12 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.092 -1.005 . . . . 1.79 112.268 -177.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.405 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -80.35 117.81 21.44 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 106.821 -1.548 . . . . 0.39 106.821 176.875 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.434 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 22.0 mm-40 -84.19 12.64 6.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.56 -0.713 . . . . 2.78 109.221 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.405 ' HB ' ' SG ' ' A' ' 60' ' ' CYS . 13.7 t -98.03 -65.67 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.888 0 C-N-CA 120.044 -0.662 . . . . 0.47 111.088 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.2 p -107.26 -7.62 16.68 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.504 -0.878 . . . . 0.59 113.179 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 111.25 -11.78 28.76 Favored Glycine 0 N--CA 1.515 3.963 0 C-N-CA 118.437 -1.84 . . . . 0.53 113.884 176.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -78.58 169.11 18.77 Favored 'General case' 0 N--CA 1.509 2.515 0 CA-C-N 120.171 1.986 . . . . 0.77 111.526 -177.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -138.42 150.67 46.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.374 -0.829 . . . . 0.65 109.487 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.573 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 35.9 m-85 -133.31 152.38 51.92 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 122.482 1.134 . . . . 0.56 112.794 -177.298 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.9 p -81.62 -29.94 33.04 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 115.055 -0.975 . . . . 1.64 108.537 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -117.28 146.91 43.0 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 122.114 0.959 . . . . 1.59 111.604 -178.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.451 ' O ' HG13 ' A' ' 74' ' ' ILE . 6.1 m -65.96 -44.07 86.06 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 118.792 -1.163 . . . . 1.23 107.937 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.582 ' OG ' ' H73' ' C' ' 211' ' ' ' DT' . 15.2 t -49.13 -42.49 39.52 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.149 -0.969 . . . . 1.8 109.136 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.8 m-20 -71.48 -33.71 69.53 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 117.673 -1.611 . . . . 0.82 108.096 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 58' ' ' HIS . 11.1 tp -64.62 -52.43 57.51 Favored 'General case' 0 N--CA 1.504 2.23 0 N-CA-C 106.182 -1.784 . . . . 0.52 106.182 175.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 70' ' ' SER . 45.1 mt -52.13 -55.52 9.72 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 O-C-N 121.135 -0.978 . . . . 0.83 110.865 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.0 m -59.63 -41.52 90.63 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 119.778 -1.826 . . . . 0.7 107.725 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.573 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 42.0 t60 -62.04 -45.42 93.65 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.951 0.881 . . . . 0.42 109.726 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 38.8 t -68.11 -32.89 73.51 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.003 -1.11 . . . . 0.56 108.003 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -61.04 -38.79 87.4 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.768 -1.197 . . . . 1.7 107.768 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -44.86 95.03 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 118.185 -1.406 . . . . 1.93 107.331 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -57.83 -53.37 58.98 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 118.014 -1.474 . . . . 0.65 109.273 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 56.5 p -58.85 -48.02 82.85 Favored 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 118.391 -1.323 . . . . 1.03 108.999 -177.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.041 0 C-N-CA 118.948 -1.596 . . . . 1.85 109.797 179.102 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.805 0 C4'-C3'-C2' 104.739 1.539 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 102' ' ' ' DA' . . . . . 0.546 ' C2 ' ' C2 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.424 -1.998 0 C4'-C3'-C2' 104.847 1.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' ' DT' . . . . . 0.546 ' C2 ' ' C2 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.833 0 C1'-O4'-C4' 106.48 -2.3 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 104' ' ' ' DA' . . . . . 0.584 ' C6 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.174 0 O4'-C4'-C3' 107.26 1.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 105' ' ' ' DA' . . . . . 0.584 ' C6 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.072 0 C1'-O4'-C4' 107.569 -1.522 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.558 ' N1 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.653 0 O4'-C4'-C3' 107.737 2.137 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.071 0 C1'-O4'-C4' 106.28 -2.443 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 108' ' ' ' DC' . . . . . 0.525 " H3'" HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C5'--C4' 1.527 1.943 0 C1'-O4'-C4' 107.308 -1.709 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 109' ' ' ' DA' . . . . . 0.539 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.532 1.42 0 N19-C1'-C2' 117.193 1.87 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 110' ' ' ' DC' . . . . . 0.539 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.953 0 P-O3'-C3' 121.761 1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' ' DT' . . . . . 0.478 ' O2 ' ' N2 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.19 0 C4'-C3'-C2' 104.809 1.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' ' DG' . . . . . 0.521 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.853 0 O4'-C4'-C3' 107.02 1.42 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.521 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.145 0 O4'-C4'-C3' 107.297 1.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.008 0 C1'-O4'-C4' 107.58 -1.514 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.812 0 C1'-O4'-C4' 107.156 -1.817 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.95 0 O4'-C4'-C3' 107.402 1.802 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.852 0 O4'-C4'-C3' 107.143 1.543 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.778 0 C4'-C3'-C2' 104.89 1.69 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.018 0 C1'-O4'-C4' 107.254 -1.747 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.992 0 C1'-O4'-C4' 107.071 -1.878 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.692 0 O4'-C4'-C3' 107.351 1.751 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.926 0 O4'-C4'-C3' 107.259 1.659 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 207' ' ' ' DG' . . . . . 0.478 ' N2 ' ' O2 ' ' B' ' 111' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.901 0 O4'-C4'-C3' 107.286 1.686 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.202 0 C1'-O4'-C4' 107.384 -1.654 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 209' ' ' ' DG' . . . . . 0.45 ' OP2' ' CB ' ' A' ' 70' ' ' SER . . . . . . . . 0 C5'--C4' 1.525 1.771 0 O4'-C4'-C3' 107.558 1.958 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 210' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.789 0 O4'-C4'-C3' 107.302 1.702 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 211' ' ' ' DT' . . . . . 0.582 ' H73' ' OG ' ' A' ' 71' ' ' SER . . . . . . . . 0 O4'--C4' 1.426 -1.801 0 C1'-O4'-C4' 106.074 -2.59 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.896 0 C1'-O4'-C4' 106.578 -2.23 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.014 0 C1'-O4'-C4' 106.861 -2.028 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 214' ' ' ' DA' . . . . . 0.519 ' C2 ' ' C2 ' ' C' ' 215' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.91 0 O4'-C4'-C3' 107.191 1.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 215' ' ' ' DT' . . . . . 0.519 ' C2 ' ' C2 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.02 0 C1'-O4'-C4' 107.294 -1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.944 0 O4'-C4'-C3' 107.172 1.572 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.5 t . . . . . 0 N--CA 1.488 1.471 0 N-CA-C 109.323 -0.621 . . . . 2.39 109.323 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.46 ' HB3' HD22 ' A' ' 17' ' ' LEU . 6.1 m-85 -109.97 125.51 52.94 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.188 -0.945 . . . . 1.96 109.633 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -109.18 144.91 36.64 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 122.474 1.13 . . . . 2.6 111.579 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -84.69 127.93 34.35 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.03 -0.986 . . . . 2.37 109.998 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.8 mttp -94.97 37.24 1.16 Allowed 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.207 -0.933 . . . . 2.62 109.455 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.664 HG21 ' CG ' ' A' ' 24' ' ' HIS . 12.8 mm -131.5 -26.75 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.488 -1.382 . . . . 2.82 112.345 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.4 p -136.78 -35.6 0.71 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.6 -1.312 . . . . 3.03 110.233 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.04 46.08 0.39 Allowed Glycine 0 N--CA 1.509 3.504 0 O-C-N 120.553 -1.342 . . . . 2.97 113.549 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -136.89 159.62 41.33 Favored 'General case' 0 N--CA 1.511 2.618 0 CA-C-N 119.286 1.543 . . . . 3.12 110.611 177.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.9 p -116.76 154.5 30.54 Favored 'General case' 0 N--CA 1.512 2.671 0 N-CA-C 113.913 1.079 . . . . 2.96 113.913 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -131.81 131.75 43.15 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-O 122.144 0.973 . . . . 2.27 111.746 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.684 ' H ' ' NH1' ' A' ' 13' ' ' ARG . 37.2 mmtm -74.61 -22.56 58.88 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 122.187 0.994 . . . . 3.79 109.259 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.684 ' NH1' ' H ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -118.21 136.12 53.84 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 115.172 -0.922 . . . . 2.93 111.39 -177.239 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 t -65.2 -34.34 78.15 Favored 'General case' 0 C--O 1.195 -1.809 0 C-N-CA 118.379 -1.328 . . . . 1.38 108.917 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 p -59.37 -37.48 78.0 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.318 -1.489 . . . . 1.5 109.718 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.529 HG21 ' OP2' ' B' ' 110' ' ' ' DC' . 29.8 m -73.77 -29.83 62.43 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.622 -1.298 . . . . 1.81 107.612 178.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.46 HD22 ' HB3' ' A' ' 2' ' ' PHE . 14.1 tp -72.45 -50.39 26.53 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 106.239 -1.764 . . . . 1.44 106.239 176.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.682 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 75.8 m -49.04 -61.27 2.16 Favored 'General case' 0 C--N 1.289 -2.044 0 O-C-N 120.835 -1.166 . . . . 1.27 109.071 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.657 HG23 ' NE2' ' A' ' 40' ' ' HIS . 27.3 m -52.78 -36.38 58.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.039 -1.038 . . . . 1.16 109.094 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -68.16 -44.76 75.25 Favored 'General case' 0 C--N 1.294 -1.807 0 O-C-N 121.303 -0.873 . . . . 2.02 109.17 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.0 mt -60.71 -29.25 69.23 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 105.532 -2.025 . . . . 1.55 105.532 177.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.682 ' HG ' ' O ' ' A' ' 18' ' ' SER . 27.3 mt -71.22 -27.34 63.41 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.745 -1.205 . . . . 1.16 107.745 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.546 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 66.8 mt -62.57 -44.4 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 120.086 -1.634 . . . . 1.98 108.268 178.15 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.664 ' CG ' HG21 ' A' ' 6' ' ' ILE . 77.2 m-70 -69.84 -59.35 2.99 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.455 -1.298 . . . . 2.25 108.99 177.696 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.4 m -58.5 -12.39 3.92 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.664 -1.272 . . . . 1.8 110.783 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.546 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 5.0 m-20 50.19 57.94 6.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.652 -0.655 . . . . 1.58 109.614 -178.251 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.8 m -90.42 105.66 17.97 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.31 -0.869 . . . . 2.67 109.596 179.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -122.74 80.56 48.78 Favored Pre-proline 0 N--CA 1.497 1.918 0 O-C-N 121.256 -0.902 . . . . 2.83 109.63 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -84.0 15.76 2.07 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 123.114 2.543 . . . . 1.56 114.361 -179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.489 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 85.8 m-85 -118.86 86.53 30.98 Favored Pre-proline 0 N--CA 1.501 2.114 0 O-C-N 120.963 -1.086 . . . . 1.4 108.476 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -82.93 128.85 5.24 Favored 'Trans proline' 0 C--N 1.31 -1.469 0 C-N-CA 122.739 2.293 . . . . 1.21 112.844 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.617 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 0.4 OUTLIER -47.94 142.6 4.84 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 122.426 1.108 . . . . 0.98 109.722 178.879 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.444 ' CG ' HG22 ' A' ' 49' ' ' THR . 0.0 OUTLIER -82.9 -11.83 57.87 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.549 -0.751 . . . . 1.62 109.925 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.541 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 22.9 m-85 -118.13 -73.88 0.63 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.429 -1.42 . . . . 0.85 111.168 -179.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.575 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 14.2 p -84.02 19.48 1.76 Allowed 'General case' 0 N--CA 1.515 2.813 0 CA-C-O 121.889 0.852 . . . . 1.04 110.242 -179.163 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.482 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 42.87 10.42 0.01 OUTLIER Glycine 0 N--CA 1.503 3.123 0 CA-C-N 114.095 -1.411 . . . . 1.17 114.407 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.617 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 69.6 tttt -52.42 172.84 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 121.977 2.888 . . . . 2.07 105.698 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.5 mtp85 -131.03 142.1 50.28 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 119.427 -2.046 . . . . 2.27 110.683 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.503 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 60.0 m-85 -126.6 167.47 15.62 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.748 -0.834 . . . . 1.16 108.748 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.657 ' NE2' HG23 ' A' ' 19' ' ' THR . 0.0 OUTLIER -100.59 -24.2 14.5 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.859 -0.526 . . . . 1.56 111.239 -178.764 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.456 ' O ' ' C ' ' A' ' 42' ' ' LYS . 46.8 mt-30 -118.02 116.8 27.62 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.277 -1.515 . . . . 1.75 111.607 -178.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.542 ' HZ3' ' HE2' ' A' ' 46' ' ' LYS . 62.6 tttm -34.02 -66.2 0.17 Allowed 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.058 -1.026 . . . . 2.19 112.32 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 93.4 p -48.62 -31.2 6.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.971 -1.081 . . . . 1.33 110.366 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.449 ' N ' ' O ' ' A' ' 41' ' ' GLN . 96.7 m-20 -70.09 -44.07 69.81 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.66 -1.275 . . . . 1.31 107.652 177.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.562 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 18.9 ttp -64.98 -46.16 82.63 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 120.696 -1.252 . . . . 1.01 107.976 177.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.542 ' HE2' ' HZ3' ' A' ' 42' ' ' LYS . 5.3 tppt? -53.31 -37.96 62.72 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.367 -1.346 . . . . 2.44 107.367 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.569 ' O ' HG23 ' A' ' 51' ' ' ILE . 9.4 mtpt -64.25 -33.18 75.23 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 106.25 -1.759 . . . . 2.65 106.25 177.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.717 ' O ' HG12 ' A' ' 51' ' ' ILE . 58.7 t60 -69.06 -62.61 1.31 Allowed 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 107.702 -1.221 . . . . 0.85 107.702 177.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.444 HG22 ' CG ' ' A' ' 33' ' ' GLN . 75.8 p -43.61 -36.05 1.98 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 120.639 -1.288 . . . . 0.78 110.329 178.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.619 ' CZ ' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-30 -68.59 -32.45 72.36 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 108.416 -0.957 . . . . 0.99 108.416 179.092 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.717 HG12 ' O ' ' A' ' 48' ' ' HIS . 7.1 pt -64.6 -31.81 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 C-N-CA 118.058 -1.457 . . . . 0.85 108.846 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 -77.74 -33.47 52.91 Favored 'General case' 0 N--CA 1.521 3.079 0 O-C-N 120.729 -1.232 . . . . 0.8 110.404 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.4 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 73.5 p -87.54 -6.98 58.1 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.92 0.867 . . . . 0.8 109.66 -179.182 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 52.71 69.84 1.08 Allowed Glycine 0 C--N 1.292 -1.881 0 N-CA-C 106.139 -2.784 . . . . 0.62 106.139 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.619 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 33.0 mt-10 -115.24 130.1 56.82 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 105.319 -2.104 . . . . 1.97 105.319 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.7 mttm -138.74 80.98 23.99 Favored Pre-proline 0 C--N 1.304 -1.373 0 O-C-N 120.911 -1.118 . . . . 2.28 110.467 -177.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -73.31 13.7 0.66 Allowed 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.863 2.375 . . . . 0.92 112.615 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -116.2 83.44 1.95 Allowed 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.045 -1.035 . . . . 1.23 110.064 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -87.18 138.41 31.51 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.122 -0.986 . . . . 1.73 111.434 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.576 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -99.27 120.05 38.92 Favored 'General case' 0 C--N 1.289 -2.053 0 N-CA-C 107.383 -1.34 . . . . 0.94 107.383 177.537 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -85.36 16.46 3.69 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 108.619 -0.882 . . . . 2.73 108.619 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.764 HG11 ' CG ' ' A' ' 80' ' ' HIS . 20.1 t -95.25 -57.16 4.58 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.746 0 CA-C-O 121.622 0.725 . . . . 1.44 109.151 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.8 p -115.16 -7.65 12.42 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.495 -0.753 . . . . 0.98 111.775 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.4 -3.42 56.51 Favored Glycine 0 N--CA 1.509 3.503 0 O-C-N 120.143 -1.598 . . . . 0.69 112.779 177.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.7 tttp -84.26 153.44 23.57 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.266 -1.726 . . . . 2.33 111.885 -177.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -121.03 145.09 48.14 Favored 'General case' 0 N--CA 1.514 2.768 0 O-C-N 121.753 -0.592 . . . . 1.07 110.935 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.443 ' HZ ' ' CE1' ' A' ' 76' ' ' HIS . 31.3 m-85 -128.05 161.85 28.22 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 122.128 0.966 . . . . 1.67 112.689 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.9 t -84.86 -35.7 22.05 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 115.536 -0.756 . . . . 1.7 110.239 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -113.87 141.69 47.02 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 120.929 -1.107 . . . . 2.23 110.746 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.5 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.4 OUTLIER -63.04 -46.23 88.53 Favored 'General case' 0 C--O 1.202 -1.414 0 N-CA-C 108.03 -1.1 . . . . 2.66 108.03 178.219 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.457 ' C ' ' O ' ' A' ' 70' ' ' SER . 91.9 p -44.16 -39.59 4.43 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.023 -1.048 . . . . 2.76 108.695 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -76.29 -32.97 59.07 Favored 'General case' 0 C--N 1.293 -1.856 0 C-N-CA 118.783 -1.167 . . . . 2.42 108.721 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.5 ' N ' ' O ' ' A' ' 70' ' ' SER . 26.4 tp -70.33 -53.36 17.02 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 106.491 -1.67 . . . . 2.03 106.491 175.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.533 HD11 ' P ' ' C' ' 209' ' ' ' DG' . 86.9 mt -46.97 -54.58 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 O-C-N 121.029 -1.045 . . . . 2.95 109.065 177.308 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.519 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 21.1 m -60.06 -46.64 88.89 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-O 122.539 1.161 . . . . 3.09 108.97 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.443 ' CE1' ' HZ ' ' A' ' 67' ' ' PHE . 26.4 t60 -56.02 -48.07 76.62 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.655 -0.702 . . . . 2.35 109.613 -179.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -33.02 73.56 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 119.932 -1.73 . . . . 2.39 107.621 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 35.0 mtp85 -54.34 -31.32 54.1 Favored 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 105.985 -1.857 . . . . 4.98 105.985 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -73.46 -49.89 24.48 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.223 -0.991 . . . . 3.18 108.765 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.764 ' CG ' HG11 ' A' ' 62' ' ' VAL . 61.5 m-70 -56.23 -61.67 2.23 Favored 'General case' 0 N--CA 1.501 2.08 0 C-N-CA 116.841 -1.943 . . . . 2.47 108.785 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 31.7 m -57.57 -53.1 61.99 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.264 -1.013 . . . . 3.27 108.264 -179.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.514 0 N-CA-C 109.363 -1.495 . . . . 3.59 109.363 179.862 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.773 0 C4'-C3'-C2' 104.834 1.634 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.077 0 C4'-C3'-C2' 104.823 1.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 103' ' ' ' DT' . . . . . 0.424 ' O4 ' ' O4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.678 0 C1'-O4'-C4' 105.899 -2.715 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' ' DA' . . . . . 0.509 ' C2 ' ' C4 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.919 0 C1'-O4'-C4' 107.581 -1.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 105' ' ' ' DA' . . . . . 0.509 ' C4 ' ' C2 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 P--O5' 1.612 1.93 0 O4'-C4'-C3' 107.177 1.577 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.548 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.745 0 C1'-O4'-C4' 107.039 -1.901 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' ' DT' . . . . . 0.442 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.099 0 C1'-O4'-C4' 106.012 -2.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.912 0 O4'-C4'-C3' 107.113 1.513 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 109' ' ' ' DA' . . . . . 0.571 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.576 0 C3'-C2'-C1' 99.961 -1.956 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 110' ' ' ' DC' . . . . . 0.571 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.657 0 P-O3'-C3' 122.011 1.926 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.536 1.812 0 C1'-O4'-C4' 107.16 -1.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 112' ' ' ' DG' . . . . . 0.608 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.723 0 O4'-C4'-C3' 107.454 1.854 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.608 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.814 0 C4'-C3'-C2' 104.787 1.587 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 C4'-C3'-C2' 105.09 1.89 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.744 0 O4'-C4'-C3' 107.222 1.622 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.06 0 O4'-C4'-C3' 107.449 1.849 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 201' ' ' ' DT' . . . . . 0.531 ' C2 ' ' N7 ' ' C' ' 202' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.85 0 O4'-C4'-C3' 107.217 1.617 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 202' ' ' ' DA' . . . . . 0.531 ' N7 ' ' C2 ' ' C' ' 201' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.087 0 O4'-C4'-C3' 107.433 1.833 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 203' ' ' ' DG' . . . . . 0.513 ' N2 ' ' N3 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.794 0 C4'-C3'-C2' 104.871 1.671 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 204' ' ' ' DG' . . . . . 0.513 ' N3 ' ' N2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.777 0 C1'-O4'-C4' 107.019 -1.915 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.992 0 C4'-C3'-C2' 104.904 1.704 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.824 0 O4'-C4'-C3' 107.47 1.87 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 207' ' ' ' DG' . . . . . 0.404 ' O6 ' ' N6 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.732 0 C4'-C3'-C2' 104.774 1.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.199 0 C4'-C3'-C2' 104.885 1.685 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 209' ' ' ' DG' . . . . . 0.533 ' P ' HD11 ' A' ' 74' ' ' ILE . . . . . . . . 0 C5'--C4' 1.527 1.96 0 O4'-C4'-C3' 107.067 1.467 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 210' ' ' ' DA' . . . . . 0.548 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.71 0 O4'-C4'-C3' 107.314 1.714 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 211' ' ' ' DT' . . . . . 0.41 ' C4 ' ' C6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.425 -1.868 0 C1'-O4'-C4' 106.085 -2.582 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.934 0 C1'-O4'-C4' 107.147 -1.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 213' ' ' ' DT' . . . . . 0.424 ' O4 ' ' O4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.588 0 C4'-C3'-C2' 104.779 1.579 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 214' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.863 0 O4'-C4'-C3' 107.299 1.699 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.052 0 C1'-O4'-C4' 107.111 -1.849 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.926 0 O4'-C4'-C3' 107.272 1.672 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.8 m . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 109.484 -0.562 . . . . 2.85 109.484 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.538 ' CE1' ' N ' ' A' ' 14' ' ' SER . 0.9 OUTLIER -99.29 125.09 44.85 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.011 -1.056 . . . . 2.01 108.517 179.627 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -107.53 135.61 48.7 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 122.539 1.161 . . . . 2.25 112.33 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.736 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 4.1 t -60.5 121.35 11.91 Favored 'General case' 0 N--CA 1.499 2.021 0 CA-C-N 114.625 -1.171 . . . . 1.74 109.432 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.7 mttp -94.8 28.5 2.67 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.204 -0.935 . . . . 2.44 108.828 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.3 mm -128.86 -63.38 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 N-CA-C 107.538 -1.282 . . . . 2.36 107.538 -178.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.636 ' N ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -126.4 45.98 2.55 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 124.015 1.864 . . . . 2.54 110.0 179.29 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 20.45 60.73 0.01 OUTLIER Glycine 0 CA--C 1.568 3.403 0 N-CA-C 121.525 3.37 . . . . 2.38 121.525 172.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.736 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 9.9 ttmm -115.07 139.89 49.5 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 105.663 -1.977 . . . . 2.27 105.663 171.166 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.3 t -93.52 145.05 24.8 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-O 122.438 1.113 . . . . 2.56 112.715 -177.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.519 ' HZ ' ' ND1' ' A' ' 20' ' ' HIS . 77.3 m-85 -127.16 130.27 49.46 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.912 0.863 . . . . 2.14 110.204 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -68.92 -27.93 66.21 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.948 -0.76 . . . . 3.29 108.948 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.459 ' HD3' HH11 ' A' ' 13' ' ' ARG . 0.4 OUTLIER -121.65 140.51 52.18 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 121.699 0.762 . . . . 3.55 109.624 -178.928 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.538 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 0.6 OUTLIER -60.2 -32.73 71.37 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 118.042 -1.463 . . . . 2.01 108.088 179.202 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 97.5 p -55.7 -60.95 2.72 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.192 -0.942 . . . . 2.71 109.069 -178.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.604 HG21 H2'' ' B' ' 109' ' ' ' DA' . 23.0 m -53.36 -32.12 47.82 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.517 -0.92 . . . . 2.37 108.517 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 tp -72.08 -39.72 68.76 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 118.077 -1.449 . . . . 1.37 107.657 177.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.736 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 58.6 m -53.01 -50.86 63.36 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.965 -1.084 . . . . 1.5 108.479 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.3 m -59.57 -36.63 76.58 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.975 0.893 . . . . 2.12 108.876 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.519 ' ND1' ' HZ ' ' A' ' 11' ' ' PHE . 23.4 t60 -69.01 -38.38 79.2 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 107.552 -1.277 . . . . 1.1 107.552 179.006 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.423 ' O ' ' N ' ' A' ' 24' ' ' HIS . 87.3 mt -67.41 -38.4 84.54 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 119.853 -1.78 . . . . 1.28 106.397 177.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.736 ' HG ' ' O ' ' A' ' 18' ' ' SER . 28.9 mt -56.17 -35.35 67.12 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 105.953 -1.869 . . . . 2.14 105.953 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.496 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 82.3 mt -61.07 -31.41 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 N-CA-C 107.256 -1.387 . . . . 1.18 107.256 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.423 ' N ' ' O ' ' A' ' 21' ' ' LEU . 87.8 m-70 -88.4 -19.51 26.49 Favored 'General case' 0 N--CA 1.514 2.774 0 C-N-CA 118.472 -1.291 . . . . 2.07 111.231 179.09 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.417 ' O ' ' C ' ' A' ' 26' ' ' ASP . 61.1 m -101.16 3.76 41.41 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 107.441 -1.318 . . . . 2.46 107.441 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.576 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER 41.03 53.97 3.31 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.875 -0.787 . . . . 1.96 108.875 -179.218 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.616 HG22 ' HD3' ' A' ' 29' ' ' PRO . 1.3 m -97.3 110.74 23.23 Favored 'General case' 0 N--CA 1.485 1.285 0 O-C-N 121.528 -0.732 . . . . 2.4 109.393 -179.123 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.431 ' HD3' ' O ' ' A' ' 27' ' ' THR . 19.2 mmt180 -129.51 63.33 67.47 Favored Pre-proline 0 N--CA 1.49 1.538 0 N-CA-C 107.996 -1.113 . . . . 2.94 107.996 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.616 ' HD3' HG22 ' A' ' 27' ' ' THR . 50.8 Cg_endo -72.56 17.63 0.36 Allowed 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 121.803 1.669 . . . . 1.45 113.973 -177.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -113.72 80.85 5.28 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 120.876 -1.14 . . . . 1.35 108.991 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.34 131.54 8.66 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 C-N-CA 122.109 1.873 . . . . 2.12 113.888 -178.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.429 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -58.94 149.29 27.58 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 121.696 0.76 . . . . 2.29 109.868 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -82.34 -15.44 52.85 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.77 -0.581 . . . . 3.89 112.45 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.545 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 3.9 m-85 -113.95 -50.67 2.81 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.224 -1.548 . . . . 2.88 113.37 -178.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 16.1 p -103.72 7.09 37.25 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.487 -1.383 . . . . 3.03 111.16 -177.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.542 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 73.85 -1.6 45.7 Favored Glycine 0 N--CA 1.492 2.427 0 O-C-N 121.29 -0.881 . . . . 2.64 114.312 176.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.542 ' O ' ' O ' ' A' ' 36' ' ' GLY . 11.8 mttp -41.89 166.0 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.212 0 CA-C-N 120.679 2.24 . . . . 3.06 108.85 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.423 ' N ' ' HE ' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -128.81 133.13 47.93 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.401 -0.963 . . . . 3.4 108.401 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -126.71 174.34 8.81 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.34 -0.85 . . . . 1.49 109.255 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.573 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -115.36 -7.26 12.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 122.0 -0.437 . . . . 2.07 110.505 -179.383 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.416 ' O ' ' C ' ' A' ' 42' ' ' LYS . 85.0 mt-30 -132.13 124.0 28.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.694 -1.254 . . . . 2.11 109.358 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.416 ' C ' ' O ' ' A' ' 41' ' ' GLN . 84.6 tttt -42.05 -65.15 0.49 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.129 -0.982 . . . . 1.95 110.257 -178.045 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.8 p -49.2 -32.98 11.39 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.733 -0.604 . . . . 1.09 111.101 -178.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.2 -48.63 70.01 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.752 -1.217 . . . . 1.9 107.744 177.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.541 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 10.8 tmm? -62.84 -46.84 86.05 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.472 -1.392 . . . . 0.95 108.617 177.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.499 ' O ' ' OG1' ' A' ' 49' ' ' THR . 35.1 mmtt -53.34 -41.21 65.53 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 120.87 -1.144 . . . . 2.03 108.711 -178.287 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -63.51 -32.82 74.38 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.168 -1.419 . . . . 1.65 107.168 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.703 ' O ' HG12 ' A' ' 51' ' ' ILE . 47.0 t60 -68.66 -61.25 1.9 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.896 -1.52 . . . . 1.78 106.896 176.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.501 ' O ' HG23 ' A' ' 53' ' ' THR . 24.1 p -41.9 -34.77 0.72 Allowed 'General case' 0 N--CA 1.486 1.35 0 O-C-N 120.323 -1.485 . . . . 1.07 109.281 178.5 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.605 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 5.2 m-30 -69.26 -32.27 71.35 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.806 -1.184 . . . . 0.86 108.918 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.703 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.0 pt -61.85 -34.16 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 C-N-CA 118.318 -1.353 . . . . 1.93 107.72 175.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -75.07 -27.72 60.06 Favored 'General case' 0 N--CA 1.51 2.548 0 C-N-CA 117.775 -1.57 . . . . 2.21 109.309 176.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.605 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 68.1 p -91.53 -2.06 57.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.16 -0.962 . . . . 1.31 110.279 -177.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.36 17.89 2.07 Favored Glycine 0 N--CA 1.502 3.038 0 N-CA-C 109.944 -1.262 . . . . 1.07 109.944 -177.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.611 ' O ' ' C ' ' A' ' 56' ' ' LYS . 77.4 mt-10 -75.74 20.27 0.18 Allowed 'General case' 0 N--CA 1.506 2.339 0 N-CA-C 115.836 1.791 . . . . 1.27 115.836 -176.092 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.611 ' C ' ' O ' ' A' ' 55' ' ' GLU . 3.0 mptp? -24.57 96.81 0.06 OUTLIER Pre-proline 0 N--CA 1.508 2.457 0 O-C-N 121.058 -1.026 . . . . 1.14 110.867 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.448 ' N ' ' O ' ' A' ' 55' ' ' GLU . 2.4 Cg_endo -78.86 -19.84 10.75 Favored 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 122.971 2.447 . . . . 0.73 112.431 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -81.65 102.65 10.82 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.908 -1.145 . . . . 0.74 107.908 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.672 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 86.5 mttt -104.55 118.02 35.55 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.915 -1.115 . . . . 0.94 111.595 -177.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 26.8 t -83.71 125.37 31.81 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.229 -0.919 . . . . 1.11 108.739 178.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.672 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 1.1 mm-40 -96.92 13.82 27.52 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.212 -0.93 . . . . 1.9 111.26 -177.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.728 HG11 ' CG ' ' A' ' 80' ' ' HIS . 97.1 t -87.13 -34.88 7.85 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.086 0 N-CA-C 106.338 -1.727 . . . . 1.65 106.338 178.22 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 26.6 p -123.58 -30.13 3.66 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 114.846 -1.07 . . . . 1.53 108.261 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.02 13.51 31.33 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 111.16 -0.776 . . . . 1.23 111.16 178.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -97.33 132.77 42.75 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.283 -1.716 . . . . 2.2 111.206 -177.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.19 148.24 23.07 Favored 'General case' 0 N--CA 1.508 2.456 0 CA-C-O 122.227 1.013 . . . . 0.76 113.685 -177.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.456 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 88.5 m-85 -128.92 151.13 49.98 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.992 0.901 . . . . 0.75 111.534 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.447 ' OG ' ' HG3' ' A' ' 69' ' ' GLN . 16.9 p -86.63 -10.35 54.04 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 115.798 -0.637 . . . . 1.19 109.768 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.556 ' NE2' ' N7 ' ' B' ' 105' ' ' ' DA' . 56.5 mt-30 -132.31 142.97 49.56 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.249 -0.907 . . . . 1.75 111.146 -177.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.7 p -66.51 -44.48 82.42 Favored 'General case' 0 C--O 1.198 -1.638 0 N-CA-C 107.174 -1.417 . . . . 1.12 107.174 177.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.444 ' OG ' ' N7 ' ' C' ' 210' ' ' ' DA' . 23.2 t -52.41 -42.59 64.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.231 -0.918 . . . . 1.41 109.915 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.442 ' O ' ' HB3' ' A' ' 76' ' ' HIS . 2.9 m-20 -70.16 -30.29 67.4 Favored 'General case' 0 C--N 1.298 -1.674 0 C-N-CA 118.084 -1.446 . . . . 1.35 107.913 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.9 tp -73.49 -42.1 62.27 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.941 -1.133 . . . . 0.74 107.941 177.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.47 HD11 ' P ' ' C' ' 209' ' ' ' DG' . 90.7 mt -59.67 -53.63 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 O-C-N 120.826 -1.171 . . . . 1.11 109.111 179.314 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 2.5 m -63.97 -48.98 74.33 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 122.374 1.083 . . . . 0.82 108.746 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.456 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 15.8 t60 -51.65 -45.47 63.38 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 123.079 1.418 . . . . 0.94 107.852 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 44.8 t -67.23 -35.61 79.93 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 120.581 -1.324 . . . . 1.21 108.288 178.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 82' ' ' GLY . 2.2 mmm180 -55.81 -35.14 66.0 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 106.986 -1.487 . . . . 2.36 106.986 178.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -63.98 -44.37 92.9 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.193 -1.403 . . . . 1.19 108.061 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.728 ' CG ' HG11 ' A' ' 62' ' ' VAL . 68.5 m-70 -57.44 -62.61 1.65 Allowed 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 116.139 -2.225 . . . . 1.5 108.304 178.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.446 ' O ' ' C ' ' A' ' 82' ' ' GLY . 29.4 p -80.19 21.48 0.59 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.516 -0.74 . . . . 1.56 109.509 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.494 2.548 0 N-CA-C 109.796 -1.321 . . . . 2.6 109.796 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.952 0 C4'-C3'-C2' 104.847 1.647 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 102' ' ' ' DA' . . . . . 0.523 ' N6 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.743 0 O4'-C4'-C3' 107.19 1.59 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 103' ' ' ' DT' . . . . . 0.532 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.777 0 C1'-O4'-C4' 106.553 -2.248 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 104' ' ' ' DA' . . . . . 0.532 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.922 0 O4'-C4'-C3' 107.109 1.509 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 105' ' ' ' DA' . . . . . 0.556 ' N7 ' ' NE2' ' A' ' 69' ' ' GLN . . . . . . . . 0 C5'--C4' 1.528 2.087 0 O4'-C4'-C3' 107.096 1.496 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.56 ' C6 ' ' C4 ' ' B' ' 107' ' ' ' DT' . . . . . . . . 0 P--O5' 1.61 1.749 0 C1'-O4'-C4' 106.975 -1.946 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 107' ' ' ' DT' . . . . . 0.56 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.878 0 C1'-O4'-C4' 106.034 -2.619 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 108' ' ' ' DC' . . . . . 0.496 " H3'" HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C5'--C4' 1.526 1.874 0 C1'-O4'-C4' 107.005 -1.925 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 109' ' ' ' DA' . . . . . 0.604 H2'' HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 P--O5' 1.608 1.459 0 N19-C1'-C2' 116.841 1.651 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 110' ' ' ' DC' . . . . . 0.515 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.059 0 C1'-O4'-C4' 107.453 -1.605 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 111' ' ' ' DT' . . . . . 0.431 ' H73' ' OG1' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.527 1.975 0 C1'-O4'-C4' 107.282 -1.727 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 112' ' ' ' DG' . . . . . 0.553 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.723 0 O4'-C4'-C3' 107.359 1.759 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.553 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.932 0 O4'-C4'-C3' 107.079 1.479 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.153 0 C1'-O4'-C4' 107.66 -1.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.991 0 C1'-O4'-C4' 107.374 -1.662 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.867 0 O4'-C4'-C3' 107.207 1.607 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.864 0 O4'-C4'-C3' 107.165 1.565 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.93 0 C4'-C3'-C2' 104.809 1.609 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.789 0 O4'-C4'-C3' 107.324 1.724 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.861 0 C1'-O4'-C4' 107.401 -1.642 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.976 0 C1'-O4'-C4' 107.549 -1.537 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.81 0 O4'-C4'-C3' 107.295 1.695 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.783 0 C1'-O4'-C4' 107.613 -1.491 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.772 0 C1'-O4'-C4' 107.426 -1.624 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 209' ' ' ' DG' . . . . . 0.561 ' N2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.74 0 O4'-C4'-C3' 107.242 1.642 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 210' ' ' ' DA' . . . . . 0.549 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.728 0 O4'-C4'-C3' 107.274 1.674 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 211' ' ' ' DT' . . . . . 0.545 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.423 -2.124 0 C1'-O4'-C4' 106.344 -2.397 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.714 0 C1'-O4'-C4' 106.925 -1.982 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 213' ' ' ' DT' . . . . . 0.406 ' O4 ' ' O4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.883 0 O4'-C4'-C3' 107.199 1.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 214' ' ' ' DA' . . . . . 0.523 ' N6 ' ' N6 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.901 0 O4'-C4'-C3' 107.211 1.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 215' ' ' ' DT' . . . . . 0.48 ' C4 ' ' C5 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.983 0 C1'-O4'-C4' 107.035 -1.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.206 0 O4'-C4'-C3' 107.314 1.714 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 98.2 p . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 109.333 -0.617 . . . . 1.36 109.333 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.599 ' CB ' HD22 ' A' ' 17' ' ' LEU . 0.5 OUTLIER -117.91 124.63 48.75 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.259 -0.901 . . . . 1.15 109.569 -179.677 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.505 ' OD2' ' N ' ' A' ' 5' ' ' LYS . 8.5 t70 -108.61 142.99 38.26 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 121.998 0.904 . . . . 2.37 110.269 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.522 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER -66.67 -36.48 82.63 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.142 -0.688 . . . . 2.2 109.142 179.212 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 4' ' ' CYS . 73.6 mttt 75.06 -23.81 0.23 Allowed 'General case' 0 N--CA 1.498 1.956 0 CA-C-O 121.037 0.446 . . . . 2.81 110.159 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.591 ' HB ' ' CD2' ' A' ' 24' ' ' HIS . 12.7 mm -67.84 -66.95 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 O-C-N 120.932 -1.105 . . . . 2.96 109.746 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.9 p -94.31 -24.5 17.39 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.275 -0.89 . . . . 3.14 109.95 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.94 38.51 1.69 Allowed Glycine 0 N--CA 1.496 2.695 0 C-N-CA 120.081 -1.057 . . . . 2.68 112.404 177.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.413 ' O ' ' OD1' ' A' ' 3' ' ' ASP . 19.0 ttmm -115.08 154.37 29.02 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.482 -1.599 . . . . 2.82 108.49 178.076 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.54 ' C ' ' CD1' ' A' ' 11' ' ' PHE . 44.8 m -112.04 163.7 13.98 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 122.112 0.958 . . . . 1.78 111.985 -177.191 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.636 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.2 m-85 -141.46 124.71 16.47 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 122.226 1.012 . . . . 1.25 110.738 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -68.67 -30.56 69.26 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 122.175 0.988 . . . . 2.04 109.158 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.95 132.79 56.37 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-N 115.646 -0.707 . . . . 2.51 109.296 -178.211 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.408 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 7.2 t -59.21 -30.41 68.21 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 118.741 -1.184 . . . . 1.65 109.903 -178.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.3 t -63.37 -47.53 81.71 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 120.278 -1.514 . . . . 2.34 109.365 -179.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.742 HG21 H2'' ' B' ' 109' ' ' ' DA' . 23.9 m -61.81 -30.73 71.01 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.312 -1.366 . . . . 1.36 107.312 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.599 HD22 ' CB ' ' A' ' 2' ' ' PHE . 11.5 tp -74.2 -35.84 63.95 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 107.022 -1.473 . . . . 1.04 107.022 177.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.6 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 32.7 t -56.42 -58.9 6.04 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.718 -1.239 . . . . 1.13 108.223 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.505 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 55.1 m -55.87 -38.77 70.57 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.726 0.774 . . . . 1.47 109.83 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.636 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 45.3 t60 -66.65 -44.37 82.07 Favored 'General case' 0 C--N 1.294 -1.843 0 O-C-N 120.742 -1.224 . . . . 1.68 108.247 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.7 mt -61.46 -29.75 70.16 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 106.363 -1.717 . . . . 1.28 106.363 178.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 18' ' ' SER . 21.9 mt -66.16 -29.9 70.27 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 106.621 -1.622 . . . . 1.04 106.621 177.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.588 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 88.4 mt -65.33 -36.58 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 O-C-N 120.577 -1.327 . . . . 2.13 108.304 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.591 ' CD2' ' HB ' ' A' ' 6' ' ' ILE . 72.1 m-70 -82.06 -28.99 32.11 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 118.149 -1.42 . . . . 2.15 110.563 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.449 ' OG ' ' OG1' ' A' ' 27' ' ' THR . 35.0 p -92.42 -1.82 56.74 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.681 -1.262 . . . . 1.07 108.22 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 48.4 m-20 44.5 65.35 1.08 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 115.95 -0.568 . . . . 1.04 110.134 -179.355 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.449 ' OG1' ' OG ' ' A' ' 25' ' ' SER . 0.6 OUTLIER -104.65 112.2 25.2 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.425 -0.954 . . . . 1.06 108.425 179.262 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.586 HH21 ' CG ' ' A' ' 40' ' ' HIS . 0.4 OUTLIER -124.16 72.7 56.53 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.311 -0.868 . . . . 2.36 108.81 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -74.43 9.77 1.74 Allowed 'Trans proline' 0 C--N 1.312 -1.38 0 C-N-CA 122.037 1.825 . . . . 1.61 113.514 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -114.49 81.73 7.11 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.005 -1.06 . . . . 1.92 108.656 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 50.0 Cg_endo -75.93 137.98 20.33 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.253 1.968 . . . . 1.84 113.037 -178.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.597 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -64.79 137.27 57.68 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 107.893 -1.151 . . . . 1.91 107.893 179.223 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.473 ' H ' ' CD ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -78.1 -15.04 59.23 Favored 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.497 -0.752 . . . . 2.78 110.663 -178.834 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.435 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 40.4 m-85 -110.97 -72.88 0.7 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.613 -1.304 . . . . 2.49 111.747 -178.402 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.554 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.9 p -85.16 2.04 45.38 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.071 -1.018 . . . . 2.69 111.472 -178.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.458 ' C ' ' HB3' ' A' ' 32' ' ' CYS . . . 80.84 -12.49 35.47 Favored Glycine 0 N--CA 1.504 3.19 0 O-C-N 120.94 -1.1 . . . . 2.24 114.289 175.038 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.597 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 1.8 mttm -47.58 119.39 2.71 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 119.561 1.68 . . . . 2.44 109.247 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.459 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 35.6 mtt180 -98.77 135.69 39.87 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.945 -1.097 . . . . 2.52 110.976 -178.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.516 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 28.2 m-85 -115.23 174.47 5.98 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.416 -0.803 . . . . 1.14 110.147 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.599 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -107.05 -19.68 13.54 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 116.306 -0.407 . . . . 1.76 110.751 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.53 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 48.8 mt-30 -114.46 110.48 19.91 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 120.718 -1.239 . . . . 2.83 110.032 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.491 ' C ' ' O ' ' A' ' 41' ' ' GLN . 44.6 tttp -34.33 -57.11 0.5 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.232 -0.917 . . . . 2.74 110.892 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.06 -33.79 63.03 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.408 -0.808 . . . . 2.53 111.073 -178.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.734 ' OD1' ' N ' ' A' ' 45' ' ' MET . 35.2 p30 -71.18 -37.5 72.15 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.181 -1.408 . . . . 2.2 108.072 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.734 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 9.9 ttp -67.71 -47.42 69.43 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 120.319 -1.488 . . . . 1.47 108.061 177.509 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.488 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 36.6 mttm -50.2 -41.23 49.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.636 -1.29 . . . . 2.66 107.565 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.592 ' O ' HG23 ' A' ' 51' ' ' ILE . 36.5 mttm -60.85 -35.06 75.6 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 106.709 -1.589 . . . . 3.38 106.709 178.01 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.712 ' O ' HG12 ' A' ' 51' ' ' ILE . 61.5 t60 -67.37 -67.64 0.44 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.494 -1.298 . . . . 1.42 107.494 177.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.488 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 32.0 p -40.75 -33.02 0.25 Allowed 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.657 -1.277 . . . . 0.84 110.546 178.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.566 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.4 m-85 -70.96 -35.83 72.31 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 120.804 -1.185 . . . . 1.68 109.352 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.712 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.1 pt -63.45 -29.19 46.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 C-N-CA 118.461 -1.295 . . . . 1.82 108.508 176.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -81.0 -29.44 35.21 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 120.315 -1.491 . . . . 1.74 109.92 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.566 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 75.0 p -91.29 2.29 56.49 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.237 -0.914 . . . . 0.83 112.181 -176.485 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 58.73 56.08 27.26 Favored Glycine 0 N--CA 1.486 2.033 0 N-CA-C 107.706 -2.157 . . . . 1.18 107.706 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.465 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 62.0 mt-10 -114.12 128.58 56.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.456 -1.026 . . . . 2.01 109.943 -178.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 68' ' ' SER . 38.1 mttm -143.29 67.27 16.72 Favored Pre-proline 0 C--N 1.304 -1.372 0 N-CA-C 108.754 -0.832 . . . . 1.69 108.754 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.48 -11.71 14.75 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 122.29 1.993 . . . . 1.56 112.532 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.537 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 62.5 m80 -101.19 90.61 4.19 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.996 -1.113 . . . . 1.53 107.996 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 26.3 mtpt -91.99 125.82 36.83 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 121.799 0.809 . . . . 2.42 110.778 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.661 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 1.7 t -43.48 -91.52 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.837 -0.539 . . . . 1.38 110.718 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.661 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 6.6 mm-40 122.31 -20.9 0.01 OUTLIER 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 121.604 0.716 . . . . 2.22 110.574 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.401 ' HB ' ' NE2' ' A' ' 80' ' ' HIS . 21.8 t -87.98 -43.26 15.42 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.136 0 CA-C-O 122.038 0.923 . . . . 1.86 109.274 -179.033 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 18.8 p -122.92 -6.15 8.48 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.675 -0.693 . . . . 2.1 109.966 -178.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.49 29.58 32.52 Favored Glycine 0 N--CA 1.496 2.682 0 O-C-N 120.942 -1.099 . . . . 1.83 111.858 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 60' ' ' CYS . 6.6 tttp -101.29 157.22 16.95 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 105.558 -2.016 . . . . 2.42 105.558 176.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -131.97 152.18 51.27 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.462 -1.399 . . . . 1.38 112.966 -176.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.611 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 60.6 m-85 -134.71 138.93 44.82 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 122.151 0.977 . . . . 1.51 112.369 -178.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 34.0 p -68.89 -26.38 65.08 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.738 -1.208 . . . . 1.74 107.738 177.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -116.51 151.62 35.74 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 122.002 0.906 . . . . 2.56 112.851 -176.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.627 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.9 OUTLIER -78.29 -47.27 18.21 Favored 'General case' 0 C--O 1.19 -2.037 0 N-CA-C 107.57 -1.27 . . . . 2.11 107.57 175.399 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.577 ' C ' ' O ' ' A' ' 70' ' ' SER . 15.7 p -39.75 -41.4 1.09 Allowed 'General case' 0 C--N 1.301 -1.519 0 O-C-N 120.441 -1.412 . . . . 2.32 107.782 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -79.79 -31.99 40.82 Favored 'General case' 0 C--N 1.291 -1.94 0 C-N-CA 119.65 -0.82 . . . . 2.16 108.916 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.627 ' N ' ' O ' ' A' ' 70' ' ' SER . 30.7 tp -72.76 -40.78 65.73 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.601 -1.312 . . . . 1.38 108.553 177.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.455 HD13 " H3'" ' C' ' 209' ' ' ' DG' . 97.2 mt -59.92 -52.19 64.04 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 O-C-N 120.937 -1.102 . . . . 2.1 108.255 178.508 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.2 m -60.33 -47.32 86.56 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.866 -1.146 . . . . 2.41 109.511 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.611 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 19.4 t60 -56.86 -39.95 75.25 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 122.419 1.104 . . . . 1.8 108.191 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 53.4 p -71.51 -34.39 70.06 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.898 -1.127 . . . . 1.74 108.684 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -57.83 -32.67 67.83 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.428 -1.323 . . . . 2.71 107.428 178.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.444 ' CD ' ' OP2' ' B' ' 103' ' ' ' DT' . 20.5 mttm -69.16 -48.26 62.75 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.904 -1.147 . . . . 3.5 107.904 178.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.401 ' NE2' ' HB ' ' A' ' 62' ' ' VAL . 50.9 m-70 -58.39 -55.25 37.42 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 117.283 -1.767 . . . . 2.34 109.247 178.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 60.6 m -56.98 -52.79 63.83 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.114 -1.034 . . . . 2.64 108.895 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.63 -1.388 . . . . 2.98 109.63 179.55 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.851 0 C4'-C3'-C2' 104.78 1.58 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.839 0 C4'-C3'-C2' 104.717 1.517 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 103' ' ' ' DT' . . . . . 0.541 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.625 0 C1'-O4'-C4' 105.634 -2.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 104' ' ' ' DA' . . . . . 0.541 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.878 0 O4'-C4'-C3' 107.115 1.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 105' ' ' ' DA' . . . . . 0.406 ' C6 ' ' C5 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.085 0 O4'-C4'-C3' 107.177 1.577 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.55 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.428 -1.659 0 C1'-O4'-C4' 106.376 -2.374 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 107' ' ' ' DT' . . . . . 0.534 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.888 0 C1'-O4'-C4' 106.114 -2.562 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 108' ' ' ' DC' . . . . . 0.588 " H3'" HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C5'--C4' 1.526 1.886 0 O4'-C4'-C3' 107.121 1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 109' ' ' ' DA' . . . . . 0.742 H2'' HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 P--O5' 1.607 1.405 0 N19-C1'-C2' 117.475 2.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 110' ' ' ' DC' . . . . . 0.551 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.018 0 P-O3'-C3' 121.73 1.692 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.833 0 C1'-O4'-C4' 107.405 -1.64 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 112' ' ' ' DG' . . . . . 0.561 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.916 0 O4'-C4'-C3' 107.436 1.836 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.561 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.786 0 O4'-C4'-C3' 107.145 1.545 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 114' ' ' ' DC' . . . . . 0.472 ' O2 ' ' N2 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.032 0 C1'-O4'-C4' 107.473 -1.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.841 0 O4'-C4'-C3' 107.239 1.639 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.03 0 O4'-C4'-C3' 107.371 1.771 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 201' ' ' ' DT' . . . . . 0.438 ' O2 ' ' N7 ' ' C' ' 202' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.935 0 O4'-C4'-C3' 107.181 1.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 202' ' ' ' DA' . . . . . 0.438 ' N7 ' ' O2 ' ' C' ' 201' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.92 0 O4'-C1'-C2' 107.645 1.405 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 203' ' ' ' DG' . . . . . 0.54 ' C2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.944 0 C4'-C3'-C2' 104.801 1.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 204' ' ' ' DG' . . . . . 0.54 ' C4 ' ' C2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.8 0 C1'-O4'-C4' 107.184 -1.797 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 205' ' ' ' DC' . . . . . 0.541 ' N4 ' ' N6 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.885 0 C4'-C3'-C2' 104.768 1.568 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 206' ' ' ' DA' . . . . . 0.541 ' N6 ' ' N4 ' ' C' ' 205' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.809 0 O4'-C4'-C3' 107.348 1.748 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.742 0 C1'-O4'-C4' 107.174 -1.804 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.737 0 O4'-C4'-C3' 107.157 1.557 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 209' ' ' ' DG' . . . . . 0.539 ' C2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.74 0 O4'-C4'-C3' 107.178 1.578 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 210' ' ' ' DA' . . . . . 0.55 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.523 1.535 0 O4'-C4'-C3' 107.425 1.825 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 211' ' ' ' DT' . . . . . 0.537 ' C4 ' ' C5 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.423 -2.059 0 C1'-O4'-C4' 106.555 -2.247 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.806 0 C1'-O4'-C4' 106.818 -2.059 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.753 0 C4'-C3'-C2' 104.869 1.669 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 214' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.866 0 O4'-C4'-C3' 107.293 1.693 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.937 0 C1'-O4'-C4' 107.16 -1.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.987 0 O4'-C4'-C3' 107.212 1.612 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.622 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.2 m-85 . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.105 -0.702 . . . . 1.84 109.105 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.599 ' OD1' ' N ' ' A' ' 4' ' ' CYS . 45.5 t0 -107.25 133.38 51.9 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-O 123.013 1.387 . . . . 1.54 110.166 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.599 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 1.7 t -66.56 131.0 45.05 Favored 'General case' 0 C--N 1.288 -2.083 0 CA-C-N 113.682 -1.599 . . . . 1.01 110.327 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.33 32.11 1.82 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.409 -0.807 . . . . 2.54 110.162 -178.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.0 mm -126.81 -71.17 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 120.871 -1.143 . . . . 1.84 109.554 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.533 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 30.6 p -84.34 -50.67 7.61 Favored 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 119.325 -0.95 . . . . 2.08 108.479 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.533 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 123.34 52.24 0.2 Allowed Glycine 0 N--CA 1.496 2.661 0 C-N-CA 120.83 -0.7 . . . . 1.69 112.437 177.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -127.98 164.12 23.04 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.82 -1.4 . . . . 1.94 109.623 178.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.4 t -112.81 159.09 19.35 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.686 1.232 . . . . 2.02 113.198 -176.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 51.9 m-85 -139.16 125.36 20.13 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 114.968 -1.014 . . . . 1.73 109.784 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -68.29 -22.37 64.73 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 108.869 -0.789 . . . . 2.69 108.869 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.683 HH21 ' N ' ' A' ' 15' ' ' SER . 0.0 OUTLIER -119.5 133.45 55.68 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.034 -0.728 . . . . 3.61 109.034 -178.62 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.622 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 40.5 t -57.42 -33.36 67.81 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.004 -1.06 . . . . 1.87 108.259 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.683 ' N ' HH21 ' A' ' 13' ' ' ARG . 30.5 t -66.44 -39.41 88.88 Favored 'General case' 0 C--N 1.308 -1.213 0 O-C-N 121.626 -0.671 . . . . 2.18 110.301 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -34.35 77.89 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 106.473 -1.677 . . . . 2.02 106.473 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.0 tp -70.6 -43.44 69.34 Favored 'General case' 0 C--O 1.202 -1.411 0 N-CA-C 106.256 -1.757 . . . . 1.19 106.256 176.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.635 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 16.4 t -49.93 -62.62 1.46 Allowed 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.529 -1.357 . . . . 2.24 109.451 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 88.0 m -54.19 -36.57 63.57 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 122.414 1.102 . . . . 1.49 108.757 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 49.9 t60 -65.47 -46.38 80.03 Favored 'General case' 0 C--N 1.284 -2.243 0 O-C-N 121.097 -1.002 . . . . 1.09 109.311 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 78.5 mt -60.91 -27.69 68.37 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 106.861 -1.533 . . . . 0.52 106.861 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 18' ' ' SER . 27.4 mt -70.03 -27.35 64.59 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 107.253 -1.388 . . . . 1.01 107.253 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 95.3 mt -65.41 -39.96 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 O-C-N 120.507 -1.37 . . . . 1.22 108.111 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -73.22 -47.31 44.44 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 117.813 -1.555 . . . . 1.29 108.763 177.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.506 ' OG ' ' OG1' ' A' ' 27' ' ' THR . 25.7 p -73.89 -3.31 28.07 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 120.564 -1.335 . . . . 1.71 110.033 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 44.4 63.51 1.63 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.575 -0.703 . . . . 1.82 109.786 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.506 ' OG1' ' OG ' ' A' ' 25' ' ' SER . 1.3 m -101.27 111.86 24.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.968 -1.082 . . . . 1.02 108.651 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.423 ' HE ' ' HB3' ' A' ' 40' ' ' HIS . 4.6 mmt85 -126.0 71.98 69.59 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.432 -0.792 . . . . 1.31 109.989 -178.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -73.94 12.15 1.02 Allowed 'Trans proline' 0 C--N 1.308 -1.583 0 C-N-CA 121.954 1.769 . . . . 1.26 113.789 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.411 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 61.6 m-85 -117.23 87.11 22.71 Favored Pre-proline 0 N--CA 1.501 2.108 0 N-CA-C 108.046 -1.094 . . . . 1.57 108.046 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -84.96 131.12 4.29 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.642 2.228 . . . . 1.15 113.047 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.582 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 1.1 t -51.51 140.59 17.67 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 121.927 0.87 . . . . 0.97 108.799 177.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.476 HE21 HG21 ' A' ' 49' ' ' THR . 0.1 OUTLIER -80.16 -17.32 52.79 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.861 -0.792 . . . . 3.19 108.861 179.632 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.569 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 30.5 m-85 -110.58 -76.75 0.6 Allowed 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 119.101 -1.04 . . . . 1.15 112.424 -178.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.544 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 14.8 p -81.77 20.98 0.88 Allowed 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 122.406 1.098 . . . . 1.07 110.714 -177.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.432 ' O ' ' C ' ' A' ' 37' ' ' LYS . . . 48.48 9.53 0.09 OUTLIER Glycine 0 N--CA 1.508 3.458 0 N-CA-C 115.513 0.965 . . . . 0.9 115.513 176.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.582 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 13.1 mttp -54.35 174.95 0.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 122.503 3.152 . . . . 0.82 107.802 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 83.8 mtm-85 -134.13 131.64 38.94 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.977 -1.077 . . . . 1.77 109.853 -178.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.404 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 55.5 m-85 -123.44 165.08 17.67 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.74 -0.837 . . . . 0.85 108.74 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.611 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -108.96 12.76 25.13 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.772 -0.58 . . . . 1.17 109.98 179.78 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -144.77 113.35 6.67 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.868 -1.145 . . . . 1.74 109.74 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.411 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 57.8 tttm -37.88 -72.2 0.06 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.324 -0.86 . . . . 2.81 112.984 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 85.5 p -47.37 -34.98 7.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.367 -0.833 . . . . 1.45 111.205 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -67.92 -40.3 83.41 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 117.524 -1.67 . . . . 1.17 107.395 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.691 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 11.1 tmm? -66.55 -47.15 73.75 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 120.711 -1.243 . . . . 1.35 107.974 176.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.497 ' O ' ' OG1' ' A' ' 49' ' ' THR . 6.0 tptp -54.07 -37.61 64.4 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.012 -1.055 . . . . 1.6 108.531 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.506 ' NZ ' ' CB ' ' A' ' 47' ' ' LYS . 8.2 mtmp? -67.25 -29.19 68.74 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 106.14 -1.8 . . . . 2.17 106.14 177.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.691 ' HB3' ' O ' ' A' ' 45' ' ' MET . 61.4 t60 -68.22 -66.31 0.58 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 106.776 -1.564 . . . . 0.47 106.776 175.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 41.1 p -38.92 -33.04 0.1 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.732 -1.23 . . . . 0.78 111.667 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.602 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.9 m-30 -75.16 -37.85 61.13 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.224 -0.658 . . . . 0.89 109.224 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 48' ' ' HIS . 14.9 pt -59.07 -24.1 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 105.017 -2.216 . . . . 0.61 105.017 176.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.914 ' O ' ' N ' ' A' ' 54' ' ' GLY . 83.4 m-70 -80.11 -103.12 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 101.514 -3.513 . . . . 0.77 101.514 170.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.602 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 72.7 p -8.68 -37.03 0.0 OUTLIER 'General case' 0 N--CA 1.518 2.927 0 C-N-CA 124.134 0.974 . . . . 0.77 112.6 -175.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.914 ' N ' ' O ' ' A' ' 52' ' ' HIS . . . 98.99 21.18 16.31 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 110.591 -1.004 . . . . 0.51 110.591 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.483 ' HB2' ' CG ' ' A' ' 50' ' ' PHE . 30.1 mt-10 -82.51 125.64 31.34 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.481 -1.011 . . . . 1.6 112.673 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -134.71 73.92 66.09 Favored Pre-proline 0 N--CA 1.504 2.248 0 N-CA-C 108.493 -0.929 . . . . 2.61 108.493 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -61.11 -11.13 17.37 Favored 'Trans proline' 0 N--CA 1.496 1.619 0 C-N-CA 124.131 3.221 . . . . 0.64 113.964 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -99.65 93.21 5.72 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 118.852 -1.139 . . . . 0.85 109.603 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.51 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 48.9 mtmt -93.94 123.27 37.19 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.662 -0.815 . . . . 2.29 111.752 -178.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.502 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -80.4 121.07 25.26 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 106.052 -1.833 . . . . 0.67 106.052 176.478 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 7.1 mm-40 -85.58 14.83 5.15 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 120.761 -1.212 . . . . 1.71 108.194 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.691 HG11 ' CG ' ' A' ' 80' ' ' HIS . 21.2 t -93.77 -56.94 4.72 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.723 0 C-N-CA 120.083 -0.647 . . . . 1.03 110.136 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.0 p -121.24 25.65 9.39 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.273 -0.892 . . . . 1.14 111.024 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 58.49 30.94 65.78 Favored Glycine 0 N--CA 1.494 2.524 0 O-C-N 120.856 -1.152 . . . . 0.97 112.706 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -107.3 152.7 23.77 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-N 118.998 1.399 . . . . 1.46 108.511 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -126.5 150.51 48.7 Favored 'General case' 0 N--CA 1.502 2.156 0 CA-C-O 121.807 0.813 . . . . 0.69 111.738 -177.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.539 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 82.7 m-85 -134.34 153.41 51.9 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 122.425 1.107 . . . . 0.97 113.404 -177.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.0 m -78.29 -41.1 34.88 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 115.47 -0.786 . . . . 1.51 108.907 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -103.78 144.75 31.07 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.926 0.869 . . . . 2.75 110.56 -177.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.537 ' O ' ' N ' ' A' ' 73' ' ' LEU . 27.9 p -70.61 -45.66 64.85 Favored 'General case' 0 C--O 1.195 -1.804 0 N-CA-C 106.951 -1.5 . . . . 1.14 106.951 178.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.415 ' C ' ' O ' ' A' ' 70' ' ' SER . 0.4 OUTLIER -47.01 -43.15 19.25 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.237 -1.023 . . . . 1.47 108.237 179.164 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -69.66 -32.87 71.77 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 107.383 -1.34 . . . . 1.41 107.383 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 70' ' ' SER . 16.2 tp -68.91 -57.54 5.37 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 106.436 -1.69 . . . . 0.68 106.436 176.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.431 ' N ' ' O ' ' A' ' 70' ' ' SER . 79.2 mt -42.9 -57.38 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 O-C-N 121.0 -1.062 . . . . 1.05 110.185 178.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.7 m -59.21 -41.82 89.48 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.015 -1.053 . . . . 1.24 108.659 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.539 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 22.7 t60 -59.93 -43.74 94.76 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 122.216 1.007 . . . . 0.84 108.37 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.9 t -68.29 -36.4 79.32 Favored 'General case' 0 C--N 1.309 -1.164 0 O-C-N 120.875 -1.141 . . . . 0.59 108.123 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 85.5 mtt-85 -54.75 -38.57 67.33 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 107.597 -1.26 . . . . 1.98 107.597 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 34.7 mttp -64.99 -43.88 91.12 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 118.714 -1.195 . . . . 2.09 107.98 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.691 ' CG ' HG11 ' A' ' 62' ' ' VAL . 49.9 m-70 -62.15 -44.37 96.77 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 117.186 -1.806 . . . . 0.91 108.713 177.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.1 m -51.64 -57.08 10.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.625 -0.672 . . . . 0.95 109.564 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 109.513 -1.435 . . . . 1.87 109.513 179.876 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.62 ' CE1' ' N ' ' A' ' 14' ' ' SER . 4.2 m-85 . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 108.723 -0.843 . . . . 1.18 108.723 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.618 ' OD1' ' N ' ' A' ' 4' ' ' CYS . 61.3 t0 -108.19 136.55 47.66 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.816 1.294 . . . . 1.38 110.85 -179.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.618 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 1.7 t -68.54 126.57 30.08 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 114.589 -1.187 . . . . 0.5 109.386 178.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.524 ' HD2' ' H ' ' A' ' 5' ' ' LYS . 2.3 mptt -92.59 26.69 2.56 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.359 -0.838 . . . . 1.53 109.308 -178.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.438 HD12 ' CD2' ' A' ' 24' ' ' HIS . 74.7 mt -125.27 -72.04 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.37 -0.831 . . . . 1.05 111.247 -179.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 29.7 p -86.54 -45.73 10.81 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.694 -1.254 . . . . 0.83 110.899 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.401 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 126.17 45.5 0.23 Allowed Glycine 0 N--CA 1.5 2.905 0 O-C-N 121.1 -1.0 . . . . 0.54 112.267 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -127.28 156.0 42.62 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.972 -1.311 . . . . 1.25 108.918 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.433 ' C ' ' CD1' ' A' ' 11' ' ' PHE . 54.4 m -113.32 165.15 12.71 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.64 -1.288 . . . . 0.86 112.579 -176.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.553 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 46.4 m-85 -142.12 124.81 15.91 Favored 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 121.665 0.745 . . . . 0.93 110.72 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -62.44 -24.57 67.5 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.775 -0.824 . . . . 1.99 108.775 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.9 mmm180 -119.64 138.39 53.28 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.182 -0.673 . . . . 2.89 109.182 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.62 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 1.0 OUTLIER -64.44 -37.79 88.77 Favored 'General case' 0 C--N 1.301 -1.504 0 C-N-CA 118.991 -1.084 . . . . 1.09 108.834 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.4 p -55.81 -48.89 74.62 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 107.799 -1.186 . . . . 1.18 107.799 178.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -36.53 70.27 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 107.671 -1.233 . . . . 1.07 107.671 178.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 tp -70.95 -34.85 71.87 Favored 'General case' 0 C--O 1.201 -1.472 0 N-CA-C 107.312 -1.366 . . . . 0.63 107.312 177.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.588 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 18.5 p -58.98 -60.6 3.61 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.038 -1.038 . . . . 1.16 108.888 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.481 ' N ' ' OG ' ' A' ' 18' ' ' SER . 68.3 m -52.8 -34.39 53.31 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 122.063 0.935 . . . . 0.74 108.518 179.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.553 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 63.1 t60 -68.39 -45.81 71.71 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-O 122.809 1.29 . . . . 0.65 108.323 178.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 21' ' ' LEU . 38.1 mt -58.05 -35.82 71.89 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 106.753 -1.573 . . . . 0.65 106.753 178.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 18' ' ' SER . 13.3 mt -62.86 -35.63 80.61 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.466 -0.939 . . . . 0.84 108.466 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 67.9 mt -57.58 -34.93 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 O-C-N 120.322 -1.486 . . . . 1.05 108.548 177.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.438 ' CD2' HD12 ' A' ' 6' ' ' ILE . 88.9 m-70 -81.15 -36.08 30.69 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.431 -1.308 . . . . 1.15 111.497 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.637 ' O ' ' CG ' ' A' ' 26' ' ' ASP . 1.3 m -83.56 -59.86 2.31 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.421 -1.424 . . . . 1.22 108.649 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.637 ' CG ' ' O ' ' A' ' 25' ' ' SER . 3.3 p-10 97.66 54.63 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.966 0 CA-C-O 122.039 0.923 . . . . 2.33 110.19 178.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.583 HG21 HD13 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -63.84 -46.83 83.28 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.3 -0.875 . . . . 1.04 108.944 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.499 ' NH1' ' ND1' ' A' ' 40' ' ' HIS . 0.4 OUTLIER 36.33 65.83 2.05 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.558 -0.714 . . . . 0.94 110.374 179.586 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -88.94 12.29 2.78 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.595 2.197 . . . . 0.7 113.752 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.414 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 69.8 m-85 -117.45 86.15 21.88 Favored Pre-proline 0 N--CA 1.498 1.973 0 O-C-N 121.009 -1.057 . . . . 0.63 109.354 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -84.99 130.96 4.22 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 123.043 2.495 . . . . 0.85 114.063 -178.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.53 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -53.04 139.43 28.16 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 122.1 0.952 . . . . 0.83 110.376 179.025 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.601 ' H ' ' NE2' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -81.64 -20.96 38.56 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.485 -0.779 . . . . 1.13 110.201 179.711 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.53 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 22.4 m-85 -103.95 -73.38 0.67 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.632 -1.292 . . . . 0.99 111.993 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.465 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 20.4 p -78.83 -19.48 51.94 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.849 -1.157 . . . . 1.04 112.139 -177.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.27 -7.67 58.51 Favored Glycine 0 N--CA 1.509 3.562 0 O-C-N 120.405 -1.434 . . . . 0.91 115.18 175.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -51.15 168.42 0.06 Allowed 'General case' 0 N--CA 1.502 2.155 0 CA-C-N 121.126 2.463 . . . . 2.38 109.522 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.463 ' N ' ' NE ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -125.8 133.21 52.09 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.719 -1.238 . . . . 1.47 109.08 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -118.95 166.53 12.73 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.482 -0.761 . . . . 0.51 109.885 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.521 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -102.81 2.71 35.87 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.796 -0.565 . . . . 0.79 111.036 -179.601 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' A' ' 42' ' ' LYS . 38.8 mt-30 -146.62 118.08 7.96 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.467 -1.395 . . . . 1.15 111.055 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 41' ' ' GLN . 37.4 tttm -37.08 -69.46 0.11 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.458 -0.776 . . . . 2.07 111.895 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.1 m -48.07 -27.79 2.5 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.843 -1.16 . . . . 1.35 110.682 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -74.75 -40.18 61.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.994 -1.066 . . . . 0.83 108.172 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.672 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 4.8 tmm? -68.6 -47.44 66.69 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.379 -1.451 . . . . 0.64 107.472 176.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -52.56 -37.55 58.09 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.416 -1.327 . . . . 1.68 107.416 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.52 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.5 mtpt -63.13 -32.84 74.32 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 105.351 -2.092 . . . . 1.12 105.351 176.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.672 ' HB3' ' O ' ' A' ' 45' ' ' MET . 65.0 t60 -69.54 -63.83 1.0 Allowed 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 107.813 -1.18 . . . . 0.61 107.813 177.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.469 ' C ' ' O ' ' A' ' 48' ' ' HIS . 70.5 p -39.9 -38.31 0.67 Allowed 'General case' 0 N--CA 1.482 1.154 0 O-C-N 120.4 -1.438 . . . . 0.51 110.249 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.613 ' CE1' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-85 -70.26 -35.17 73.6 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.166 -0.959 . . . . 0.51 109.503 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.561 HG12 ' O ' ' A' ' 48' ' ' HIS . 4.4 pt -57.45 -21.25 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 C-N-CA 118.158 -1.417 . . . . 0.7 107.392 176.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . 0.286 77.9 m-70 -94.22 -35.86 12.28 Favored 'General case' 0 N--CA 1.53 3.556 0 O-C-N 120.917 -1.115 . . . . 0.77 112.998 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.465 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 68.6 p -74.67 -17.67 60.64 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.748 0.785 . . . . 0.65 109.094 -176.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.63 7.6 68.8 Favored Glycine 0 C--N 1.292 -1.876 0 N-CA-C 107.941 -2.064 . . . . 0.59 107.941 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.613 ' OE1' ' CE1' ' A' ' 50' ' ' PHE . 91.8 mt-10 -73.48 115.41 12.83 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 122.313 1.054 . . . . 1.53 112.409 -177.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.0 mttm -125.2 68.77 58.46 Favored Pre-proline 0 N--CA 1.495 1.818 0 N-CA-C 108.597 -0.89 . . . . 1.67 108.597 177.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.461 ' HD3' ' C ' ' A' ' 55' ' ' GLU . 31.6 Cg_exo -56.69 -10.55 5.45 Favored 'Trans proline' 0 N--CA 1.503 2.074 0 C-N-CA 123.425 2.75 . . . . 0.75 114.487 -179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.588 ' CE1' ' OG ' ' A' ' 70' ' ' SER . 98.7 m-70 -99.42 85.84 3.25 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.474 -1.391 . . . . 1.02 109.288 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -84.41 124.76 31.67 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.368 -0.833 . . . . 2.52 110.072 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.673 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 0.5 OUTLIER -54.41 -89.02 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.785 0 O-C-N 121.864 -0.523 . . . . 0.89 110.02 179.24 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.673 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 3.9 mm-40 120.06 -10.17 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.372 0 CA-C-O 121.79 0.805 . . . . 1.85 110.238 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.493 HG11 ' CG ' ' A' ' 80' ' ' HIS . 14.5 t -94.69 -53.21 8.6 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-O 122.006 0.908 . . . . 1.35 108.631 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 26.8 p -108.48 -8.67 15.5 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.913 -0.585 . . . . 1.48 110.135 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.68 33.39 16.21 Favored Glycine 0 N--CA 1.498 2.795 0 O-C-N 121.17 -0.956 . . . . 1.06 113.123 177.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.1 tttm -109.32 174.53 5.82 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.356 -1.673 . . . . 2.5 108.117 178.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -137.41 156.36 48.29 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.398 -1.439 . . . . 0.8 111.79 -177.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -137.75 147.77 45.01 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 122.522 1.153 . . . . 0.99 113.758 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.0 m -81.21 -27.15 35.41 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 115.023 -0.99 . . . . 1.39 109.428 178.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -120.67 144.15 48.34 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 118.916 -1.114 . . . . 3.01 111.0 -178.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.588 ' OG ' ' CE1' ' A' ' 58' ' ' HIS . 17.1 m -65.12 -42.6 93.77 Favored 'General case' 0 C--O 1.197 -1.674 0 C-N-CA 119.248 -0.981 . . . . 1.45 108.831 178.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.8 m -50.34 -44.26 54.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.038 -1.039 . . . . 1.71 108.524 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -69.04 -33.61 73.87 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 118.48 -1.288 . . . . 2.21 108.731 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.436 HD22 ' HB3' ' A' ' 58' ' ' HIS . 21.2 tp -73.05 -47.16 47.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.414 -1.429 . . . . 0.85 108.907 177.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.451 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 67.8 mt -55.01 -52.68 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.544 -1.347 . . . . 1.54 108.307 178.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.668 HG22 ' NZ ' ' A' ' 79' ' ' LYS . 91.8 m -59.14 -47.96 83.37 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 118.878 -1.129 . . . . 1.51 108.182 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.2 t60 -54.75 -49.23 71.36 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.752 0.787 . . . . 0.82 109.84 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.0 t -67.89 -31.22 70.85 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.382 -1.449 . . . . 0.66 108.928 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 44.5 mtp180 -61.42 -31.63 71.57 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 106.805 -1.554 . . . . 2.75 106.805 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.668 ' NZ ' HG22 ' A' ' 75' ' ' THR . 61.5 mttp -67.42 -46.32 73.51 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 107.255 -1.387 . . . . 2.64 107.255 177.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.493 ' CG ' HG11 ' A' ' 62' ' ' VAL . 58.1 m-70 -59.98 -65.94 0.6 Allowed 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 117.383 -1.727 . . . . 0.83 109.275 178.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.5 m -54.74 -55.25 31.92 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.714 -0.616 . . . . 0.75 110.03 -178.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.518 0 N-CA-C 109.243 -1.543 . . . . 1.46 109.243 179.828 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.598 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.5 m-85 . . . . . 0 N--CA 1.496 1.87 0 N-CA-C 108.711 -0.848 . . . . 0.88 108.711 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.14 112.08 21.17 Favored 'General case' 0 N--CA 1.512 2.627 0 CA-C-O 122.797 1.284 . . . . 1.78 113.5 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 0.1 OUTLIER -48.1 131.33 15.94 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-N 114.372 -1.286 . . . . 0.82 111.478 179.362 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -90.61 -22.36 21.26 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.649 -0.657 . . . . 2.42 112.003 -178.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.753 ' N ' HD12 ' A' ' 6' ' ' ILE . 1.1 mp -74.82 -69.29 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 O-C-N 120.253 -1.529 . . . . 0.91 111.479 -177.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.0 p -92.14 -18.77 23.05 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.727 -1.233 . . . . 0.87 110.018 -178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.86 51.59 2.8 Favored Glycine 0 N--CA 1.502 3.074 0 C-N-CA 119.999 -1.096 . . . . 0.83 114.552 175.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.401 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 27.9 mttp -121.63 160.89 23.45 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 119.603 1.702 . . . . 1.27 108.251 176.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 36.8 m -112.42 149.83 31.99 Favored 'General case' 0 N--CA 1.51 2.566 0 CA-C-O 122.51 1.148 . . . . 1.33 113.7 -175.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.543 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.6 m-85 -130.33 123.3 29.67 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.176 -0.92 . . . . 0.77 110.484 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.496 ' N ' ' CD ' ' A' ' 12' ' ' LYS . 11.6 mptt -63.46 -20.64 65.75 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 109.091 -0.707 . . . . 3.25 109.091 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.69 ' HB2' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -121.26 137.25 54.77 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.679 -0.638 . . . . 1.27 109.625 -178.231 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.598 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 0.0 OUTLIER -61.36 -34.7 75.74 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 118.887 -1.125 . . . . 0.69 107.99 179.575 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.8 t -63.32 -44.58 94.56 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.682 -0.636 . . . . 1.07 110.139 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.69 ' OG1' ' HB2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -62.27 -32.8 73.56 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 106.637 -1.616 . . . . 0.56 106.637 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.9 tp -72.63 -35.87 67.91 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.527 -1.286 . . . . 0.64 107.527 177.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.458 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 18.5 m -59.31 -59.13 5.95 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.802 -1.186 . . . . 0.55 108.726 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 80.4 m -53.71 -35.73 61.47 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.102 -1.073 . . . . 0.46 108.102 178.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.543 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 55.1 t60 -66.34 -47.65 72.79 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 122.262 1.029 . . . . 0.45 108.719 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 49.3 mt -58.42 -29.97 66.52 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 107.545 -1.28 . . . . 0.58 107.545 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 18' ' ' SER . 86.7 mt -73.3 -27.76 61.72 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 107.724 -1.213 . . . . 0.5 107.724 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.438 HG12 HH22 ' A' ' 28' ' ' ARG . 72.4 mt -63.02 -33.78 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 106.988 -1.486 . . . . 0.53 106.988 177.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.485 ' ND1' HG21 ' A' ' 6' ' ' ILE . 79.7 m-70 -79.57 -44.08 21.76 Favored 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 119.805 -0.758 . . . . 0.72 111.168 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.418 ' O ' ' C ' ' A' ' 26' ' ' ASP . 1.2 m -85.86 2.97 43.76 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.201 -1.562 . . . . 0.84 108.57 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.418 ' C ' ' O ' ' A' ' 25' ' ' SER . 4.6 m-20 36.31 57.42 1.05 Allowed 'General case' 0 N--CA 1.498 1.975 0 CA-C-O 121.719 0.771 . . . . 1.4 111.155 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 58.2 m -68.85 -52.25 31.79 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.794 -0.817 . . . . 0.61 108.794 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.481 ' HD2' ' N ' ' A' ' 28' ' ' ARG . 5.5 mpt_? 43.12 61.1 10.1 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.318 -0.864 . . . . 0.6 110.503 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.47 19.75 0.31 Allowed 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.085 1.856 . . . . 0.55 113.731 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -126.8 88.92 53.37 Favored Pre-proline 0 N--CA 1.503 2.184 0 O-C-N 120.611 -1.306 . . . . 0.66 109.338 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.94 136.97 9.57 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.817 2.345 . . . . 0.56 114.095 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.602 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -60.56 129.74 43.06 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.536 -0.913 . . . . 0.36 108.536 179.399 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -74.06 -11.67 60.39 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-N 116.058 -0.519 . . . . 1.34 110.772 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.501 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 40.5 m-85 -113.86 -70.45 0.8 Allowed 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.507 -1.37 . . . . 0.48 112.541 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.602 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 18.0 p -89.28 -7.54 55.21 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.893 -1.129 . . . . 0.34 111.18 -178.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.501 ' C ' ' HB3' ' A' ' 32' ' ' CYS . . . 87.88 -3.78 85.85 Favored Glycine 0 N--CA 1.5 2.901 0 N-CA-C 115.821 1.088 . . . . 0.39 115.821 175.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.569 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 19.4 mttm -48.08 148.07 1.9 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-N 121.795 2.797 . . . . 0.7 106.93 178.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -117.45 134.79 54.45 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.068 -1.645 . . . . 1.69 109.449 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 17.9 m-85 -119.19 175.48 5.77 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.433 -0.792 . . . . 0.53 109.016 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.532 ' CD2' ' H ' ' A' ' 40' ' ' HIS . 5.0 p80 -113.31 8.56 18.07 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.639 -0.663 . . . . 0.98 111.362 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.507 ' O ' ' C ' ' A' ' 42' ' ' LYS . 28.1 mt-30 -143.1 111.51 6.24 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.453 -1.404 . . . . 1.48 110.421 179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' A' ' 45' ' ' MET . 49.4 tttm -30.95 -80.59 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.527 -0.733 . . . . 1.1 111.05 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 42' ' ' LYS . 10.8 p -36.12 -31.15 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.144 -0.973 . . . . 0.77 111.718 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -75.55 -40.9 56.18 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 118.359 -1.337 . . . . 0.81 108.349 179.796 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.617 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.5 tmm? -65.28 -46.23 81.27 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.434 -1.691 . . . . 0.69 106.434 177.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.569 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 52.9 mmtt -50.7 -36.83 38.07 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 107.476 -1.305 . . . . 1.44 107.476 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.626 ' O ' HG23 ' A' ' 51' ' ' ILE . 5.4 mtmp? -63.33 -32.09 73.41 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 106.395 -1.706 . . . . 1.92 106.395 177.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.637 ' O ' HG12 ' A' ' 51' ' ' ILE . 66.3 t60 -72.6 -67.32 0.56 Allowed 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.273 -1.38 . . . . 0.33 107.273 177.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.569 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 41.7 p -40.68 -32.28 0.2 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 120.136 -1.602 . . . . 0.42 109.61 177.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.553 ' CZ ' ' OE1' ' A' ' 55' ' ' GLU . 3.9 m-30 -70.41 -32.82 70.6 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 121.074 -1.016 . . . . 0.47 108.955 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.637 HG12 ' O ' ' A' ' 48' ' ' HIS . 15.6 pt -71.1 -16.75 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 C-N-CA 118.409 -1.316 . . . . 0.37 109.264 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.467 ' NE2' ' HB2' ' A' ' 34' ' ' TYR . 67.1 m-70 -90.86 -30.68 16.81 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.403 -1.436 . . . . 0.32 109.061 176.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 62.8 p -85.23 -11.2 55.43 Favored 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 112.608 0.596 . . . . 0.56 112.608 -176.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 83.15 14.75 73.86 Favored Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.071 -1.612 . . . . 0.45 109.071 -178.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.553 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 85.2 mt-10 -74.5 130.51 39.75 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.282 -1.128 . . . . 1.77 111.031 -177.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.1 mmtt -139.46 67.42 37.82 Favored Pre-proline 0 N--CA 1.487 1.418 0 N-CA-C 108.581 -0.896 . . . . 1.39 108.581 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.55 -7.7 11.35 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.9 2.4 . . . . 0.47 113.122 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.42 ' HB3' HD22 ' A' ' 73' ' ' LEU . 80.2 m-70 -105.73 93.19 4.51 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.734 -1.229 . . . . 0.54 109.019 179.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.464 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 91.5 mttt -94.31 123.72 37.88 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.068 -1.02 . . . . 1.34 110.761 -178.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.02 119.09 24.52 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.532 -1.284 . . . . 0.8 107.532 177.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.464 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 38.6 mm-40 -74.79 -16.17 60.72 Favored 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 112.439 0.533 . . . . 1.39 112.439 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.478 HG11 ' CG ' ' A' ' 80' ' ' HIS . 40.7 t -69.54 -55.97 13.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.039 0 O-C-N 120.187 -1.571 . . . . 1.04 111.469 -178.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.8 p -112.11 -0.07 15.74 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 119.305 -0.958 . . . . 0.92 110.83 -177.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.79 31.8 55.17 Favored Glycine 0 N--CA 1.498 2.803 0 C-N-CA 119.768 -1.206 . . . . 0.74 112.516 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -102.16 168.72 9.18 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 106.203 -1.777 . . . . 1.67 106.203 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -139.09 149.19 44.26 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.436 -1.415 . . . . 0.6 110.836 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.431 ' HZ ' ' CE1' ' A' ' 76' ' ' HIS . 31.2 m-85 -133.46 151.53 51.8 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 122.061 0.934 . . . . 0.54 112.905 -177.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 79.7 p -79.08 -27.39 43.02 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.717 -0.674 . . . . 0.64 109.777 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -116.72 140.13 49.77 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.877 -1.139 . . . . 2.25 111.189 -178.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.449 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -64.18 -45.28 89.05 Favored 'General case' 0 C--O 1.2 -1.538 0 N-CA-C 108.223 -1.028 . . . . 0.82 108.223 178.194 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.0 t -49.75 -35.87 23.85 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.299 -0.876 . . . . 0.99 108.923 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -74.96 -31.21 61.42 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.193 -1.41 . . . . 0.84 107.193 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' A' ' 70' ' ' SER . 43.7 tp -72.73 -54.52 8.72 Favored 'General case' 0 C--O 1.199 -1.582 0 N-CA-C 107.288 -1.375 . . . . 0.76 107.288 176.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.429 ' C ' ' O ' ' A' ' 73' ' ' LEU . 72.0 mt -45.34 -51.14 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 O-C-N 120.438 -1.414 . . . . 1.02 108.549 178.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 57.2 m -62.43 -45.84 91.24 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 120.8 -1.188 . . . . 0.96 109.313 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.431 ' CE1' ' HZ ' ' A' ' 67' ' ' PHE . 22.1 t60 -60.84 -43.34 98.43 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 122.141 0.972 . . . . 0.8 109.593 -179.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -69.33 -32.55 71.71 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 120.779 -1.2 . . . . 1.34 108.283 178.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 82' ' ' GLY . 93.0 mtt180 -62.83 -31.88 72.98 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 106.673 -1.602 . . . . 2.35 106.673 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.03 -43.55 87.27 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 118.134 -1.426 . . . . 1.76 107.29 178.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.478 ' CG ' HG11 ' A' ' 62' ' ' VAL . 68.3 m-70 -66.12 -33.41 75.72 Favored 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 118.099 -1.44 . . . . 1.12 109.506 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 17.5 p -103.0 16.79 25.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.303 -0.873 . . . . 1.57 111.265 -177.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.488 2.129 0 C-N-CA 119.237 -1.459 . . . . 1.59 109.686 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.621 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.2 m-85 . . . . . 0 N--CA 1.493 1.723 0 N-CA-C 109.113 -0.699 . . . . 70.07 109.113 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -113.72 120.79 42.04 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 122.526 1.155 . . . . 83.59 112.414 -177.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.506 ' O ' ' HA2' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -52.62 126.61 20.27 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 108.377 -0.972 . . . . 50.89 108.377 177.257 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.457 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.3 OUTLIER -86.31 -17.33 34.87 Favored 'General case' 0 C--N 1.289 -2.053 0 O-C-N 120.846 -1.159 . . . . 99.16 111.939 -177.895 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.9 mm -77.91 -72.75 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 120.822 -1.174 . . . . 112.28 112.592 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.5 p -87.3 -32.0 19.91 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 106.516 -1.661 . . . . 82.08 106.516 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.506 ' HA2' ' O ' ' A' ' 4' ' ' CYS . . . 95.94 53.77 1.47 Allowed Glycine 0 N--CA 1.496 2.652 0 C-N-CA 118.513 -1.803 . . . . 195.93 114.54 174.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -115.71 164.56 14.18 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 104.438 -2.43 . . . . 114.22 104.438 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 90.2 p -115.7 149.19 38.8 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 119.826 -1.796 . . . . 78.05 113.847 -175.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 17.3 m-85 -129.21 129.69 45.36 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.682 0.753 . . . . 54.66 110.453 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.3 mtpt -73.31 -22.2 60.4 Favored 'General case' 0 N--CA 1.497 1.894 0 CA-C-O 121.785 0.803 . . . . 101.13 109.562 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.479 ' CB ' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -113.63 131.03 56.28 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.693 -0.855 . . . . 74.89 108.693 -177.516 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.621 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 98.3 p -58.63 -32.44 69.04 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.771 -1.206 . . . . 25.87 107.899 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 76.0 p -64.68 -41.48 96.02 Favored 'General case' 0 N--CA 1.485 1.315 0 O-C-N 121.541 -0.724 . . . . 23.45 110.337 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.479 ' OG1' ' CB ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -65.38 -33.5 76.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.078 -1.452 . . . . 32.27 107.078 179.816 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 tp -72.83 -36.36 67.49 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 107.509 -1.293 . . . . 97.78 107.509 177.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.594 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 20.7 t -57.84 -60.44 3.71 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.067 -1.021 . . . . 34.23 108.794 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.488 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 58.3 m -52.36 -40.55 62.15 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 122.526 1.155 . . . . 30.69 109.32 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 61.8 t60 -63.31 -46.05 88.5 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 108.116 -1.068 . . . . 81.83 108.116 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.7 mt -58.44 -31.4 67.73 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 106.638 -1.616 . . . . 156.93 106.638 178.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 18' ' ' SER . 35.7 mt -70.02 -24.49 63.29 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 115.278 -0.874 . . . . 64.07 108.685 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 86.9 mt -68.32 -33.3 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 107.13 -1.433 . . . . 150.1 107.13 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.5 m-70 -80.71 -38.31 29.09 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.434 -1.307 . . . . 55.94 109.744 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 m -84.78 -3.63 58.7 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 120.596 -1.315 . . . . 89.1 108.846 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 22' ' ' LEU . 53.7 m-20 47.94 51.3 14.62 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 121.385 0.612 . . . . 62.89 110.248 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -91.55 130.67 37.34 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.354 -0.841 . . . . 115.68 109.509 179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.0 mtt-85 -144.84 76.06 14.07 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 120.98 -1.075 . . . . 115.33 109.374 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.46 10.23 1.3 Allowed 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 121.843 1.695 . . . . 90.27 113.385 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.466 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 73.5 m-85 -115.19 81.72 8.33 Favored Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 120.985 -1.072 . . . . 131.19 108.434 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.81 126.07 7.06 Favored 'Trans proline' 0 C--N 1.312 -1.342 0 C-N-CA 122.509 2.139 . . . . 108.54 112.746 -178.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.501 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.1 OUTLIER -48.32 142.88 5.14 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.174 0.988 . . . . 43.4 110.08 178.204 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -83.36 -11.79 57.26 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.691 -0.631 . . . . 113.04 110.831 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.501 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 52.6 m-85 -117.67 -73.42 0.64 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.242 -1.536 . . . . 118.47 112.187 -178.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 18.3 p -79.21 -27.32 42.53 Favored 'General case' 0 N--CA 1.504 2.242 0 C-N-CA 119.088 -1.045 . . . . 56.06 110.634 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 104.94 1.46 42.23 Favored Glycine 0 N--CA 1.488 2.125 0 C-N-CA 119.405 -1.379 . . . . 19.15 114.218 175.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -54.73 153.32 6.09 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 121.12 2.46 . . . . 73.47 106.023 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -117.28 138.94 51.41 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.305 -1.497 . . . . 160.56 109.681 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.446 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 51.6 m-85 -120.18 160.53 22.73 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.078 -1.014 . . . . 72.45 110.153 -179.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.544 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -99.91 -7.67 24.96 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 116.234 -0.439 . . . . 97.77 110.542 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.517 ' O ' ' C ' ' A' ' 42' ' ' LYS . 88.3 mt-30 -130.3 109.24 10.61 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.885 -1.135 . . . . 106.11 109.32 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.585 ' O ' ' N ' ' A' ' 45' ' ' MET . 85.5 tttt -29.74 -82.47 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.781 -0.574 . . . . 136.29 111.199 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 42' ' ' LYS . 2.1 m -37.71 -30.42 0.03 OUTLIER 'General case' 0 C--N 1.291 -1.938 0 O-C-N 121.204 -0.935 . . . . 65.22 111.879 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 41' ' ' GLN . 57.6 t0 -72.35 -36.31 68.75 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.108 -1.62 . . . . 40.66 107.314 178.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.597 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.1 tmm? -71.31 -47.3 57.54 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.326 -1.361 . . . . 31.66 107.326 176.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.534 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 7.7 tptp -50.54 -39.06 48.01 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.21 -1.404 . . . . 103.12 107.21 -179.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.512 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.8 mtmt -64.41 -34.97 79.42 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 106.178 -1.786 . . . . 48.51 106.178 176.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.662 ' O ' HG12 ' A' ' 51' ' ' ILE . 64.8 t60 -65.38 -65.49 0.67 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 107.426 -1.324 . . . . 65.66 107.426 176.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.534 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 31.9 p -42.2 -33.32 0.59 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.227 -1.545 . . . . 47.02 109.9 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.508 ' CE2' ' OE1' ' A' ' 55' ' ' GLU . 2.6 m-85 -71.69 -27.65 63.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.86 -1.15 . . . . 54.63 109.572 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 48' ' ' HIS . 15.0 pt -74.96 -17.55 16.23 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 121.058 -1.026 . . . . 99.09 109.149 176.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.426 ' CE1' ' HB2' ' A' ' 34' ' ' TYR . 59.2 m-70 -89.34 -30.27 18.53 Favored 'General case' 0 N--CA 1.516 2.847 0 C-N-CA 118.065 -1.454 . . . . 59.33 107.916 176.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.465 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 38.6 p -77.18 -23.16 51.56 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.654 0.74 . . . . 97.33 109.061 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.69 22.64 35.9 Favored Glycine 0 N--CA 1.485 1.966 0 N-CA-C 108.276 -1.93 . . . . 23.68 108.276 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.508 ' OE1' ' CE2' ' A' ' 50' ' ' PHE . 86.5 mt-10 -85.66 127.1 34.4 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 122.394 1.092 . . . . 47.26 112.026 -177.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -137.76 78.83 35.58 Favored Pre-proline 0 C--N 1.296 -1.731 0 N-CA-C 107.588 -1.264 . . . . 86.79 107.588 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -67.37 -13.02 37.91 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 C-N-CA 123.101 2.534 . . . . 151.44 112.782 -178.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -96.34 91.32 5.79 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 118.437 -1.305 . . . . 42.67 108.623 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.404 ' O ' ' OE1' ' A' ' 61' ' ' GLN . 91.5 mttt -93.0 122.07 34.98 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.214 -0.929 . . . . 72.96 110.014 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.422 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -72.93 121.66 20.41 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.006 -1.109 . . . . 38.91 108.006 178.592 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.404 ' OE1' ' O ' ' A' ' 59' ' ' LYS . 1.6 mm100 -84.25 7.99 17.37 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.297 -0.877 . . . . 124.0 109.855 -178.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.788 HG11 ' CG ' ' A' ' 80' ' ' HIS . 21.7 t -91.65 -59.66 2.83 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 C-N-CA 119.566 -0.854 . . . . 56.07 109.546 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.1 p -111.22 -12.63 14.09 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.285 0.846 . . . . 63.83 113.285 -178.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.47 12.4 51.25 Favored Glycine 0 N--CA 1.505 3.247 0 O-C-N 120.057 -1.652 . . . . 23.81 112.867 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -86.18 166.79 15.47 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.087 -1.82 . . . . 120.74 106.087 177.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -132.41 144.76 50.73 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.481 -1.387 . . . . 39.51 109.702 -178.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.459 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 82.3 m-85 -128.49 147.03 50.65 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 122.237 1.018 . . . . 62.57 112.183 -177.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.1 m -74.31 -36.79 63.73 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.631 -0.713 . . . . 84.84 109.089 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -116.19 141.62 47.91 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.403 1.097 . . . . 93.39 111.751 -178.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.4 p -59.6 -40.83 88.79 Favored 'General case' 0 C--O 1.197 -1.664 0 N-CA-C 107.842 -1.169 . . . . 67.34 107.842 178.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.2 t -48.18 -41.9 28.27 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.374 -0.829 . . . . 68.68 110.004 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 -76.19 -29.73 57.76 Favored 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 118.321 -1.351 . . . . 33.83 108.307 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' A' ' 74' ' ' ILE . 48.3 tp -70.44 -55.65 8.5 Favored 'General case' 0 C--O 1.195 -1.804 0 N-CA-C 107.517 -1.29 . . . . 75.65 107.517 176.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.403 ' C ' ' O ' ' A' ' 73' ' ' LEU . 79.9 mt -45.91 -52.23 3.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 O-C-N 120.666 -1.271 . . . . 27.72 108.985 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.3 m -61.45 -45.87 92.45 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.985 -1.072 . . . . 95.2 109.702 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.459 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 11.6 t60 -64.56 -38.07 89.73 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 122.496 1.141 . . . . 66.3 109.09 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.53 -31.93 70.45 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 107.332 -1.358 . . . . 87.23 107.332 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 82' ' ' GLY . 10.0 mmt85 -63.36 -38.9 92.94 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 107.709 -1.219 . . . . 73.27 107.709 177.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.0 mttm -60.41 -44.07 96.07 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 118.014 -1.474 . . . . 80.85 107.403 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.788 ' CG ' HG11 ' A' ' 62' ' ' VAL . 59.3 m-70 -61.3 -35.73 78.15 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 117.002 -1.879 . . . . 46.01 107.898 177.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.467 HG22 ' O ' ' A' ' 81' ' ' THR . 20.4 m -98.26 24.16 7.53 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 107.918 -1.142 . . . . 89.5 107.918 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 109.476 -1.45 . . . . 8.65 109.476 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.666 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.6 m-85 . . . . . 0 N--CA 1.497 1.91 0 CA-C-O 121.609 0.719 . . . . 70.07 109.152 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.7 139.56 40.93 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 122.272 1.034 . . . . 83.59 110.844 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -72.53 130.24 40.18 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 122.046 0.927 . . . . 50.89 110.593 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -92.95 22.89 4.55 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 109.311 -0.626 . . . . 99.16 109.311 -177.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.3 mm -123.72 -58.24 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.055 -1.028 . . . . 112.28 113.603 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.9 p -103.79 -38.5 7.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.706 -1.246 . . . . 82.08 110.537 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 133.04 13.58 1.54 Allowed Glycine 0 N--CA 1.506 3.362 0 CA-C-O 118.727 -1.041 . . . . 195.93 114.463 177.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -104.01 164.11 11.92 Favored 'General case' 0 N--CA 1.516 2.837 0 CA-C-N 121.167 2.483 . . . . 114.22 113.805 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.5 t -117.36 160.06 21.75 Favored 'General case' 0 N--CA 1.511 2.593 0 CA-C-O 122.511 1.148 . . . . 78.05 113.195 -176.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.539 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.9 m-85 -140.06 127.9 21.95 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-N 115.455 -0.793 . . . . 54.66 110.401 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -72.59 -23.63 60.98 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 122.612 1.196 . . . . 101.13 109.217 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.732 ' HE ' ' N ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -119.17 115.5 24.36 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 114.784 -1.098 . . . . 74.89 110.158 -177.275 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.666 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 1.3 t -50.39 -33.69 21.59 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 118.4 -1.32 . . . . 25.87 109.303 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 p -56.28 -39.96 73.5 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.262 -1.524 . . . . 23.45 109.304 -178.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.1 m -72.64 -32.02 65.56 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.389 -0.967 . . . . 32.27 108.389 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.7 tp -72.73 -44.98 60.99 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 106.395 -1.706 . . . . 97.78 106.395 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.621 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 45.1 m -44.35 -53.96 6.28 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.84 -1.17 . . . . 34.23 107.84 178.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.7 m -59.63 -41.33 90.22 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.911 0.863 . . . . 30.69 109.008 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.539 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 56.6 t60 -63.18 -35.73 81.26 Favored 'General case' 0 C--N 1.291 -1.94 0 CA-C-O 122.423 1.106 . . . . 81.83 108.602 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.2 mt -70.73 -34.69 72.16 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.103 -1.814 . . . . 156.93 106.103 178.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 18' ' ' SER . 22.2 mt -65.4 -21.48 66.67 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.215 -1.402 . . . . 64.07 107.215 177.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 80.2 mt -74.89 -41.05 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 120.864 -1.148 . . . . 150.1 109.262 178.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -76.01 -27.71 57.48 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 118.027 -1.469 . . . . 55.94 108.865 178.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -86.91 -25.75 24.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.3 -0.875 . . . . 89.1 108.694 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 64.64 50.9 2.01 Favored 'General case' 0 C--N 1.29 -1.998 0 O-C-N 121.404 -0.81 . . . . 62.89 109.56 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.454 ' C ' HH11 ' A' ' 28' ' ' ARG . 2.3 m -98.23 127.46 44.17 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.445 -0.784 . . . . 115.68 109.261 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.454 HH11 ' C ' ' A' ' 27' ' ' THR . 1.7 mpt_? -136.36 80.04 40.81 Favored Pre-proline 0 N--CA 1.495 1.783 0 O-C-N 121.147 -0.971 . . . . 115.33 109.878 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -75.69 17.88 0.65 Allowed 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 122.296 1.997 . . . . 90.27 114.13 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.498 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 61.9 m-85 -124.1 82.73 56.4 Favored Pre-proline 0 N--CA 1.497 1.9 0 N-CA-C 107.657 -1.238 . . . . 131.19 107.657 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 5.4 Cg_endo -79.41 147.49 20.23 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 C-N-CA 122.689 2.259 . . . . 108.54 114.396 -177.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.625 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.5 OUTLIER -71.78 137.29 47.54 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-O 121.674 0.75 . . . . 43.4 109.826 -179.029 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.429 ' HG2' ' H ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -81.56 -15.68 54.04 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 120.414 -0.515 . . . . 113.04 110.476 -179.435 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.413 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 25.0 m-85 -119.09 -51.82 2.32 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 115.185 1.55 . . . . 118.47 115.185 -175.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.625 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.6 p -100.54 -18.62 16.55 Favored 'General case' 0 N--CA 1.517 2.917 0 O-C-N 120.414 -1.429 . . . . 56.06 113.843 -175.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 124.54 -32.58 4.04 Favored Glycine 0 N--CA 1.512 3.744 0 O-C-N 119.597 -1.94 . . . . 19.15 114.548 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -51.67 160.69 0.61 Allowed 'General case' 0 C--N 1.292 -1.915 0 O-C-N 120.895 -1.356 . . . . 73.47 112.698 -177.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.46 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 0.3 OUTLIER -131.97 152.96 50.78 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 107.801 -1.185 . . . . 160.56 107.801 179.846 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.467 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 35.4 m-85 -135.02 162.18 33.19 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-O 121.979 0.895 . . . . 72.45 110.36 -178.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.492 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -94.17 -11.92 29.4 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 115.598 -0.728 . . . . 97.77 110.863 -178.796 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' C ' ' A' ' 42' ' ' LYS . 65.7 mt-30 -131.86 116.24 16.95 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.928 -1.107 . . . . 106.11 110.126 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.499 ' O ' ' N ' ' A' ' 45' ' ' MET . 81.9 tttt -34.32 -74.21 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.197 -0.939 . . . . 136.29 111.384 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -43.98 -34.43 1.7 Allowed 'General case' 0 C--N 1.295 -1.775 0 O-C-N 121.566 -0.709 . . . . 65.22 111.287 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -68.36 -40.74 81.39 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.332 -1.729 . . . . 40.66 106.332 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.662 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 9.1 tmm? -69.45 -47.61 63.46 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 119.965 -1.709 . . . . 31.66 108.05 176.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.556 ' O ' ' OG1' ' A' ' 49' ' ' THR . 31.7 ttmt -50.9 -35.97 35.75 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.681 -1.229 . . . . 103.12 107.681 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.519 ' O ' HG23 ' A' ' 51' ' ' ILE . 25.9 mtmm -67.9 -32.78 73.5 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 105.596 -2.002 . . . . 48.51 105.596 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.824 ' O ' HG12 ' A' ' 51' ' ' ILE . 73.9 t60 -64.67 -65.21 0.7 Allowed 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 106.121 -1.807 . . . . 65.66 106.121 174.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.556 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 41.0 p -40.79 -37.05 0.7 Allowed 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.934 -1.104 . . . . 47.02 110.521 178.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.485 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 4.0 m-30 -65.52 -36.99 85.46 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.034 -1.042 . . . . 54.63 109.082 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.824 HG12 ' O ' ' A' ' 48' ' ' HIS . 10.5 pt -59.91 -36.58 67.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 N-CA-C 106.857 -1.535 . . . . 99.09 106.857 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -74.4 -32.08 62.57 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.452 -1.405 . . . . 59.33 110.852 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.485 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 69.3 p -85.56 -8.7 58.14 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.551 -1.343 . . . . 97.33 111.626 -176.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 74.0 13.78 80.71 Favored Glycine 0 N--CA 1.49 2.284 0 O-C-N 120.761 -1.212 . . . . 23.68 110.082 -178.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -75.82 107.78 8.23 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.98 0.895 . . . . 47.26 110.657 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -115.49 79.66 7.32 Favored Pre-proline 0 C--N 1.292 -1.912 0 N-CA-C 108.241 -1.022 . . . . 86.79 108.241 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -75.06 -13.31 21.33 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.488 2.126 . . . . 151.44 114.125 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -90.73 82.08 5.77 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 120.267 -1.521 . . . . 42.67 109.421 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -77.31 140.03 39.92 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 122.003 0.906 . . . . 72.96 111.404 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.481 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -103.11 115.4 30.52 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.621 -1.992 . . . . 38.91 105.621 177.569 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -85.12 14.05 5.53 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.34 -1.475 . . . . 124.0 109.934 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.675 HG11 ' CG ' ' A' ' 80' ' ' HIS . 46.8 t -95.47 -38.93 9.22 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 O-C-N 121.255 -0.903 . . . . 56.07 110.439 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.7 p -131.3 -8.01 3.78 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 122.139 0.971 . . . . 63.83 108.877 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.16 31.94 33.2 Favored Glycine 0 C--N 1.29 -2.024 0 O-C-N 120.837 -1.164 . . . . 23.81 111.195 176.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -96.36 -172.4 2.52 Favored 'General case' 0 C--N 1.287 -2.127 0 N-CA-C 103.216 -2.883 . . . . 120.74 103.216 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -165.74 148.13 7.44 Favored 'General case' 0 C--N 1.265 -3.077 0 N-CA-C 105.739 -1.949 . . . . 39.51 105.739 -176.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.55 ' CZ ' ' CG ' ' A' ' 76' ' ' HIS . 2.7 m-85 -129.22 146.77 51.06 Favored 'General case' 0 C--N 1.28 -2.419 0 C-N-CA 117.79 -1.564 . . . . 62.57 113.401 -175.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.446 ' OG ' ' HG3' ' A' ' 69' ' ' GLN . 4.9 p -70.7 -8.03 49.06 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 115.277 -0.874 . . . . 84.84 108.993 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.446 ' HG3' ' OG ' ' A' ' 68' ' ' SER . 24.7 mt-30 -145.4 130.82 18.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.036 -1.04 . . . . 93.39 111.312 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.596 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -51.1 -48.9 61.59 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.767 -1.208 . . . . 67.34 109.3 177.224 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.436 ' C ' ' O ' ' A' ' 70' ' ' SER . 0.3 OUTLIER -44.6 -44.87 9.18 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.969 -1.082 . . . . 68.68 108.7 -179.304 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.407 ' O ' ' CB ' ' A' ' 76' ' ' HIS . 63.0 m-20 -70.66 -28.1 64.53 Favored 'General case' 0 C--N 1.291 -1.976 0 C-N-CA 118.187 -1.405 . . . . 33.83 108.145 178.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.596 ' N ' ' O ' ' A' ' 70' ' ' SER . 37.6 tp -70.19 -59.33 2.95 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 106.778 -1.564 . . . . 75.65 106.778 175.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 91.5 mt -46.78 -54.34 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.376 -1.452 . . . . 27.72 109.875 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 3.2 m -61.96 -43.27 99.19 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 119.631 -1.918 . . . . 95.2 109.004 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.55 ' CG ' ' CZ ' ' A' ' 67' ' ' PHE . 16.2 t60 -58.94 -45.65 89.91 Favored 'General case' 0 C--N 1.296 -1.76 0 O-C-N 121.12 -0.988 . . . . 66.3 109.39 -178.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.6 t -69.15 -33.78 73.95 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 120.244 -1.535 . . . . 87.23 107.997 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.449 ' HB2' ' O ' ' A' ' 75' ' ' THR . 4.3 mtt85 -50.83 -41.04 57.3 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 106.49 -1.67 . . . . 73.27 106.49 178.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -64.6 -45.02 88.75 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 118.252 -1.379 . . . . 80.85 108.582 178.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.675 ' CG ' HG11 ' A' ' 62' ' ' VAL . 63.7 m-70 -62.49 -35.28 78.85 Favored 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 116.52 -2.072 . . . . 46.01 108.52 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 50.6 p -96.09 19.1 12.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.085 -1.01 . . . . 89.5 109.786 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.552 0 N-CA-C 109.381 -1.487 . . . . 8.65 109.381 178.971 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.576 ' CE2' ' N ' ' A' ' 14' ' ' SER . 3.7 m-85 . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.671 0.748 . . . . 70.07 109.158 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.904 ' O ' ' O ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -108.68 103.24 12.29 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 122.009 0.909 . . . . 83.59 110.761 -178.558 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.904 ' O ' ' O ' ' A' ' 3' ' ' ASP . 19.4 t -13.88 157.21 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.214 0 CA-C-N 114.621 -1.172 . . . . 50.89 109.573 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.7 mttp -120.36 20.44 11.92 Favored 'General case' 0 N--CA 1.507 2.385 0 N-CA-C 106.474 -1.676 . . . . 99.16 106.474 174.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.541 ' HB ' ' NE2' ' A' ' 24' ' ' HIS . 6.3 mm -126.13 -80.35 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 CA-C-N 115.333 -0.848 . . . . 112.28 110.361 -178.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.8 p -81.45 -36.2 29.66 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.269 -1.519 . . . . 82.08 109.384 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.88 43.44 1.12 Allowed Glycine 0 N--CA 1.506 3.302 0 C-N-CA 119.696 -1.24 . . . . 195.93 113.521 177.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.49 ' HG2' ' N ' ' A' ' 10' ' ' SER . 49.5 tttm -112.19 160.39 17.64 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.503 -1.586 . . . . 114.22 107.856 178.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.49 ' N ' ' HG2' ' A' ' 9' ' ' LYS . 57.6 p -112.32 146.96 37.34 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 123.499 1.619 . . . . 78.05 114.708 -174.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.531 ' HZ ' ' ND1' ' A' ' 20' ' ' HIS . 49.4 m-85 -130.22 125.69 35.52 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 113.35 -1.75 . . . . 54.66 110.047 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.1 mttp -70.82 -21.21 62.49 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 122.631 1.205 . . . . 101.13 108.507 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.563 ' NH2' ' H ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -114.68 136.82 52.64 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 114.893 -1.049 . . . . 74.89 110.19 -177.178 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.576 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 19.3 t -65.62 -36.4 83.6 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.041 -1.037 . . . . 25.87 108.978 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -38.99 90.01 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.186 -0.946 . . . . 23.45 110.293 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.8 m -66.11 -31.31 72.1 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 105.854 -1.906 . . . . 32.27 105.854 178.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 2' ' ' PHE . 14.9 tp -73.19 -35.14 66.33 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 106.712 -1.588 . . . . 97.78 106.712 176.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.635 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 40.3 p -57.91 -57.16 14.0 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.782 -1.199 . . . . 34.23 108.308 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.9 m -53.53 -41.17 66.12 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 122.439 1.114 . . . . 30.69 108.863 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.531 ' ND1' ' HZ ' ' A' ' 11' ' ' PHE . 55.3 t60 -62.78 -47.47 83.35 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-O 122.511 1.148 . . . . 81.83 108.411 178.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 37.9 mt -58.19 -30.72 66.65 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.025 -1.472 . . . . 156.93 107.025 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 18' ' ' SER . 61.3 mt -72.41 -26.69 61.96 Favored 'General case' 0 C--O 1.205 -1.246 0 N-CA-C 107.967 -1.123 . . . . 64.07 107.967 178.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 49.5 mt -64.07 -34.0 65.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 O-C-N 120.046 -1.659 . . . . 150.1 107.028 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.541 ' NE2' ' HB ' ' A' ' 6' ' ' ILE . 89.7 m-70 -81.21 -37.29 28.88 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 118.697 -1.201 . . . . 55.94 110.477 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.51 ' O ' ' C ' ' A' ' 26' ' ' ASP . 57.4 m -93.6 1.87 56.54 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.387 -1.446 . . . . 89.1 109.043 -179.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.51 ' C ' ' O ' ' A' ' 25' ' ' SER . 1.1 p30 32.47 59.86 0.38 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.436 0.636 . . . . 62.89 110.164 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 91.5 m -70.65 -54.54 11.53 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 108.077 -1.083 . . . . 115.68 108.077 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.431 HH11 ' HG2' ' A' ' 28' ' ' ARG . 23.3 mtt-85 40.69 67.64 2.76 Favored Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.731 -0.605 . . . . 115.33 110.843 179.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -89.1 26.24 0.57 Allowed 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.639 2.226 . . . . 90.27 113.847 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.531 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 63.9 m-85 -122.73 76.54 47.54 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 120.694 -1.254 . . . . 131.19 107.634 179.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.29 125.81 12.28 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 122.696 2.264 . . . . 108.54 114.507 -176.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.9 OUTLIER -52.92 135.24 36.8 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.636 -0.876 . . . . 43.4 108.636 177.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.7 -11.57 58.24 Favored 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.372 -0.931 . . . . 113.04 109.652 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.519 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 85.6 m-85 -104.71 -74.29 0.65 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.798 -1.189 . . . . 118.47 111.659 -178.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.555 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 28.4 p -85.98 -19.82 29.83 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 118.614 -1.234 . . . . 56.06 111.487 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.71 0.16 55.33 Favored Glycine 0 N--CA 1.498 2.771 0 O-C-N 120.409 -1.432 . . . . 19.15 114.867 175.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.413 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 25.5 mttp -54.57 164.84 0.66 Allowed 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 121.737 2.769 . . . . 73.47 107.42 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -123.85 107.56 11.52 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.454 -1.404 . . . . 160.56 109.132 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.608 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 31.6 m-85 -89.44 170.63 10.37 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.334 -0.854 . . . . 72.45 111.15 -178.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.776 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 0.3 OUTLIER -117.1 40.25 3.05 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 115.651 -0.704 . . . . 97.77 111.037 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.776 ' HG3' ' O ' ' A' ' 40' ' ' HIS . 12.9 mt-30 179.72 105.73 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 108.473 -0.936 . . . . 106.11 108.473 177.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 33.8 tttp -32.35 -65.37 0.15 Allowed 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 112.627 0.603 . . . . 136.29 112.627 -178.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.1 m -52.89 -39.15 62.46 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.502 -0.749 . . . . 65.22 111.11 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -64.74 -42.1 95.43 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.309 -1.367 . . . . 40.66 107.309 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.609 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 61.9 ttp -63.32 -44.9 93.62 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.33 -1.481 . . . . 31.66 107.22 177.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.638 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 22.9 mttm -51.41 -42.44 61.46 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 107.547 -1.279 . . . . 103.12 107.547 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.514 ' O ' HG23 ' A' ' 51' ' ' ILE . 51.7 mtmt -59.63 -30.99 69.11 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 106.361 -1.718 . . . . 48.51 106.361 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.614 ' O ' HG12 ' A' ' 51' ' ' ILE . 76.3 t60 -71.19 -65.14 0.78 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 107.419 -1.326 . . . . 65.66 107.419 176.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.638 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 19.4 p -43.99 -31.07 0.82 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.586 -1.321 . . . . 47.02 110.003 178.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -71.39 -34.02 70.02 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.457 -0.777 . . . . 54.63 109.198 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.0 pt -65.95 -36.64 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 C-N-CA 118.029 -1.468 . . . . 99.09 108.362 176.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.505 ' NE2' ' HB2' ' A' ' 34' ' ' TYR . 78.1 m-70 -69.48 -32.04 70.69 Favored 'General case' 0 N--CA 1.524 3.232 0 O-C-N 120.142 -1.599 . . . . 59.33 110.368 178.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 63.1 p -82.27 -17.48 45.76 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.506 -0.746 . . . . 97.33 109.599 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 84.13 17.38 65.08 Favored Glycine 0 N--CA 1.481 1.697 0 N-CA-C 107.359 -2.297 . . . . 23.68 107.359 -177.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -76.48 116.97 17.65 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 122.143 0.973 . . . . 47.26 110.348 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -125.72 78.47 69.03 Favored Pre-proline 0 N--CA 1.49 1.575 0 N-CA-C 108.76 -0.83 . . . . 86.79 108.76 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -65.0 -10.66 26.36 Favored 'Trans proline' 0 C--N 1.309 -1.548 0 C-N-CA 122.589 2.193 . . . . 151.44 112.804 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -112.34 95.79 5.65 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 117.762 -1.575 . . . . 42.67 109.434 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -97.96 129.49 44.86 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.22 -0.925 . . . . 72.96 110.219 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.405 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -71.84 120.55 17.59 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 107.147 -1.427 . . . . 38.91 107.147 178.523 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -88.2 9.7 22.01 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.275 -1.009 . . . . 124.0 108.275 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.457 HG11 ' CG ' ' A' ' 80' ' ' HIS . 14.2 t -94.56 -59.89 2.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 C-N-CA 119.929 -0.709 . . . . 56.07 111.026 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.4 p -114.56 -17.87 11.59 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 113.987 1.106 . . . . 63.83 113.987 -177.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.86 -11.75 7.37 Favored Glycine 0 N--CA 1.514 3.891 0 CA-C-N 122.112 2.233 . . . . 23.81 114.765 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.5 tttp -86.8 166.0 15.56 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.077 -1.837 . . . . 120.74 112.024 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.52 151.82 48.98 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.19 -0.944 . . . . 39.51 112.228 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.552 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 90.6 m-85 -132.49 144.18 50.27 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 122.264 1.03 . . . . 62.57 112.922 -177.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.9 t -78.47 -40.03 36.68 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.293 -1.003 . . . . 84.84 108.293 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -106.29 140.66 38.88 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.965 0.888 . . . . 93.39 110.747 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 75.2 p -62.33 -40.37 96.12 Favored 'General case' 0 C--O 1.195 -1.796 0 N-CA-C 107.86 -1.163 . . . . 67.34 107.86 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.446 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.4 OUTLIER -51.66 -35.1 41.02 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.621 -0.674 . . . . 68.68 110.078 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -80.57 -32.77 36.5 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.012 -1.075 . . . . 33.83 108.581 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.6 tp -73.71 -35.21 65.1 Favored 'General case' 0 C--O 1.202 -1.402 0 N-CA-C 106.914 -1.513 . . . . 75.65 106.914 176.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.5 ' O ' ' OG ' ' A' ' 77' ' ' SER . 66.6 mt -59.25 -54.16 38.14 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 O-C-N 120.486 -1.384 . . . . 27.72 107.732 177.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.65 ' O ' ' N ' ' A' ' 78' ' ' ARG . 55.2 m -57.98 -61.76 2.31 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 122.705 1.24 . . . . 95.2 107.91 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.552 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 13.0 t60 -45.59 -40.7 9.13 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.079 -1.082 . . . . 66.3 108.079 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.5 ' OG ' ' O ' ' A' ' 74' ' ' ILE . 95.6 p -69.45 -32.07 70.77 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 107.207 -1.405 . . . . 87.23 107.207 177.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.65 ' N ' ' O ' ' A' ' 75' ' ' THR . 51.8 mtp85 -61.41 -39.76 91.9 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.071 -1.018 . . . . 73.27 108.915 178.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.3 mttt -59.17 -45.72 90.27 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 105.622 -1.992 . . . . 80.85 105.622 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.457 ' CG ' HG11 ' A' ' 62' ' ' VAL . 47.7 m-70 -60.06 -43.13 95.62 Favored 'General case' 0 C--N 1.295 -1.78 0 C-N-CA 117.211 -1.796 . . . . 46.01 109.305 175.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 75.4 p -91.82 22.13 4.39 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.379 -1.45 . . . . 89.5 108.919 -179.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.486 2.002 0 N-CA-C 109.875 -1.29 . . . . 8.65 109.875 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.474 ' CE2' ' N ' ' A' ' 14' ' ' SER . 1.7 m-85 . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 108.44 -0.948 . . . . 70.07 108.44 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.5 p-10 -103.23 128.42 50.24 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 122.483 1.135 . . . . 83.59 110.341 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.34 123.88 19.41 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 108.123 -1.066 . . . . 50.89 108.123 178.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -83.43 -8.7 59.34 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.297 -0.877 . . . . 99.16 109.758 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.404 ' HB ' ' CD2' ' A' ' 24' ' ' HIS . 6.3 mm -83.14 -70.0 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.767 -1.208 . . . . 112.28 110.618 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 24.2 p -94.42 -23.9 17.56 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 120.816 -1.177 . . . . 82.08 111.215 -178.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 101.93 37.32 3.44 Favored Glycine 0 N--CA 1.504 3.226 0 C-N-CA 119.214 -1.47 . . . . 195.93 114.047 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -113.86 161.87 17.05 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.556 -1.556 . . . . 114.22 107.512 177.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.3 t -114.02 166.3 11.74 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.377 -1.452 . . . . 78.05 112.739 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.544 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 53.0 m-85 -143.18 127.94 18.22 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 114.643 -1.162 . . . . 54.66 109.775 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.632 ' NZ ' ' NH1' ' A' ' 13' ' ' ARG . 7.0 mtmp? -70.36 -24.45 62.97 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.609 0.719 . . . . 101.13 109.433 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.884 ' HE ' ' H ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -118.5 138.24 52.65 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.611 -0.681 . . . . 74.89 109.309 -178.642 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.474 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 22.9 t -59.87 -34.13 72.74 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 120.95 -1.094 . . . . 25.87 108.706 -179.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.46 -44.18 97.03 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 121.245 -0.909 . . . . 23.45 109.004 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.546 ' OG1' ' HB2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -61.51 -32.72 72.77 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 106.977 -1.49 . . . . 32.27 106.977 179.675 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.422 HD22 ' HB3' ' A' ' 2' ' ' PHE . 18.5 tp -73.83 -37.64 64.79 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.112 -1.44 . . . . 97.78 107.112 177.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.649 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 31.9 p -57.6 -58.53 7.93 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.796 -1.19 . . . . 34.23 109.195 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.429 ' N ' ' OG ' ' A' ' 18' ' ' SER . 97.0 m -57.07 -34.96 68.81 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 122.026 0.917 . . . . 30.69 108.961 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 62.1 t60 -65.94 -49.55 67.52 Favored 'General case' 0 C--N 1.295 -1.761 0 O-C-N 121.003 -1.061 . . . . 81.83 108.488 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 71.1 mt -55.25 -30.27 59.71 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 106.743 -1.577 . . . . 156.93 106.743 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 18' ' ' SER . 26.0 mt -70.9 -29.2 65.2 Favored 'General case' 0 C--O 1.208 -1.088 0 N-CA-C 108.178 -1.045 . . . . 64.07 108.178 178.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.414 ' N ' ' O ' ' A' ' 20' ' ' HIS . 65.4 mt -62.14 -36.1 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 O-C-N 119.877 -1.764 . . . . 150.1 107.728 177.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.404 ' CD2' ' HB ' ' A' ' 6' ' ' ILE . 88.7 m-70 -80.97 -31.15 34.92 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 118.765 -1.174 . . . . 55.94 111.192 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.8 m -92.98 -5.0 51.66 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.173 -1.579 . . . . 89.1 108.875 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 46.21 73.22 0.18 Allowed 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 109.245 -0.65 . . . . 62.89 109.245 -178.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.5 m -107.84 122.59 47.08 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.53 -0.915 . . . . 115.68 108.53 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -139.02 85.55 15.86 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.078 -1.014 . . . . 115.33 109.974 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -83.07 7.84 4.97 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 122.498 2.132 . . . . 90.27 113.388 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -112.27 93.94 24.38 Favored Pre-proline 0 N--CA 1.499 1.982 0 O-C-N 120.988 -1.07 . . . . 131.19 109.036 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.485 ' CB ' ' HE ' ' A' ' 38' ' ' ARG . 93.0 Cg_endo -85.78 129.29 3.5 Favored 'Trans proline' 0 N--CA 1.491 1.325 0 C-N-CA 122.636 2.224 . . . . 108.54 115.099 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.577 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -55.43 135.11 50.66 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.017 -1.105 . . . . 43.4 108.017 177.374 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -80.55 -16.27 54.62 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 121.826 -0.546 . . . . 113.04 110.954 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.48 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 13.9 m-85 -109.77 -66.61 1.05 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.603 -1.311 . . . . 118.47 112.333 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.577 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.9 p -91.01 12.72 18.84 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.602 -1.311 . . . . 56.06 112.209 -178.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 37' ' ' LYS . . . 69.79 -11.44 1.84 Allowed Glycine 0 N--CA 1.511 3.651 0 O-C-N 121.099 -1.001 . . . . 19.15 115.581 175.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.417 ' C ' ' O ' ' A' ' 36' ' ' GLY . 21.9 tttp -46.55 154.44 0.3 Allowed 'General case' 0 N--CA 1.507 2.411 0 CA-C-N 120.423 2.111 . . . . 73.47 108.717 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.485 ' HE ' ' CB ' ' A' ' 31' ' ' PRO . 1.1 mmt85 -120.23 147.6 44.74 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 120.081 -1.637 . . . . 160.56 109.785 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.541 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 77.5 m-85 -128.7 171.86 11.79 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.537 -0.727 . . . . 72.45 109.373 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.592 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 2.8 p-80 -109.58 -8.43 14.99 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.828 -0.545 . . . . 97.77 111.108 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -128.52 123.13 32.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.745 -1.222 . . . . 106.11 109.708 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -43.88 -66.1 0.42 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.887 -1.133 . . . . 136.29 111.177 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 21.9 t -47.18 -33.28 5.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.356 -0.84 . . . . 65.22 111.094 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -69.09 -45.2 70.86 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.129 -1.029 . . . . 40.66 108.28 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.554 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 35.7 ttp -63.03 -46.18 88.8 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.215 -1.402 . . . . 31.66 107.215 177.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.557 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 3.9 mmpt? -52.04 -40.74 61.54 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.33 -0.989 . . . . 103.12 108.33 -179.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.6 mtmt -63.14 -32.83 74.31 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 107.272 -1.381 . . . . 48.51 107.272 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.554 ' HB3' ' O ' ' A' ' 45' ' ' MET . 53.6 t60 -69.4 -65.82 0.66 Allowed 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 106.753 -1.573 . . . . 65.66 106.753 177.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.557 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 25.6 p -42.38 -30.43 0.33 Allowed 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.832 -1.168 . . . . 47.02 109.936 177.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.56 ' CD1' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-30 -73.46 -34.99 65.66 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.301 -0.875 . . . . 54.63 110.283 -179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 48' ' ' HIS . 19.2 pt -69.13 -22.28 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 C-N-CA 118.191 -1.404 . . . . 99.09 107.583 177.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.458 ' CE1' ' HB2' ' A' ' 34' ' ' TYR . 45.0 m-70 -79.72 -32.48 41.2 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.022 -1.048 . . . . 59.33 108.86 176.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.505 HG23 ' O ' ' A' ' 49' ' ' THR . 76.3 p -87.88 -11.98 46.13 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.709 -0.62 . . . . 97.33 112.175 -177.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.57 19.58 65.83 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 107.87 -2.092 . . . . 23.68 107.87 -177.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.56 ' OE1' ' CD1' ' A' ' 50' ' ' PHE . 32.3 mt-10 -79.14 130.24 35.29 Favored 'General case' 0 C--N 1.306 -1.3 0 O-C-N 121.379 -1.071 . . . . 47.26 110.922 -177.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -145.85 62.47 8.41 Favored Pre-proline 0 N--CA 1.49 1.567 0 N-CA-C 109.065 -0.717 . . . . 86.79 109.065 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -53.1 -15.47 5.09 Favored 'Trans proline' 0 N--CA 1.501 1.962 0 C-N-CA 123.132 2.554 . . . . 151.44 113.314 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.596 ' CE1' ' OG ' ' A' ' 70' ' ' SER . 95.9 m-70 -94.54 96.16 9.28 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.85 -1.156 . . . . 42.67 108.86 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.444 ' O ' ' C ' ' A' ' 60' ' ' CYS . 95.9 mttt -93.6 120.46 33.9 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.035 -1.041 . . . . 72.96 110.615 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.664 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 3.9 t -38.47 -86.68 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.728 -0.607 . . . . 38.91 109.765 179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.664 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 8.7 mm100 117.1 -16.51 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.732 0 CA-C-O 122.173 0.987 . . . . 124.0 108.804 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.47 HG11 ' CG ' ' A' ' 80' ' ' HIS . 5.6 t -95.86 -63.04 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 CA-C-O 121.776 0.798 . . . . 56.07 109.994 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 23.8 p -101.42 -14.05 17.72 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.856 -0.528 . . . . 63.83 111.647 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.71 27.43 9.04 Favored Glycine 0 N--CA 1.504 3.207 0 O-C-N 120.372 -1.455 . . . . 23.81 111.709 178.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -105.37 164.0 12.19 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.514 -1.58 . . . . 120.74 107.41 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.444 ' C ' ' CD2' ' A' ' 67' ' ' PHE . . . -134.27 163.22 30.11 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.897 -1.127 . . . . 39.51 111.518 -177.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.444 ' CD2' ' C ' ' A' ' 66' ' ' ALA . 66.2 m-85 -145.5 147.18 31.87 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 122.569 1.176 . . . . 62.57 113.548 -177.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 78.6 p -81.6 -10.72 59.36 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 115.266 -0.879 . . . . 84.84 109.193 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -133.63 145.06 49.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.214 -0.928 . . . . 93.39 110.646 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.596 ' OG ' ' CE1' ' A' ' 58' ' ' HIS . 10.0 m -71.2 -47.44 57.42 Favored 'General case' 0 C--O 1.197 -1.685 0 C-N-CA 119.45 -0.9 . . . . 67.34 109.135 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.616 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.6 OUTLIER -50.45 -33.22 20.26 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.193 -0.942 . . . . 68.68 108.58 179.675 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -77.37 -34.09 55.12 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.976 -1.078 . . . . 33.83 108.347 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.0 tp -73.28 -39.41 65.39 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.105 -1.072 . . . . 75.65 108.105 177.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' A' ' 71' ' ' SER . 93.0 mt -57.86 -53.79 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 O-C-N 120.768 -1.207 . . . . 27.72 108.666 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.475 ' HA ' ' HE ' ' A' ' 78' ' ' ARG . 97.4 m -59.08 -43.86 91.83 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.865 -1.147 . . . . 95.2 108.372 179.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.409 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 31.8 t60 -58.54 -43.34 89.22 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 122.563 1.173 . . . . 66.3 108.149 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 36.4 t -68.38 -34.51 76.18 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.173 -0.955 . . . . 87.23 109.279 178.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.475 ' HE ' ' HA ' ' A' ' 75' ' ' THR . 28.1 mtm180 -61.38 -33.68 74.07 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 107.948 -1.13 . . . . 73.27 107.948 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -47.9 77.59 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 107.19 -1.411 . . . . 80.85 107.19 178.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.47 ' CG ' HG11 ' A' ' 62' ' ' VAL . 53.3 m-70 -61.05 -44.96 96.61 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 117.834 -1.547 . . . . 46.01 109.077 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 33.8 m -50.31 -54.8 18.85 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.442 -0.786 . . . . 89.5 110.383 -177.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.65 -1.38 . . . . 8.65 109.65 179.995 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.548 ' CE1' ' N ' ' A' ' 14' ' ' SER . 13.7 m-85 . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 108.834 -0.802 . . . . 70.07 108.834 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -104.96 137.36 42.83 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 122.287 1.041 . . . . 83.59 112.016 -178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.41 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 0.5 OUTLIER -75.57 130.26 38.52 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-N 115.199 -0.91 . . . . 50.89 110.34 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -98.82 32.12 2.72 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 121.216 0.532 . . . . 99.16 109.617 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.473 HG21 ' CG ' ' A' ' 24' ' ' HIS . 5.2 mm -126.92 -78.38 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.293 -0.879 . . . . 112.28 108.82 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.54 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 31.7 p -83.26 -52.07 6.9 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.559 -1.645 . . . . 82.08 106.559 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.54 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 121.46 62.77 0.23 Allowed Glycine 0 N--CA 1.496 2.659 0 C-N-CA 119.761 -1.209 . . . . 195.93 113.401 176.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.41 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 34.6 tttt -131.11 161.6 31.73 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 106.357 -1.72 . . . . 114.22 106.357 176.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.3 p -115.37 167.91 10.44 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.094 -1.629 . . . . 78.05 112.466 -176.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.508 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 55.3 m-85 -145.43 131.95 19.79 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 115.078 -0.965 . . . . 54.66 110.966 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -19.57 63.07 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 115.788 -0.642 . . . . 101.13 110.035 -179.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.426 ' O ' ' OG1' ' A' ' 16' ' ' THR . 0.1 OUTLIER -124.9 136.81 54.12 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.32 -0.863 . . . . 74.89 109.975 -178.32 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.548 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 30.5 t -56.07 -33.12 64.72 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 118.975 -1.09 . . . . 25.87 108.337 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.5 p -65.22 -42.06 93.81 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.039 -0.726 . . . . 23.45 109.039 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -63.44 -33.25 75.14 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.336 -1.357 . . . . 32.27 107.336 179.555 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.444 HD22 ' HB3' ' A' ' 2' ' ' PHE . 16.7 tp -72.37 -46.32 55.91 Favored 'General case' 0 C--O 1.199 -1.59 0 N-CA-C 106.009 -1.848 . . . . 97.78 106.009 177.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.65 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 19.1 t -48.74 -58.84 4.16 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.162 -0.961 . . . . 34.23 108.505 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 87.4 m -54.61 -36.49 64.51 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.06 0.933 . . . . 30.69 109.163 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.508 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 64.4 t60 -68.21 -47.08 68.85 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-O 122.5 1.143 . . . . 81.83 108.269 179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 21' ' ' LEU . 72.9 mt -59.97 -34.35 73.18 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 106.448 -1.686 . . . . 156.93 106.448 179.221 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.65 ' HG ' ' O ' ' A' ' 18' ' ' SER . 7.0 mt -62.36 -31.18 71.79 Favored 'General case' 0 C--O 1.205 -1.246 0 N-CA-C 107.237 -1.394 . . . . 64.07 107.237 178.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.432 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 65.1 mt -63.01 -34.88 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.38 -1.45 . . . . 150.1 108.112 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.473 ' CG ' HG21 ' A' ' 6' ' ' ILE . 97.2 m-70 -85.59 -14.39 45.89 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.248 -0.981 . . . . 55.94 109.434 178.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.537 ' O ' ' C ' ' A' ' 26' ' ' ASP . 4.9 p -108.62 0.24 20.59 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.945 -1.097 . . . . 89.1 109.457 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.537 ' C ' ' O ' ' A' ' 25' ' ' SER . 9.9 m-20 27.88 51.5 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.323 0.582 . . . . 62.89 109.845 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.581 HG21 HD13 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -66.53 -47.09 74.01 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.882 -0.784 . . . . 115.68 108.882 179.601 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.434 ' H ' ' HD2' ' A' ' 28' ' ' ARG . 9.6 mpt_? 37.33 65.76 2.42 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.694 -0.629 . . . . 115.33 111.354 178.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 40' ' ' HIS . 70.7 Cg_endo -83.07 31.58 0.52 Allowed 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.998 2.465 . . . . 90.27 113.378 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -136.13 76.23 51.79 Favored Pre-proline 0 N--CA 1.5 2.066 0 O-C-N 120.795 -1.191 . . . . 131.19 108.605 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.43 ' HB3' ' HE ' ' A' ' 38' ' ' ARG . 18.5 Cg_exo -66.09 160.4 44.84 Favored 'Trans proline' 0 N--CA 1.502 2.028 0 C-N-CA 123.331 2.688 . . . . 108.54 114.681 -178.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.565 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -83.79 136.53 34.11 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 122.058 0.932 . . . . 43.4 108.633 178.215 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -79.23 -16.92 55.77 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 115.842 -0.617 . . . . 113.04 109.772 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.538 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 18.1 m-85 -111.89 -71.02 0.78 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.779 -1.201 . . . . 118.47 112.634 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.565 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 20.1 p -83.03 -18.72 38.73 Favored 'General case' 0 N--CA 1.517 2.883 0 O-C-N 120.331 -1.481 . . . . 56.06 113.7 -177.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.567 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 114.05 -35.01 4.68 Favored Glycine 0 N--CA 1.511 3.65 0 O-C-N 120.189 -1.569 . . . . 19.15 113.518 176.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.567 ' O ' ' O ' ' A' ' 36' ' ' GLY . 5.8 mtpm? -26.57 149.34 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.862 0 O-C-N 121.075 -1.25 . . . . 73.47 110.772 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.433 ' NH2' ' O ' ' A' ' 36' ' ' GLY . 3.2 mmp_? -116.89 136.61 52.81 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.823 -1.176 . . . . 160.56 107.823 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.424 ' CZ ' ' CG ' ' A' ' 48' ' ' HIS . 34.1 m-85 -124.91 176.78 6.41 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.311 -0.996 . . . . 72.45 108.311 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.63 ' O ' ' CD2' ' A' ' 40' ' ' HIS . 1.5 t-80 -113.34 -19.38 11.76 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.73 -0.788 . . . . 97.77 111.563 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.473 ' O ' ' HB2' ' A' ' 44' ' ' ASP . 67.5 mt-30 -121.88 128.43 51.59 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.728 -1.232 . . . . 106.11 111.635 -178.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.42 ' C ' ' O ' ' A' ' 41' ' ' GLN . 35.1 tptt -41.98 -71.05 0.09 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.227 -0.921 . . . . 136.29 110.109 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.411 ' C ' ' O ' ' A' ' 42' ' ' LYS . 26.0 p -43.5 -29.26 0.44 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.909 -1.12 . . . . 65.22 110.619 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 41' ' ' GLN . 4.8 m-20 -70.57 -47.59 59.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.377 -1.452 . . . . 40.66 107.822 178.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.497 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.0 tmm? -63.98 -48.01 78.12 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.425 -1.422 . . . . 31.66 107.796 178.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.579 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 90.2 mttt -51.1 -36.02 38.25 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.041 -1.096 . . . . 103.12 108.041 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.638 ' O ' HG23 ' A' ' 51' ' ' ILE . 30.3 mtpt -68.49 -34.52 76.06 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.106 -1.442 . . . . 48.51 107.106 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.813 ' O ' HG12 ' A' ' 51' ' ' ILE . 66.3 t60 -70.94 -64.49 0.89 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 106.9 -1.518 . . . . 65.66 106.9 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.579 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 16.9 p -42.66 -33.6 0.75 Allowed 'General case' 0 C--N 1.31 -1.148 0 O-C-N 120.414 -1.429 . . . . 47.02 108.775 177.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.531 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.1 m-85 -69.54 -28.06 65.69 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.057 -1.027 . . . . 54.63 108.233 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.813 HG12 ' O ' ' A' ' 48' ' ' HIS . 12.6 pt -73.34 -19.12 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 120.74 -1.225 . . . . 99.09 109.32 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.439 ' CD2' ' HB2' ' A' ' 34' ' ' TYR . 69.4 m-70 -89.9 -31.49 17.27 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.367 -1.458 . . . . 59.33 108.754 177.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.531 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 41.3 p -84.65 -20.73 30.84 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-N 115.345 -0.843 . . . . 97.33 109.329 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 71.72 49.06 25.41 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 108.606 -1.798 . . . . 23.68 108.606 -177.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.42 110.49 22.5 Favored 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.515 -0.991 . . . . 47.26 109.025 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -117.86 70.75 7.51 Favored Pre-proline 0 N--CA 1.494 1.725 0 O-C-N 121.5 -0.75 . . . . 86.79 110.556 -178.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -60.76 -8.2 8.91 Favored 'Trans proline' 0 N--CA 1.505 2.163 0 C-N-CA 123.841 3.027 . . . . 151.44 114.082 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.553 ' HB3' HD22 ' A' ' 73' ' ' LEU . 96.7 m-70 -101.83 93.0 5.07 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.549 -1.345 . . . . 42.67 108.315 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.457 ' CB ' ' NZ ' ' A' ' 59' ' ' LYS . 7.3 mtpm? -94.78 128.12 41.27 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.281 -0.887 . . . . 72.96 110.151 -178.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -79.43 124.64 28.64 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.702 0.763 . . . . 38.91 109.586 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -85.66 11.26 11.23 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.254 -0.904 . . . . 124.0 110.046 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.827 HG11 ' CG ' ' A' ' 80' ' ' HIS . 22.3 t -98.81 -58.1 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 120.865 -1.147 . . . . 56.07 111.049 -178.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 31.8 p -107.15 -25.5 11.52 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.157 -0.964 . . . . 63.83 109.76 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 109.39 10.85 22.96 Favored Glycine 0 N--CA 1.5 2.94 0 O-C-N 120.901 -1.125 . . . . 23.81 111.687 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 tttm -88.81 174.54 7.92 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.446 -1.62 . . . . 120.74 108.765 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -137.65 150.38 47.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.761 -1.212 . . . . 39.51 111.419 -177.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.508 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 63.8 m-85 -132.09 147.68 52.45 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 122.167 0.984 . . . . 62.57 111.534 -178.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.8 m -83.55 -19.6 35.33 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 108.934 -0.765 . . . . 84.84 108.934 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -122.53 146.1 47.71 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.121 -1.032 . . . . 93.39 111.697 -177.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 10.6 m -65.45 -40.82 93.69 Favored 'General case' 0 C--O 1.199 -1.571 0 N-CA-C 106.794 -1.558 . . . . 67.34 106.794 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.5 t -50.24 -45.69 54.23 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.479 -0.763 . . . . 68.68 109.356 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -73.25 -30.99 63.84 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 118.72 -1.192 . . . . 33.83 109.459 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.553 HD22 ' HB3' ' A' ' 58' ' ' HIS . 18.2 tp -74.4 -39.76 62.47 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.869 -1.144 . . . . 75.65 108.987 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.406 ' O ' ' CG ' ' A' ' 78' ' ' ARG . 97.3 mt -63.6 -50.4 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 120.254 -1.529 . . . . 27.72 107.67 177.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.7 m -57.98 -49.8 75.58 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 122.286 1.041 . . . . 95.2 108.64 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.508 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 28.3 t60 -58.64 -48.7 80.15 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.783 0.801 . . . . 66.3 110.717 -178.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.1 t -70.09 -34.29 72.97 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 120.136 -1.602 . . . . 87.23 108.656 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.406 ' CG ' ' O ' ' A' ' 74' ' ' ILE . 19.8 mmt180 -55.9 -32.13 63.46 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 107.083 -1.451 . . . . 73.27 107.083 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -69.29 -47.9 63.21 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.946 -1.131 . . . . 80.85 107.946 177.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.827 ' CG ' HG11 ' A' ' 62' ' ' VAL . 60.1 m-70 -56.98 -58.04 9.9 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 117.078 -1.849 . . . . 46.01 107.9 178.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 49.5 m -49.12 -52.27 27.11 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.102 -1.073 . . . . 89.5 108.102 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 109.392 -1.483 . . . . 8.65 109.392 179.928 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 2' ' ' PHE . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 107.51 -1.293 . . . . 1.35 107.51 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.573 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 0.5 OUTLIER -110.63 132.99 53.71 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 122.532 1.158 . . . . 1.67 110.95 -178.755 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.29 129.82 41.88 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 113.886 -1.506 . . . . 0.92 111.037 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -103.64 30.6 4.93 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.276 -0.89 . . . . 2.46 109.315 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.615 HD12 ' CD2' ' A' ' 24' ' ' HIS . 29.0 mt -121.45 -29.59 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 119.754 -0.778 . . . . 1.51 111.0 -178.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.5 p -142.07 -27.75 0.63 Allowed 'General case' 0 C--N 1.298 -1.667 0 C-N-CA 118.995 -1.082 . . . . 1.5 109.784 -179.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 112.06 61.58 0.46 Allowed Glycine 0 N--CA 1.498 2.792 0 C-N-CA 119.489 -1.338 . . . . 1.27 114.1 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.0 tttm -142.83 150.95 40.6 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.543 -1.563 . . . . 1.33 107.817 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 3' ' ' ASP . 3.6 p -109.86 158.8 17.8 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.731 -1.231 . . . . 0.8 111.911 -176.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.629 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 63.1 m-85 -136.68 128.17 28.55 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 115.275 -0.875 . . . . 0.7 111.335 -178.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -69.99 -21.1 63.26 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 115.447 -0.797 . . . . 2.61 108.96 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.401 ' HB2' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -127.82 140.82 51.8 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 122.123 0.964 . . . . 2.04 109.976 -177.762 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.5 t -59.49 -33.36 71.24 Favored 'General case' 0 C--N 1.289 -2.029 0 O-C-N 120.48 -1.388 . . . . 1.27 107.411 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.1 p -61.55 -52.0 66.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 119.94 -0.704 . . . . 1.48 109.462 -178.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.401 ' OG1' ' HB2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -58.2 -36.02 72.5 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.184 -1.043 . . . . 0.95 108.184 -179.865 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.8 tp -69.62 -40.51 76.55 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 107.128 -1.434 . . . . 0.62 107.128 177.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.674 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.5 t -53.12 -50.25 64.88 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.283 -0.886 . . . . 0.74 109.389 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 74.9 m -65.09 -38.26 90.17 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.948 -1.095 . . . . 1.2 108.816 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.629 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 43.8 t60 -61.27 -41.95 97.8 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.218 -1.03 . . . . 0.8 108.218 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 54.2 mt -62.51 -35.34 79.08 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 106.969 -1.493 . . . . 0.82 106.969 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 18' ' ' SER . 31.9 mt -65.5 -30.05 70.77 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.643 -1.243 . . . . 1.16 107.643 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 67.8 mt -59.87 -40.11 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 O-C-N 120.102 -1.624 . . . . 1.38 106.64 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.615 ' CD2' HD12 ' A' ' 6' ' ' ILE . 77.7 m-70 -72.76 -60.88 2.02 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 118.432 -1.307 . . . . 1.29 109.44 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.424 ' O ' ' C ' ' A' ' 26' ' ' ASP . 20.2 m -62.11 -5.7 2.45 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.835 -1.165 . . . . 1.63 112.148 -178.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 25' ' ' SER . 65.3 m-20 43.73 63.18 1.66 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.844 -1.16 . . . . 1.45 109.132 -177.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.546 ' C ' HH11 ' A' ' 28' ' ' ARG . 1.8 m -99.4 111.26 23.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.424 -0.797 . . . . 1.22 109.294 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.546 HH11 ' C ' ' A' ' 27' ' ' THR . 1.7 mpt_? -125.45 79.22 67.25 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.47 -0.769 . . . . 0.97 110.225 -179.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -78.54 9.08 3.33 Favored 'Trans proline' 0 C--N 1.313 -1.314 0 C-N-CA 122.682 2.255 . . . . 1.1 112.437 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.507 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 60.0 m-85 -117.92 84.94 21.98 Favored Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 121.303 -0.873 . . . . 0.8 109.435 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -83.43 143.03 10.85 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.321 2.014 . . . . 0.85 112.943 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.478 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -67.15 149.72 50.11 Favored 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 119.298 -0.961 . . . . 0.51 109.796 -179.307 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.447 HE21 HG21 ' A' ' 49' ' ' THR . 0.4 OUTLIER -87.42 -23.54 24.48 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.93 -0.708 . . . . 1.31 111.633 -178.53 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.491 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 5.2 m-85 -102.91 -69.78 0.78 Allowed 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 117.364 -1.734 . . . . 0.76 111.289 -179.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 15.3 p -81.15 -23.34 38.34 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.559 -1.338 . . . . 0.51 111.728 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.609 ' O ' ' NH1' ' A' ' 38' ' ' ARG . . . 102.72 -4.33 50.05 Favored Glycine 0 N--CA 1.514 3.855 0 O-C-N 120.201 -1.562 . . . . 0.54 116.441 174.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.5 ' C ' ' O ' ' A' ' 36' ' ' GLY . 36.0 mttp -47.14 156.91 0.2 Allowed 'General case' 0 N--CA 1.509 2.489 0 CA-C-N 122.39 3.095 . . . . 1.38 108.649 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.609 ' NH1' ' O ' ' A' ' 36' ' ' GLY . 9.6 mmt-85 -111.09 123.54 50.4 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 107.465 -1.309 . . . . 2.11 107.465 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.459 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 82.9 m-85 -113.85 164.62 13.52 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.712 -1.242 . . . . 0.69 109.889 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.512 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -103.19 -6.64 21.94 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 116.243 -0.435 . . . . 1.03 111.073 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -133.33 119.67 20.03 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.538 -1.351 . . . . 1.03 110.201 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.507 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 71.8 tttt -41.61 -61.32 1.1 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.521 -0.737 . . . . 0.59 110.895 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.4 p -53.7 -30.14 42.28 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.254 -0.904 . . . . 1.42 111.971 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 47' ' ' LYS . 51.4 m-20 -76.67 -39.71 51.3 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 117.385 -1.726 . . . . 1.48 107.588 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.655 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 7.6 tmm? -60.81 -46.72 89.44 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 105.728 -1.953 . . . . 0.48 105.728 176.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.511 ' O ' ' OG1' ' A' ' 49' ' ' THR . 59.8 tttp -54.2 -38.0 65.16 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.105 -1.072 . . . . 2.61 108.105 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.576 ' O ' HG23 ' A' ' 51' ' ' ILE . 47.5 mtpt -66.47 -32.65 74.14 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 106.582 -1.636 . . . . 1.55 106.582 177.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.684 ' O ' HG12 ' A' ' 51' ' ' ILE . 71.0 t60 -64.74 -60.12 3.47 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 107.016 -1.476 . . . . 0.45 107.016 176.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.511 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 54.2 p -47.46 -36.67 10.39 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 120.944 -1.098 . . . . 0.56 111.154 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.443 ' CD1' ' OE1' ' A' ' 55' ' ' GLU . 3.2 m-85 -69.3 -31.77 70.46 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.633 -1.292 . . . . 0.8 109.666 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.684 HG12 ' O ' ' A' ' 48' ' ' HIS . 3.0 pt -65.21 -32.49 58.49 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.236 0 C-N-CA 118.423 -1.311 . . . . 0.76 108.159 177.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.444 ' CE1' ' HB2' ' A' ' 34' ' ' TYR 0.251 60.6 m-70 -77.07 -33.88 57.08 Favored 'General case' 0 N--CA 1.537 3.879 0 O-C-N 120.492 -1.38 . . . . 0.84 111.054 177.48 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 49' ' ' THR . 73.9 p -79.66 -16.68 55.31 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 106.17 -1.789 . . . . 0.99 106.17 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 67.58 68.98 1.48 Allowed Glycine 0 C--O 1.203 -1.831 0 N-CA-C 104.396 -3.481 . . . . 1.09 104.396 -174.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.443 ' OE1' ' CD1' ' A' ' 50' ' ' PHE . 50.1 mt-10 -120.91 128.48 52.82 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.449 -0.945 . . . . 1.92 108.449 -179.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.9 mmtm -133.36 79.03 61.9 Favored Pre-proline 0 C--N 1.297 -1.702 0 C-N-CA 119.938 -0.705 . . . . 1.27 109.335 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.87 0.9 5.05 Favored 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 122.158 1.905 . . . . 0.77 112.801 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.5 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 97.1 m-70 -112.85 89.86 3.19 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.101 -1.0 . . . . 0.75 108.851 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.434 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 62.3 mttp -94.5 133.43 38.12 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.092 -1.005 . . . . 1.79 112.268 -177.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.405 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -80.35 117.81 21.44 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 106.821 -1.548 . . . . 0.39 106.821 176.875 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.434 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 22.0 mm-40 -84.19 12.64 6.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.56 -0.713 . . . . 2.78 109.221 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.405 ' HB ' ' SG ' ' A' ' 60' ' ' CYS . 13.7 t -98.03 -65.67 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.888 0 C-N-CA 120.044 -0.662 . . . . 0.47 111.088 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.2 p -107.26 -7.62 16.68 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.504 -0.878 . . . . 0.59 113.179 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 111.25 -11.78 28.76 Favored Glycine 0 N--CA 1.515 3.963 0 C-N-CA 118.437 -1.84 . . . . 0.53 113.884 176.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -78.58 169.11 18.77 Favored 'General case' 0 N--CA 1.509 2.515 0 CA-C-N 120.171 1.986 . . . . 0.77 111.526 -177.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -138.42 150.67 46.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.374 -0.829 . . . . 0.65 109.487 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.573 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 35.9 m-85 -133.31 152.38 51.92 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 122.482 1.134 . . . . 0.56 112.794 -177.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.9 p -81.62 -29.94 33.04 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 115.055 -0.975 . . . . 1.64 108.537 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -117.28 146.91 43.0 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 122.114 0.959 . . . . 1.59 111.604 -178.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.451 ' O ' HG13 ' A' ' 74' ' ' ILE . 6.1 m -65.96 -44.07 86.06 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 118.792 -1.163 . . . . 1.23 107.937 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 t -49.13 -42.49 39.52 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.149 -0.969 . . . . 1.8 109.136 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.8 m-20 -71.48 -33.71 69.53 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 117.673 -1.611 . . . . 0.82 108.096 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 58' ' ' HIS . 11.1 tp -64.62 -52.43 57.51 Favored 'General case' 0 N--CA 1.504 2.23 0 N-CA-C 106.182 -1.784 . . . . 0.52 106.182 175.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 70' ' ' SER . 45.1 mt -52.13 -55.52 9.72 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 O-C-N 121.135 -0.978 . . . . 0.83 110.865 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.0 m -59.63 -41.52 90.63 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 119.778 -1.826 . . . . 0.7 107.725 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.573 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 42.0 t60 -62.04 -45.42 93.65 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.951 0.881 . . . . 0.42 109.726 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 38.8 t -68.11 -32.89 73.51 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.003 -1.11 . . . . 0.56 108.003 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -61.04 -38.79 87.4 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.768 -1.197 . . . . 1.7 107.768 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -44.86 95.03 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 118.185 -1.406 . . . . 1.93 107.331 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -57.83 -53.37 58.98 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 118.014 -1.474 . . . . 0.65 109.273 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 56.5 p -58.85 -48.02 82.85 Favored 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 118.391 -1.323 . . . . 1.03 108.999 -177.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.041 0 C-N-CA 118.948 -1.596 . . . . 1.85 109.797 179.102 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.46 ' HB3' HD22 ' A' ' 17' ' ' LEU . 6.1 m-85 . . . . . 0 N--CA 1.502 2.142 0 CA-C-O 121.279 0.561 . . . . 1.96 109.633 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -109.18 144.91 36.64 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 122.474 1.13 . . . . 2.6 111.579 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -84.69 127.93 34.35 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.03 -0.986 . . . . 2.37 109.998 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.8 mttp -94.97 37.24 1.16 Allowed 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.207 -0.933 . . . . 2.62 109.455 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.664 HG21 ' CG ' ' A' ' 24' ' ' HIS . 12.8 mm -131.5 -26.75 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.488 -1.382 . . . . 2.82 112.345 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.4 p -136.78 -35.6 0.71 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.6 -1.312 . . . . 3.03 110.233 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.04 46.08 0.39 Allowed Glycine 0 N--CA 1.509 3.504 0 O-C-N 120.553 -1.342 . . . . 2.97 113.549 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -136.89 159.62 41.33 Favored 'General case' 0 N--CA 1.511 2.618 0 CA-C-N 119.286 1.543 . . . . 3.12 110.611 177.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.9 p -116.76 154.5 30.54 Favored 'General case' 0 N--CA 1.512 2.671 0 N-CA-C 113.913 1.079 . . . . 2.96 113.913 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -131.81 131.75 43.15 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-O 122.144 0.973 . . . . 2.27 111.746 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.684 ' H ' ' NH1' ' A' ' 13' ' ' ARG . 37.2 mmtm -74.61 -22.56 58.88 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 122.187 0.994 . . . . 3.79 109.259 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.684 ' NH1' ' H ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -118.21 136.12 53.84 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 115.172 -0.922 . . . . 2.93 111.39 -177.239 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 t -65.2 -34.34 78.15 Favored 'General case' 0 C--O 1.195 -1.809 0 C-N-CA 118.379 -1.328 . . . . 1.38 108.917 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 p -59.37 -37.48 78.0 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.318 -1.489 . . . . 1.5 109.718 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 29.8 m -73.77 -29.83 62.43 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.622 -1.298 . . . . 1.81 107.612 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.46 HD22 ' HB3' ' A' ' 2' ' ' PHE . 14.1 tp -72.45 -50.39 26.53 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 106.239 -1.764 . . . . 1.44 106.239 176.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.682 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 75.8 m -49.04 -61.27 2.16 Favored 'General case' 0 C--N 1.289 -2.044 0 O-C-N 120.835 -1.166 . . . . 1.27 109.071 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.657 HG23 ' NE2' ' A' ' 40' ' ' HIS . 27.3 m -52.78 -36.38 58.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.039 -1.038 . . . . 1.16 109.094 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -68.16 -44.76 75.25 Favored 'General case' 0 C--N 1.294 -1.807 0 O-C-N 121.303 -0.873 . . . . 2.02 109.17 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.0 mt -60.71 -29.25 69.23 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 105.532 -2.025 . . . . 1.55 105.532 177.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.682 ' HG ' ' O ' ' A' ' 18' ' ' SER . 27.3 mt -71.22 -27.34 63.41 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.745 -1.205 . . . . 1.16 107.745 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.546 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 66.8 mt -62.57 -44.4 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 120.086 -1.634 . . . . 1.98 108.268 178.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.664 ' CG ' HG21 ' A' ' 6' ' ' ILE . 77.2 m-70 -69.84 -59.35 2.99 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.455 -1.298 . . . . 2.25 108.99 177.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.4 m -58.5 -12.39 3.92 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.664 -1.272 . . . . 1.8 110.783 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.546 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 5.0 m-20 50.19 57.94 6.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.652 -0.655 . . . . 1.58 109.614 -178.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.8 m -90.42 105.66 17.97 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.31 -0.869 . . . . 2.67 109.596 179.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -122.74 80.56 48.78 Favored Pre-proline 0 N--CA 1.497 1.918 0 O-C-N 121.256 -0.902 . . . . 2.83 109.63 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -84.0 15.76 2.07 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 123.114 2.543 . . . . 1.56 114.361 -179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.489 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 85.8 m-85 -118.86 86.53 30.98 Favored Pre-proline 0 N--CA 1.501 2.114 0 O-C-N 120.963 -1.086 . . . . 1.4 108.476 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -82.93 128.85 5.24 Favored 'Trans proline' 0 C--N 1.31 -1.469 0 C-N-CA 122.739 2.293 . . . . 1.21 112.844 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.617 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 0.4 OUTLIER -47.94 142.6 4.84 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 122.426 1.108 . . . . 0.98 109.722 178.879 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.444 ' CG ' HG22 ' A' ' 49' ' ' THR . 0.0 OUTLIER -82.9 -11.83 57.87 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.549 -0.751 . . . . 1.62 109.925 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.541 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 22.9 m-85 -118.13 -73.88 0.63 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.429 -1.42 . . . . 0.85 111.168 -179.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.575 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 14.2 p -84.02 19.48 1.76 Allowed 'General case' 0 N--CA 1.515 2.813 0 CA-C-O 121.889 0.852 . . . . 1.04 110.242 -179.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.482 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 42.87 10.42 0.01 OUTLIER Glycine 0 N--CA 1.503 3.123 0 CA-C-N 114.095 -1.411 . . . . 1.17 114.407 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.617 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 69.6 tttt -52.42 172.84 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 121.977 2.888 . . . . 2.07 105.698 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.5 mtp85 -131.03 142.1 50.28 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 119.427 -2.046 . . . . 2.27 110.683 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.503 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 60.0 m-85 -126.6 167.47 15.62 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.748 -0.834 . . . . 1.16 108.748 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.657 ' NE2' HG23 ' A' ' 19' ' ' THR . 0.0 OUTLIER -100.59 -24.2 14.5 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.859 -0.526 . . . . 1.56 111.239 -178.764 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.456 ' O ' ' C ' ' A' ' 42' ' ' LYS . 46.8 mt-30 -118.02 116.8 27.62 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.277 -1.515 . . . . 1.75 111.607 -178.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.542 ' HZ3' ' HE2' ' A' ' 46' ' ' LYS . 62.6 tttm -34.02 -66.2 0.17 Allowed 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.058 -1.026 . . . . 2.19 112.32 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 93.4 p -48.62 -31.2 6.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.971 -1.081 . . . . 1.33 110.366 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.449 ' N ' ' O ' ' A' ' 41' ' ' GLN . 96.7 m-20 -70.09 -44.07 69.81 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.66 -1.275 . . . . 1.31 107.652 177.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.562 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 18.9 ttp -64.98 -46.16 82.63 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 120.696 -1.252 . . . . 1.01 107.976 177.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.542 ' HE2' ' HZ3' ' A' ' 42' ' ' LYS . 5.3 tppt? -53.31 -37.96 62.72 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.367 -1.346 . . . . 2.44 107.367 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.569 ' O ' HG23 ' A' ' 51' ' ' ILE . 9.4 mtpt -64.25 -33.18 75.23 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 106.25 -1.759 . . . . 2.65 106.25 177.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.717 ' O ' HG12 ' A' ' 51' ' ' ILE . 58.7 t60 -69.06 -62.61 1.31 Allowed 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 107.702 -1.221 . . . . 0.85 107.702 177.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.444 HG22 ' CG ' ' A' ' 33' ' ' GLN . 75.8 p -43.61 -36.05 1.98 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 120.639 -1.288 . . . . 0.78 110.329 178.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.619 ' CZ ' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-30 -68.59 -32.45 72.36 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 108.416 -0.957 . . . . 0.99 108.416 179.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.717 HG12 ' O ' ' A' ' 48' ' ' HIS . 7.1 pt -64.6 -31.81 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 C-N-CA 118.058 -1.457 . . . . 0.85 108.846 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 -77.74 -33.47 52.91 Favored 'General case' 0 N--CA 1.521 3.079 0 O-C-N 120.729 -1.232 . . . . 0.8 110.404 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.4 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 73.5 p -87.54 -6.98 58.1 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.92 0.867 . . . . 0.8 109.66 -179.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 52.71 69.84 1.08 Allowed Glycine 0 C--N 1.292 -1.881 0 N-CA-C 106.139 -2.784 . . . . 0.62 106.139 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.619 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 33.0 mt-10 -115.24 130.1 56.82 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 105.319 -2.104 . . . . 1.97 105.319 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.7 mttm -138.74 80.98 23.99 Favored Pre-proline 0 C--N 1.304 -1.373 0 O-C-N 120.911 -1.118 . . . . 2.28 110.467 -177.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -73.31 13.7 0.66 Allowed 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.863 2.375 . . . . 0.92 112.615 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -116.2 83.44 1.95 Allowed 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.045 -1.035 . . . . 1.23 110.064 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -87.18 138.41 31.51 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.122 -0.986 . . . . 1.73 111.434 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.576 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -99.27 120.05 38.92 Favored 'General case' 0 C--N 1.289 -2.053 0 N-CA-C 107.383 -1.34 . . . . 0.94 107.383 177.537 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -85.36 16.46 3.69 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 108.619 -0.882 . . . . 2.73 108.619 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.764 HG11 ' CG ' ' A' ' 80' ' ' HIS . 20.1 t -95.25 -57.16 4.58 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.746 0 CA-C-O 121.622 0.725 . . . . 1.44 109.151 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.8 p -115.16 -7.65 12.42 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.495 -0.753 . . . . 0.98 111.775 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.4 -3.42 56.51 Favored Glycine 0 N--CA 1.509 3.503 0 O-C-N 120.143 -1.598 . . . . 0.69 112.779 177.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.7 tttp -84.26 153.44 23.57 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.266 -1.726 . . . . 2.33 111.885 -177.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -121.03 145.09 48.14 Favored 'General case' 0 N--CA 1.514 2.768 0 O-C-N 121.753 -0.592 . . . . 1.07 110.935 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.443 ' HZ ' ' CE1' ' A' ' 76' ' ' HIS . 31.3 m-85 -128.05 161.85 28.22 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 122.128 0.966 . . . . 1.67 112.689 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.9 t -84.86 -35.7 22.05 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 115.536 -0.756 . . . . 1.7 110.239 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -113.87 141.69 47.02 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 120.929 -1.107 . . . . 2.23 110.746 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.5 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.4 OUTLIER -63.04 -46.23 88.53 Favored 'General case' 0 C--O 1.202 -1.414 0 N-CA-C 108.03 -1.1 . . . . 2.66 108.03 178.219 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.457 ' C ' ' O ' ' A' ' 70' ' ' SER . 91.9 p -44.16 -39.59 4.43 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.023 -1.048 . . . . 2.76 108.695 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -76.29 -32.97 59.07 Favored 'General case' 0 C--N 1.293 -1.856 0 C-N-CA 118.783 -1.167 . . . . 2.42 108.721 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.5 ' N ' ' O ' ' A' ' 70' ' ' SER . 26.4 tp -70.33 -53.36 17.02 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 106.491 -1.67 . . . . 2.03 106.491 175.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.52 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 86.9 mt -46.97 -54.58 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 O-C-N 121.029 -1.045 . . . . 2.95 109.065 177.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.519 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 21.1 m -60.06 -46.64 88.89 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-O 122.539 1.161 . . . . 3.09 108.97 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.443 ' CE1' ' HZ ' ' A' ' 67' ' ' PHE . 26.4 t60 -56.02 -48.07 76.62 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.655 -0.702 . . . . 2.35 109.613 -179.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -33.02 73.56 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 119.932 -1.73 . . . . 2.39 107.621 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 35.0 mtp85 -54.34 -31.32 54.1 Favored 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 105.985 -1.857 . . . . 4.98 105.985 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -73.46 -49.89 24.48 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.223 -0.991 . . . . 3.18 108.765 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.764 ' CG ' HG11 ' A' ' 62' ' ' VAL . 61.5 m-70 -56.23 -61.67 2.23 Favored 'General case' 0 N--CA 1.501 2.08 0 C-N-CA 116.841 -1.943 . . . . 2.47 108.785 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 31.7 m -57.57 -53.1 61.99 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.264 -1.013 . . . . 3.27 108.264 -179.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.514 0 N-CA-C 109.363 -1.495 . . . . 3.59 109.363 179.862 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.538 ' CE1' ' N ' ' A' ' 14' ' ' SER . 0.9 OUTLIER . . . . . 0 N--CA 1.499 2.01 0 N-CA-C 108.517 -0.92 . . . . 2.01 108.517 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -107.53 135.61 48.7 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 122.539 1.161 . . . . 2.25 112.33 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.736 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 4.1 t -60.5 121.35 11.91 Favored 'General case' 0 N--CA 1.499 2.021 0 CA-C-N 114.625 -1.171 . . . . 1.74 109.432 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.7 mttp -94.8 28.5 2.67 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.204 -0.935 . . . . 2.44 108.828 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.3 mm -128.86 -63.38 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 N-CA-C 107.538 -1.282 . . . . 2.36 107.538 -178.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.636 ' N ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -126.4 45.98 2.55 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 124.015 1.864 . . . . 2.54 110.0 179.29 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 20.45 60.73 0.01 OUTLIER Glycine 0 CA--C 1.568 3.403 0 N-CA-C 121.525 3.37 . . . . 2.38 121.525 172.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.736 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 9.9 ttmm -115.07 139.89 49.5 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 105.663 -1.977 . . . . 2.27 105.663 171.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.3 t -93.52 145.05 24.8 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-O 122.438 1.113 . . . . 2.56 112.715 -177.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.519 ' HZ ' ' ND1' ' A' ' 20' ' ' HIS . 77.3 m-85 -127.16 130.27 49.46 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.912 0.863 . . . . 2.14 110.204 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -68.92 -27.93 66.21 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.948 -0.76 . . . . 3.29 108.948 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.459 ' HD3' HH11 ' A' ' 13' ' ' ARG . 0.4 OUTLIER -121.65 140.51 52.18 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 121.699 0.762 . . . . 3.55 109.624 -178.928 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.538 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 0.6 OUTLIER -60.2 -32.73 71.37 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 118.042 -1.463 . . . . 2.01 108.088 179.202 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 97.5 p -55.7 -60.95 2.72 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.192 -0.942 . . . . 2.71 109.069 -178.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.0 m -53.36 -32.12 47.82 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.517 -0.92 . . . . 2.37 108.517 179.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 tp -72.08 -39.72 68.76 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 118.077 -1.449 . . . . 1.37 107.657 177.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.736 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 58.6 m -53.01 -50.86 63.36 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.965 -1.084 . . . . 1.5 108.479 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.3 m -59.57 -36.63 76.58 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.975 0.893 . . . . 2.12 108.876 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.519 ' ND1' ' HZ ' ' A' ' 11' ' ' PHE . 23.4 t60 -69.01 -38.38 79.2 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 107.552 -1.277 . . . . 1.1 107.552 179.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.423 ' O ' ' N ' ' A' ' 24' ' ' HIS . 87.3 mt -67.41 -38.4 84.54 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 119.853 -1.78 . . . . 1.28 106.397 177.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.736 ' HG ' ' O ' ' A' ' 18' ' ' SER . 28.9 mt -56.17 -35.35 67.12 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 105.953 -1.869 . . . . 2.14 105.953 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.487 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 82.3 mt -61.07 -31.41 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 N-CA-C 107.256 -1.387 . . . . 1.18 107.256 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.423 ' N ' ' O ' ' A' ' 21' ' ' LEU . 87.8 m-70 -88.4 -19.51 26.49 Favored 'General case' 0 N--CA 1.514 2.774 0 C-N-CA 118.472 -1.291 . . . . 2.07 111.231 179.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.417 ' O ' ' C ' ' A' ' 26' ' ' ASP . 61.1 m -101.16 3.76 41.41 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 107.441 -1.318 . . . . 2.46 107.441 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.576 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER 41.03 53.97 3.31 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.875 -0.787 . . . . 1.96 108.875 -179.218 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.616 HG22 ' HD3' ' A' ' 29' ' ' PRO . 1.3 m -97.3 110.74 23.23 Favored 'General case' 0 N--CA 1.485 1.285 0 O-C-N 121.528 -0.732 . . . . 2.4 109.393 -179.123 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.431 ' HD3' ' O ' ' A' ' 27' ' ' THR . 19.2 mmt180 -129.51 63.33 67.47 Favored Pre-proline 0 N--CA 1.49 1.538 0 N-CA-C 107.996 -1.113 . . . . 2.94 107.996 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.616 ' HD3' HG22 ' A' ' 27' ' ' THR . 50.8 Cg_endo -72.56 17.63 0.36 Allowed 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 121.803 1.669 . . . . 1.45 113.973 -177.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -113.72 80.85 5.28 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 120.876 -1.14 . . . . 1.35 108.991 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.34 131.54 8.66 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 C-N-CA 122.109 1.873 . . . . 2.12 113.888 -178.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.429 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -58.94 149.29 27.58 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 121.696 0.76 . . . . 2.29 109.868 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -82.34 -15.44 52.85 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.77 -0.581 . . . . 3.89 112.45 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.545 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 3.9 m-85 -113.95 -50.67 2.81 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.224 -1.548 . . . . 2.88 113.37 -178.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 16.1 p -103.72 7.09 37.25 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.487 -1.383 . . . . 3.03 111.16 -177.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.542 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 73.85 -1.6 45.7 Favored Glycine 0 N--CA 1.492 2.427 0 O-C-N 121.29 -0.881 . . . . 2.64 114.312 176.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.542 ' O ' ' O ' ' A' ' 36' ' ' GLY . 11.8 mttp -41.89 166.0 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.212 0 CA-C-N 120.679 2.24 . . . . 3.06 108.85 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.423 ' N ' ' HE ' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -128.81 133.13 47.93 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.401 -0.963 . . . . 3.4 108.401 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -126.71 174.34 8.81 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.34 -0.85 . . . . 1.49 109.255 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.573 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -115.36 -7.26 12.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 122.0 -0.437 . . . . 2.07 110.505 -179.383 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.416 ' O ' ' C ' ' A' ' 42' ' ' LYS . 85.0 mt-30 -132.13 124.0 28.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.694 -1.254 . . . . 2.11 109.358 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.416 ' C ' ' O ' ' A' ' 41' ' ' GLN . 84.6 tttt -42.05 -65.15 0.49 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.129 -0.982 . . . . 1.95 110.257 -178.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.8 p -49.2 -32.98 11.39 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.733 -0.604 . . . . 1.09 111.101 -178.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.2 -48.63 70.01 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.752 -1.217 . . . . 1.9 107.744 177.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.541 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 10.8 tmm? -62.84 -46.84 86.05 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.472 -1.392 . . . . 0.95 108.617 177.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.499 ' O ' ' OG1' ' A' ' 49' ' ' THR . 35.1 mmtt -53.34 -41.21 65.53 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 120.87 -1.144 . . . . 2.03 108.711 -178.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -63.51 -32.82 74.38 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.168 -1.419 . . . . 1.65 107.168 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.703 ' O ' HG12 ' A' ' 51' ' ' ILE . 47.0 t60 -68.66 -61.25 1.9 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.896 -1.52 . . . . 1.78 106.896 176.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.501 ' O ' HG23 ' A' ' 53' ' ' THR . 24.1 p -41.9 -34.77 0.72 Allowed 'General case' 0 N--CA 1.486 1.35 0 O-C-N 120.323 -1.485 . . . . 1.07 109.281 178.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.605 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 5.2 m-30 -69.26 -32.27 71.35 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.806 -1.184 . . . . 0.86 108.918 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.703 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.0 pt -61.85 -34.16 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 C-N-CA 118.318 -1.353 . . . . 1.93 107.72 175.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -75.07 -27.72 60.06 Favored 'General case' 0 N--CA 1.51 2.548 0 C-N-CA 117.775 -1.57 . . . . 2.21 109.309 176.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.605 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 68.1 p -91.53 -2.06 57.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.16 -0.962 . . . . 1.31 110.279 -177.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.36 17.89 2.07 Favored Glycine 0 N--CA 1.502 3.038 0 N-CA-C 109.944 -1.262 . . . . 1.07 109.944 -177.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.611 ' O ' ' C ' ' A' ' 56' ' ' LYS . 77.4 mt-10 -75.74 20.27 0.18 Allowed 'General case' 0 N--CA 1.506 2.339 0 N-CA-C 115.836 1.791 . . . . 1.27 115.836 -176.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.611 ' C ' ' O ' ' A' ' 55' ' ' GLU . 3.0 mptp? -24.57 96.81 0.06 OUTLIER Pre-proline 0 N--CA 1.508 2.457 0 O-C-N 121.058 -1.026 . . . . 1.14 110.867 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.448 ' N ' ' O ' ' A' ' 55' ' ' GLU . 2.4 Cg_endo -78.86 -19.84 10.75 Favored 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 122.971 2.447 . . . . 0.73 112.431 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -81.65 102.65 10.82 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.908 -1.145 . . . . 0.74 107.908 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.672 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 86.5 mttt -104.55 118.02 35.55 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.915 -1.115 . . . . 0.94 111.595 -177.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 26.8 t -83.71 125.37 31.81 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.229 -0.919 . . . . 1.11 108.739 178.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.672 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 1.1 mm-40 -96.92 13.82 27.52 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.212 -0.93 . . . . 1.9 111.26 -177.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.728 HG11 ' CG ' ' A' ' 80' ' ' HIS . 97.1 t -87.13 -34.88 7.85 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.086 0 N-CA-C 106.338 -1.727 . . . . 1.65 106.338 178.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 26.6 p -123.58 -30.13 3.66 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 114.846 -1.07 . . . . 1.53 108.261 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.02 13.51 31.33 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 111.16 -0.776 . . . . 1.23 111.16 178.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -97.33 132.77 42.75 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.283 -1.716 . . . . 2.2 111.206 -177.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.19 148.24 23.07 Favored 'General case' 0 N--CA 1.508 2.456 0 CA-C-O 122.227 1.013 . . . . 0.76 113.685 -177.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.456 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 88.5 m-85 -128.92 151.13 49.98 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.992 0.901 . . . . 0.75 111.534 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.447 ' OG ' ' HG3' ' A' ' 69' ' ' GLN . 16.9 p -86.63 -10.35 54.04 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 115.798 -0.637 . . . . 1.19 109.768 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.447 ' HG3' ' OG ' ' A' ' 68' ' ' SER . 56.5 mt-30 -132.31 142.97 49.56 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.249 -0.907 . . . . 1.75 111.146 -177.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.7 p -66.51 -44.48 82.42 Favored 'General case' 0 C--O 1.198 -1.638 0 N-CA-C 107.174 -1.417 . . . . 1.12 107.174 177.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.2 t -52.41 -42.59 64.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.231 -0.918 . . . . 1.41 109.915 -179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.442 ' O ' ' HB3' ' A' ' 76' ' ' HIS . 2.9 m-20 -70.16 -30.29 67.4 Favored 'General case' 0 C--N 1.298 -1.674 0 C-N-CA 118.084 -1.446 . . . . 1.35 107.913 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.9 tp -73.49 -42.1 62.27 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.941 -1.133 . . . . 0.74 107.941 177.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 90.7 mt -59.67 -53.63 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 O-C-N 120.826 -1.171 . . . . 1.11 109.111 179.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 2.5 m -63.97 -48.98 74.33 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 122.374 1.083 . . . . 0.82 108.746 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.456 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 15.8 t60 -51.65 -45.47 63.38 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 123.079 1.418 . . . . 0.94 107.852 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 44.8 t -67.23 -35.61 79.93 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 120.581 -1.324 . . . . 1.21 108.288 178.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 82' ' ' GLY . 2.2 mmm180 -55.81 -35.14 66.0 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 106.986 -1.487 . . . . 2.36 106.986 178.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -63.98 -44.37 92.9 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.193 -1.403 . . . . 1.19 108.061 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.728 ' CG ' HG11 ' A' ' 62' ' ' VAL . 68.5 m-70 -57.44 -62.61 1.65 Allowed 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 116.139 -2.225 . . . . 1.5 108.304 178.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.446 ' O ' ' C ' ' A' ' 82' ' ' GLY . 29.4 p -80.19 21.48 0.59 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.516 -0.74 . . . . 1.56 109.509 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.494 2.548 0 N-CA-C 109.796 -1.321 . . . . 2.6 109.796 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.599 ' CB ' HD22 ' A' ' 17' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 CA-C-O 121.47 0.652 . . . . 1.15 109.569 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.505 ' OD2' ' N ' ' A' ' 5' ' ' LYS . 8.5 t70 -108.61 142.99 38.26 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 121.998 0.904 . . . . 2.37 110.269 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.522 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER -66.67 -36.48 82.63 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.142 -0.688 . . . . 2.2 109.142 179.212 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 4' ' ' CYS . 73.6 mttt 75.06 -23.81 0.23 Allowed 'General case' 0 N--CA 1.498 1.956 0 CA-C-O 121.037 0.446 . . . . 2.81 110.159 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.591 ' HB ' ' CD2' ' A' ' 24' ' ' HIS . 12.7 mm -67.84 -66.95 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 O-C-N 120.932 -1.105 . . . . 2.96 109.746 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.9 p -94.31 -24.5 17.39 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.275 -0.89 . . . . 3.14 109.95 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.94 38.51 1.69 Allowed Glycine 0 N--CA 1.496 2.695 0 C-N-CA 120.081 -1.057 . . . . 2.68 112.404 177.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.413 ' O ' ' OD1' ' A' ' 3' ' ' ASP . 19.0 ttmm -115.08 154.37 29.02 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.482 -1.599 . . . . 2.82 108.49 178.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.54 ' C ' ' CD1' ' A' ' 11' ' ' PHE . 44.8 m -112.04 163.7 13.98 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 122.112 0.958 . . . . 1.78 111.985 -177.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.636 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.2 m-85 -141.46 124.71 16.47 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 122.226 1.012 . . . . 1.25 110.738 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -68.67 -30.56 69.26 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 122.175 0.988 . . . . 2.04 109.158 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.95 132.79 56.37 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-N 115.646 -0.707 . . . . 2.51 109.296 -178.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.408 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 7.2 t -59.21 -30.41 68.21 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 118.741 -1.184 . . . . 1.65 109.903 -178.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.3 t -63.37 -47.53 81.71 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 120.278 -1.514 . . . . 2.34 109.365 -179.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.9 m -61.81 -30.73 71.01 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.312 -1.366 . . . . 1.36 107.312 179.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.599 HD22 ' CB ' ' A' ' 2' ' ' PHE . 11.5 tp -74.2 -35.84 63.95 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 107.022 -1.473 . . . . 1.04 107.022 177.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.6 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 32.7 t -56.42 -58.9 6.04 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.718 -1.239 . . . . 1.13 108.223 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.505 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 55.1 m -55.87 -38.77 70.57 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.726 0.774 . . . . 1.47 109.83 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.636 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 45.3 t60 -66.65 -44.37 82.07 Favored 'General case' 0 C--N 1.294 -1.843 0 O-C-N 120.742 -1.224 . . . . 1.68 108.247 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.7 mt -61.46 -29.75 70.16 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 106.363 -1.717 . . . . 1.28 106.363 178.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 18' ' ' SER . 21.9 mt -66.16 -29.9 70.27 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 106.621 -1.622 . . . . 1.04 106.621 177.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.432 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 88.4 mt -65.33 -36.58 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 O-C-N 120.577 -1.327 . . . . 2.13 108.304 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.591 ' CD2' ' HB ' ' A' ' 6' ' ' ILE . 72.1 m-70 -82.06 -28.99 32.11 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 118.149 -1.42 . . . . 2.15 110.563 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.449 ' OG ' ' OG1' ' A' ' 27' ' ' THR . 35.0 p -92.42 -1.82 56.74 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.681 -1.262 . . . . 1.07 108.22 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 48.4 m-20 44.5 65.35 1.08 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 115.95 -0.568 . . . . 1.04 110.134 -179.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.449 ' OG1' ' OG ' ' A' ' 25' ' ' SER . 0.6 OUTLIER -104.65 112.2 25.2 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.425 -0.954 . . . . 1.06 108.425 179.262 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.586 HH21 ' CG ' ' A' ' 40' ' ' HIS . 0.4 OUTLIER -124.16 72.7 56.53 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.311 -0.868 . . . . 2.36 108.81 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -74.43 9.77 1.74 Allowed 'Trans proline' 0 C--N 1.312 -1.38 0 C-N-CA 122.037 1.825 . . . . 1.61 113.514 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -114.49 81.73 7.11 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.005 -1.06 . . . . 1.92 108.656 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 50.0 Cg_endo -75.93 137.98 20.33 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.253 1.968 . . . . 1.84 113.037 -178.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.597 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -64.79 137.27 57.68 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 107.893 -1.151 . . . . 1.91 107.893 179.223 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.473 ' H ' ' CD ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -78.1 -15.04 59.23 Favored 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.497 -0.752 . . . . 2.78 110.663 -178.834 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.435 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 40.4 m-85 -110.97 -72.88 0.7 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.613 -1.304 . . . . 2.49 111.747 -178.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.554 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.9 p -85.16 2.04 45.38 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.071 -1.018 . . . . 2.69 111.472 -178.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.458 ' C ' ' HB3' ' A' ' 32' ' ' CYS . . . 80.84 -12.49 35.47 Favored Glycine 0 N--CA 1.504 3.19 0 O-C-N 120.94 -1.1 . . . . 2.24 114.289 175.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.597 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 1.8 mttm -47.58 119.39 2.71 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 119.561 1.68 . . . . 2.44 109.247 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.459 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 35.6 mtt180 -98.77 135.69 39.87 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.945 -1.097 . . . . 2.52 110.976 -178.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.516 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 28.2 m-85 -115.23 174.47 5.98 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.416 -0.803 . . . . 1.14 110.147 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.599 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -107.05 -19.68 13.54 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 116.306 -0.407 . . . . 1.76 110.751 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.53 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 48.8 mt-30 -114.46 110.48 19.91 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 120.718 -1.239 . . . . 2.83 110.032 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.491 ' C ' ' O ' ' A' ' 41' ' ' GLN . 44.6 tttp -34.33 -57.11 0.5 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.232 -0.917 . . . . 2.74 110.892 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.06 -33.79 63.03 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.408 -0.808 . . . . 2.53 111.073 -178.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.734 ' OD1' ' N ' ' A' ' 45' ' ' MET . 35.2 p30 -71.18 -37.5 72.15 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.181 -1.408 . . . . 2.2 108.072 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.734 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 9.9 ttp -67.71 -47.42 69.43 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 120.319 -1.488 . . . . 1.47 108.061 177.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.488 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 36.6 mttm -50.2 -41.23 49.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.636 -1.29 . . . . 2.66 107.565 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.592 ' O ' HG23 ' A' ' 51' ' ' ILE . 36.5 mttm -60.85 -35.06 75.6 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 106.709 -1.589 . . . . 3.38 106.709 178.01 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.712 ' O ' HG12 ' A' ' 51' ' ' ILE . 61.5 t60 -67.37 -67.64 0.44 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.494 -1.298 . . . . 1.42 107.494 177.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.488 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 32.0 p -40.75 -33.02 0.25 Allowed 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.657 -1.277 . . . . 0.84 110.546 178.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.566 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.4 m-85 -70.96 -35.83 72.31 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 120.804 -1.185 . . . . 1.68 109.352 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.712 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.1 pt -63.45 -29.19 46.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 C-N-CA 118.461 -1.295 . . . . 1.82 108.508 176.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -81.0 -29.44 35.21 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 120.315 -1.491 . . . . 1.74 109.92 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.566 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 75.0 p -91.29 2.29 56.49 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.237 -0.914 . . . . 0.83 112.181 -176.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 58.73 56.08 27.26 Favored Glycine 0 N--CA 1.486 2.033 0 N-CA-C 107.706 -2.157 . . . . 1.18 107.706 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.465 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 62.0 mt-10 -114.12 128.58 56.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.456 -1.026 . . . . 2.01 109.943 -178.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 68' ' ' SER . 38.1 mttm -143.29 67.27 16.72 Favored Pre-proline 0 C--N 1.304 -1.372 0 N-CA-C 108.754 -0.832 . . . . 1.69 108.754 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.48 -11.71 14.75 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 122.29 1.993 . . . . 1.56 112.532 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.537 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 94.5 m-70 -101.19 90.61 4.19 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.996 -1.113 . . . . 1.53 107.996 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 26.3 mtpt -91.99 125.82 36.83 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 121.799 0.809 . . . . 2.42 110.778 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.661 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 1.7 t -43.48 -91.52 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.837 -0.539 . . . . 1.38 110.718 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.661 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 6.6 mm-40 122.31 -20.9 0.01 OUTLIER 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 121.604 0.716 . . . . 2.22 110.574 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.401 ' HB ' ' NE2' ' A' ' 80' ' ' HIS . 21.8 t -87.98 -43.26 15.42 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.136 0 CA-C-O 122.038 0.923 . . . . 1.86 109.274 -179.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 18.8 p -122.92 -6.15 8.48 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.675 -0.693 . . . . 2.1 109.966 -178.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.49 29.58 32.52 Favored Glycine 0 N--CA 1.496 2.682 0 O-C-N 120.942 -1.099 . . . . 1.83 111.858 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 60' ' ' CYS . 6.6 tttp -101.29 157.22 16.95 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 105.558 -2.016 . . . . 2.42 105.558 176.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -131.97 152.18 51.27 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.462 -1.399 . . . . 1.38 112.966 -176.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.611 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 60.6 m-85 -134.71 138.93 44.82 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 122.151 0.977 . . . . 1.51 112.369 -178.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 34.0 p -68.89 -26.38 65.08 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.738 -1.208 . . . . 1.74 107.738 177.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -116.51 151.62 35.74 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 122.002 0.906 . . . . 2.56 112.851 -176.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.627 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.9 OUTLIER -78.29 -47.27 18.21 Favored 'General case' 0 C--O 1.19 -2.037 0 N-CA-C 107.57 -1.27 . . . . 2.11 107.57 175.399 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.577 ' C ' ' O ' ' A' ' 70' ' ' SER . 15.7 p -39.75 -41.4 1.09 Allowed 'General case' 0 C--N 1.301 -1.519 0 O-C-N 120.441 -1.412 . . . . 2.32 107.782 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -79.79 -31.99 40.82 Favored 'General case' 0 C--N 1.291 -1.94 0 C-N-CA 119.65 -0.82 . . . . 2.16 108.916 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.627 ' N ' ' O ' ' A' ' 70' ' ' SER . 30.7 tp -72.76 -40.78 65.73 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.601 -1.312 . . . . 1.38 108.553 177.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 97.2 mt -59.92 -52.19 64.04 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 O-C-N 120.937 -1.102 . . . . 2.1 108.255 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.2 m -60.33 -47.32 86.56 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.866 -1.146 . . . . 2.41 109.511 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.611 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 19.4 t60 -56.86 -39.95 75.25 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 122.419 1.104 . . . . 1.8 108.191 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 53.4 p -71.51 -34.39 70.06 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.898 -1.127 . . . . 1.74 108.684 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -57.83 -32.67 67.83 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.428 -1.323 . . . . 2.71 107.428 178.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -69.16 -48.26 62.75 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.904 -1.147 . . . . 3.5 107.904 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.401 ' NE2' ' HB ' ' A' ' 62' ' ' VAL . 50.9 m-70 -58.39 -55.25 37.42 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 117.283 -1.767 . . . . 2.34 109.247 178.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 60.6 m -56.98 -52.79 63.83 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.114 -1.034 . . . . 2.64 108.895 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.63 -1.388 . . . . 2.98 109.63 179.55 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.31 0.576 . . . . 2.41 109.828 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.622 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.2 m-85 -96.47 122.24 39.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.414 -0.804 . . . . 1.84 109.105 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.599 ' OD1' ' N ' ' A' ' 4' ' ' CYS . 45.5 t0 -107.25 133.38 51.9 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-O 123.013 1.387 . . . . 1.54 110.166 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.599 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 1.7 t -66.56 131.0 45.05 Favored 'General case' 0 C--N 1.288 -2.083 0 CA-C-N 113.682 -1.599 . . . . 1.01 110.327 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.33 32.11 1.82 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.409 -0.807 . . . . 2.54 110.162 -178.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.0 mm -126.81 -71.17 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 120.871 -1.143 . . . . 1.84 109.554 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.533 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 30.6 p -84.34 -50.67 7.61 Favored 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 119.325 -0.95 . . . . 2.08 108.479 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.533 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 123.34 52.24 0.2 Allowed Glycine 0 N--CA 1.496 2.661 0 C-N-CA 120.83 -0.7 . . . . 1.69 112.437 177.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -127.98 164.12 23.04 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.82 -1.4 . . . . 1.94 109.623 178.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.4 t -112.81 159.09 19.35 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.686 1.232 . . . . 2.02 113.198 -176.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 51.9 m-85 -139.16 125.36 20.13 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 114.968 -1.014 . . . . 1.73 109.784 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -68.29 -22.37 64.73 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 108.869 -0.789 . . . . 2.69 108.869 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.683 HH21 ' N ' ' A' ' 15' ' ' SER . 0.0 OUTLIER -119.5 133.45 55.68 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.034 -0.728 . . . . 3.61 109.034 -178.62 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.622 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 40.5 t -57.42 -33.36 67.81 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.004 -1.06 . . . . 1.87 108.259 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.683 ' N ' HH21 ' A' ' 13' ' ' ARG . 30.5 t -66.44 -39.41 88.88 Favored 'General case' 0 C--N 1.308 -1.213 0 O-C-N 121.626 -0.671 . . . . 2.18 110.301 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -34.35 77.89 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 106.473 -1.677 . . . . 2.02 106.473 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.0 tp -70.6 -43.44 69.34 Favored 'General case' 0 C--O 1.202 -1.411 0 N-CA-C 106.256 -1.757 . . . . 1.19 106.256 176.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.635 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 16.4 t -49.93 -62.62 1.46 Allowed 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.529 -1.357 . . . . 2.24 109.451 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 88.0 m -54.19 -36.57 63.57 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 122.414 1.102 . . . . 1.49 108.757 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 49.9 t60 -65.47 -46.38 80.03 Favored 'General case' 0 C--N 1.284 -2.243 0 O-C-N 121.097 -1.002 . . . . 1.09 109.311 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 78.5 mt -60.91 -27.69 68.37 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 106.861 -1.533 . . . . 0.52 106.861 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 18' ' ' SER . 27.4 mt -70.03 -27.35 64.59 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 107.253 -1.388 . . . . 1.01 107.253 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.423 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 95.3 mt -65.41 -39.96 86.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 O-C-N 120.507 -1.37 . . . . 1.22 108.111 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -73.22 -47.31 44.44 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 117.813 -1.555 . . . . 1.29 108.763 177.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.506 ' OG ' ' OG1' ' A' ' 27' ' ' THR . 25.7 p -73.89 -3.31 28.07 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 120.564 -1.335 . . . . 1.71 110.033 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 44.4 63.51 1.63 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.575 -0.703 . . . . 1.82 109.786 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.506 ' OG1' ' OG ' ' A' ' 25' ' ' SER . 1.3 m -101.27 111.86 24.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.968 -1.082 . . . . 1.02 108.651 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.423 ' HE ' ' HB3' ' A' ' 40' ' ' HIS . 4.6 mmt85 -126.0 71.98 69.59 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.432 -0.792 . . . . 1.31 109.989 -178.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -73.94 12.15 1.02 Allowed 'Trans proline' 0 C--N 1.308 -1.583 0 C-N-CA 121.954 1.769 . . . . 1.26 113.789 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.411 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 61.6 m-85 -117.23 87.11 22.71 Favored Pre-proline 0 N--CA 1.501 2.108 0 N-CA-C 108.046 -1.094 . . . . 1.57 108.046 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -84.96 131.12 4.29 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.642 2.228 . . . . 1.15 113.047 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.582 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 1.1 t -51.51 140.59 17.67 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-O 121.927 0.87 . . . . 0.97 108.799 177.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.476 HE21 HG21 ' A' ' 49' ' ' THR . 0.1 OUTLIER -80.16 -17.32 52.79 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.861 -0.792 . . . . 3.19 108.861 179.632 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.569 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 30.5 m-85 -110.58 -76.75 0.6 Allowed 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 119.101 -1.04 . . . . 1.15 112.424 -178.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.544 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 14.8 p -81.77 20.98 0.88 Allowed 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 122.406 1.098 . . . . 1.07 110.714 -177.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.432 ' O ' ' C ' ' A' ' 37' ' ' LYS . . . 48.48 9.53 0.09 OUTLIER Glycine 0 N--CA 1.508 3.458 0 N-CA-C 115.513 0.965 . . . . 0.9 115.513 176.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.582 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 13.1 mttp -54.35 174.95 0.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 122.503 3.152 . . . . 0.82 107.802 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 83.8 mtm-85 -134.13 131.64 38.94 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.977 -1.077 . . . . 1.77 109.853 -178.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.404 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 55.5 m-85 -123.44 165.08 17.67 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.74 -0.837 . . . . 0.85 108.74 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.611 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -108.96 12.76 25.13 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.772 -0.58 . . . . 1.17 109.98 179.78 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -144.77 113.35 6.67 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.868 -1.145 . . . . 1.74 109.74 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.411 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 57.8 tttm -37.88 -72.2 0.06 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.324 -0.86 . . . . 2.81 112.984 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 85.5 p -47.37 -34.98 7.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.367 -0.833 . . . . 1.45 111.205 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -67.92 -40.3 83.41 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 117.524 -1.67 . . . . 1.17 107.395 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.691 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 11.1 tmm? -66.55 -47.15 73.75 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 120.711 -1.243 . . . . 1.35 107.974 176.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.497 ' O ' ' OG1' ' A' ' 49' ' ' THR . 6.0 tptp -54.07 -37.61 64.4 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.012 -1.055 . . . . 1.6 108.531 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.506 ' NZ ' ' CB ' ' A' ' 47' ' ' LYS . 8.2 mtmp? -67.25 -29.19 68.74 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 106.14 -1.8 . . . . 2.17 106.14 177.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.691 ' HB3' ' O ' ' A' ' 45' ' ' MET . 61.4 t60 -68.22 -66.31 0.58 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 106.776 -1.564 . . . . 0.47 106.776 175.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 41.1 p -38.92 -33.04 0.1 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.732 -1.23 . . . . 0.78 111.667 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.602 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.9 m-30 -75.16 -37.85 61.13 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.224 -0.658 . . . . 0.89 109.224 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.688 HD13 ' OP2' ' B' ' 106' ' ' ' DA' . 14.9 pt -59.07 -24.1 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 105.017 -2.216 . . . . 0.61 105.017 176.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.914 ' O ' ' N ' ' A' ' 54' ' ' GLY . 83.4 m-70 -80.11 -103.12 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 101.514 -3.513 . . . . 0.77 101.514 170.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.602 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 72.7 p -8.68 -37.03 0.0 OUTLIER 'General case' 0 N--CA 1.518 2.927 0 C-N-CA 124.134 0.974 . . . . 0.77 112.6 -175.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.914 ' N ' ' O ' ' A' ' 52' ' ' HIS . . . 98.99 21.18 16.31 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 110.591 -1.004 . . . . 0.51 110.591 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.483 ' HB2' ' CG ' ' A' ' 50' ' ' PHE . 30.1 mt-10 -82.51 125.64 31.34 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.481 -1.011 . . . . 1.6 112.673 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -134.71 73.92 66.09 Favored Pre-proline 0 N--CA 1.504 2.248 0 N-CA-C 108.493 -0.929 . . . . 2.61 108.493 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -61.11 -11.13 17.37 Favored 'Trans proline' 0 N--CA 1.496 1.619 0 C-N-CA 124.131 3.221 . . . . 0.64 113.964 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -99.65 93.21 5.72 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 118.852 -1.139 . . . . 0.85 109.603 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.51 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 48.9 mtmt -93.94 123.27 37.19 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.662 -0.815 . . . . 2.29 111.752 -178.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.502 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -80.4 121.07 25.26 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 106.052 -1.833 . . . . 0.67 106.052 176.478 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 7.1 mm-40 -85.58 14.83 5.15 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 120.761 -1.212 . . . . 1.71 108.194 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.691 HG11 ' CG ' ' A' ' 80' ' ' HIS . 21.2 t -93.77 -56.94 4.72 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.723 0 C-N-CA 120.083 -0.647 . . . . 1.03 110.136 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.0 p -121.24 25.65 9.39 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.273 -0.892 . . . . 1.14 111.024 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 58.49 30.94 65.78 Favored Glycine 0 N--CA 1.494 2.524 0 O-C-N 120.856 -1.152 . . . . 0.97 112.706 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.5 ttmp? -107.3 152.7 23.77 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-N 118.998 1.399 . . . . 1.46 108.511 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -126.5 150.51 48.7 Favored 'General case' 0 N--CA 1.502 2.156 0 CA-C-O 121.807 0.813 . . . . 0.69 111.738 -177.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.539 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 82.7 m-85 -134.34 153.41 51.9 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 122.425 1.107 . . . . 0.97 113.404 -177.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.0 m -78.29 -41.1 34.88 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 115.47 -0.786 . . . . 1.51 108.907 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -103.78 144.75 31.07 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 121.926 0.869 . . . . 2.75 110.56 -177.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.537 ' O ' ' N ' ' A' ' 73' ' ' LEU . 27.9 p -70.61 -45.66 64.85 Favored 'General case' 0 C--O 1.195 -1.804 0 N-CA-C 106.951 -1.5 . . . . 1.14 106.951 178.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.58 ' OG ' ' N7 ' ' C' ' 210' ' ' ' DA' . 0.4 OUTLIER -47.01 -43.15 19.25 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.237 -1.023 . . . . 1.47 108.237 179.164 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -69.66 -32.87 71.77 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 107.383 -1.34 . . . . 1.41 107.383 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 70' ' ' SER . 16.2 tp -68.91 -57.54 5.37 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 106.436 -1.69 . . . . 0.68 106.436 176.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.431 ' N ' ' O ' ' A' ' 70' ' ' SER . 79.2 mt -42.9 -57.38 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 O-C-N 121.0 -1.062 . . . . 1.05 110.185 178.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.7 m -59.21 -41.82 89.48 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.015 -1.053 . . . . 1.24 108.659 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.539 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 22.7 t60 -59.93 -43.74 94.76 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 122.216 1.007 . . . . 0.84 108.37 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.9 t -68.29 -36.4 79.32 Favored 'General case' 0 C--N 1.309 -1.164 0 O-C-N 120.875 -1.141 . . . . 0.59 108.123 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 85.5 mtt-85 -54.75 -38.57 67.33 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 107.597 -1.26 . . . . 1.98 107.597 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 34.7 mttp -64.99 -43.88 91.12 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 118.714 -1.195 . . . . 2.09 107.98 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.691 ' CG ' HG11 ' A' ' 62' ' ' VAL . 49.9 m-70 -62.15 -44.37 96.77 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 117.186 -1.806 . . . . 0.91 108.713 177.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.1 m -51.64 -57.08 10.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.625 -0.672 . . . . 0.95 109.564 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 109.513 -1.435 . . . . 1.87 109.513 179.876 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.956 0 O4'-C4'-C3' 107.262 1.662 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.858 0 O4'-C4'-C3' 107.122 1.522 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' ' DT' . . . . . 0.462 ' O4 ' ' N6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.732 0 C1'-O4'-C4' 106.19 -2.507 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' ' DA' . . . . . 0.577 ' C6 ' ' C5 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.031 0 O4'-C4'-C3' 107.083 1.483 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' ' DA' . . . . . 0.577 ' C5 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.221 0 C1'-O4'-C4' 107.584 -1.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.688 ' OP2' HD13 ' A' ' 51' ' ' ILE . . . . . . . . 0 C5'--C4' 1.526 1.925 0 P-O3'-C3' 122.493 2.328 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.54 2.219 0 C1'-O4'-C4' 106.364 -2.383 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' ' DC' . . . . . 0.566 ' O2 ' ' H2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.79 0 O4'-C4'-C3' 107.154 1.554 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' ' DA' . . . . . 0.596 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.515 0 C1'-O4'-C4' 107.524 -1.554 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' ' DC' . . . . . 0.596 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.038 0 P-O3'-C3' 121.986 1.905 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.538 1.977 0 C1'-O4'-C4' 107.41 -1.636 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' ' DG' . . . . . 0.51 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.777 0 O4'-C4'-C3' 107.392 1.792 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.51 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.991 0 O4'-C4'-C3' 107.049 1.449 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.906 0 C4'-C3'-C2' 104.936 1.736 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.815 0 C4'-C3'-C2' 104.826 1.626 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.953 0 O4'-C4'-C3' 107.272 1.672 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.835 0 O4'-C4'-C3' 107.225 1.625 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.828 0 C4'-C3'-C2' 104.862 1.662 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.9 0 C1'-O4'-C4' 107.194 -1.79 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.988 0 C1'-O4'-C4' 107.451 -1.607 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.751 0 C4'-C3'-C2' 104.794 1.594 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.888 0 O4'-C4'-C3' 107.392 1.792 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.959 0 O4'-C4'-C3' 107.292 1.692 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.005 0 C1'-O4'-C4' 106.846 -2.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 209' ' ' ' DG' . . . . . 0.57 ' N2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.535 1.698 0 C4'-C3'-C2' 104.881 1.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 210' ' ' ' DA' . . . . . 0.595 ' C2 ' ' C2 ' ' C' ' 211' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.531 1.307 0 O4'-C4'-C3' 107.319 1.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 211' ' ' ' DT' . . . . . 0.595 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.425 -1.937 0 C1'-O4'-C4' 106.278 -2.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 212' ' ' ' DT' . . . . . 0.439 ' C2 ' ' C6 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.534 1.59 0 C1'-O4'-C4' 106.685 -2.153 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 213' ' ' ' DT' . . . . . 0.455 ' O4 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.75 0 C1'-O4'-C4' 107.089 -1.865 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 214' ' ' ' DA' . . . . . 0.455 ' N6 ' ' O4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.139 0 O4'-C4'-C3' 107.169 1.569 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 215' ' ' ' DT' . . . . . 0.409 ' C4 ' ' C5 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.023 0 C1'-O4'-C4' 107.195 -1.789 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.024 0 O4'-C4'-C3' 107.287 1.687 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 78.1 p . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.352 -0.611 . . . . 1.46 109.352 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.62 ' CE1' ' N ' ' A' ' 14' ' ' SER . 4.2 m-85 -85.88 128.42 34.82 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.183 -0.948 . . . . 1.18 108.723 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.618 ' OD1' ' N ' ' A' ' 4' ' ' CYS . 61.3 t0 -108.19 136.55 47.66 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.816 1.294 . . . . 1.38 110.85 -179.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.618 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 1.7 t -68.54 126.57 30.08 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 114.589 -1.187 . . . . 0.5 109.386 178.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.524 ' HD2' ' H ' ' A' ' 5' ' ' LYS . 2.3 mptt -92.59 26.69 2.56 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.359 -0.838 . . . . 1.53 109.308 -178.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.438 HD12 ' CD2' ' A' ' 24' ' ' HIS . 74.7 mt -125.27 -72.04 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.37 -0.831 . . . . 1.05 111.247 -179.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 29.7 p -86.54 -45.73 10.81 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.694 -1.254 . . . . 0.83 110.899 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.401 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 126.17 45.5 0.23 Allowed Glycine 0 N--CA 1.5 2.905 0 O-C-N 121.1 -1.0 . . . . 0.54 112.267 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -127.28 156.0 42.62 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.972 -1.311 . . . . 1.25 108.918 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.433 ' C ' ' CD1' ' A' ' 11' ' ' PHE . 54.4 m -113.32 165.15 12.71 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.64 -1.288 . . . . 0.86 112.579 -176.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.553 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 46.4 m-85 -142.12 124.81 15.91 Favored 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 121.665 0.745 . . . . 0.93 110.72 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -62.44 -24.57 67.5 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.775 -0.824 . . . . 1.99 108.775 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.431 ' NH2' ' O6 ' ' C' ' 204' ' ' ' DG' . 2.9 mmm180 -119.64 138.39 53.28 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.182 -0.673 . . . . 2.89 109.182 -179.115 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.62 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 1.0 OUTLIER -64.44 -37.79 88.77 Favored 'General case' 0 C--N 1.301 -1.504 0 C-N-CA 118.991 -1.084 . . . . 1.09 108.834 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.4 p -55.81 -48.89 74.62 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 107.799 -1.186 . . . . 1.18 107.799 178.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -36.53 70.27 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 107.671 -1.233 . . . . 1.07 107.671 178.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 tp -70.95 -34.85 71.87 Favored 'General case' 0 C--O 1.201 -1.472 0 N-CA-C 107.312 -1.366 . . . . 0.63 107.312 177.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.588 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 18.5 p -58.98 -60.6 3.61 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.038 -1.038 . . . . 1.16 108.888 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.481 ' N ' ' OG ' ' A' ' 18' ' ' SER . 68.3 m -52.8 -34.39 53.31 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 122.063 0.935 . . . . 0.74 108.518 179.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.553 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 63.1 t60 -68.39 -45.81 71.71 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-O 122.809 1.29 . . . . 0.65 108.323 178.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 21' ' ' LEU . 38.1 mt -58.05 -35.82 71.89 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 106.753 -1.573 . . . . 0.65 106.753 178.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 18' ' ' SER . 13.3 mt -62.86 -35.63 80.61 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.466 -0.939 . . . . 0.84 108.466 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.692 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 67.9 mt -57.58 -34.93 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 O-C-N 120.322 -1.486 . . . . 1.05 108.548 177.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.438 ' CD2' HD12 ' A' ' 6' ' ' ILE . 88.9 m-70 -81.15 -36.08 30.69 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.431 -1.308 . . . . 1.15 111.497 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.637 ' O ' ' CG ' ' A' ' 26' ' ' ASP . 1.3 m -83.56 -59.86 2.31 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.421 -1.424 . . . . 1.22 108.649 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.637 ' CG ' ' O ' ' A' ' 25' ' ' SER . 3.3 p-10 97.66 54.63 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.966 0 CA-C-O 122.039 0.923 . . . . 2.33 110.19 178.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.583 HG21 HD13 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -63.84 -46.83 83.28 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.3 -0.875 . . . . 1.04 108.944 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.499 ' NH1' ' ND1' ' A' ' 40' ' ' HIS . 0.4 OUTLIER 36.33 65.83 2.05 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.558 -0.714 . . . . 0.94 110.374 179.586 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -88.94 12.29 2.78 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.595 2.197 . . . . 0.7 113.752 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.414 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 69.8 m-85 -117.45 86.15 21.88 Favored Pre-proline 0 N--CA 1.498 1.973 0 O-C-N 121.009 -1.057 . . . . 0.63 109.354 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -84.99 130.96 4.22 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 123.043 2.495 . . . . 0.85 114.063 -178.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.53 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.8 OUTLIER -53.04 139.43 28.16 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 122.1 0.952 . . . . 0.83 110.376 179.025 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.601 ' H ' ' NE2' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -81.64 -20.96 38.56 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.485 -0.779 . . . . 1.13 110.201 179.711 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.53 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 22.4 m-85 -103.95 -73.38 0.67 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.632 -1.292 . . . . 0.99 111.993 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.465 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 20.4 p -78.83 -19.48 51.94 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.849 -1.157 . . . . 1.04 112.139 -177.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.27 -7.67 58.51 Favored Glycine 0 N--CA 1.509 3.562 0 O-C-N 120.405 -1.434 . . . . 0.91 115.18 175.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -51.15 168.42 0.06 Allowed 'General case' 0 N--CA 1.502 2.155 0 CA-C-N 121.126 2.463 . . . . 2.38 109.522 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.463 ' N ' ' NE ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -125.8 133.21 52.09 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.719 -1.238 . . . . 1.47 109.08 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -118.95 166.53 12.73 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.482 -0.761 . . . . 0.51 109.885 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.521 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -102.81 2.71 35.87 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.796 -0.565 . . . . 0.79 111.036 -179.601 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' A' ' 42' ' ' LYS . 38.8 mt-30 -146.62 118.08 7.96 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.467 -1.395 . . . . 1.15 111.055 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 41' ' ' GLN . 37.4 tttm -37.08 -69.46 0.11 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.458 -0.776 . . . . 2.07 111.895 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.1 m -48.07 -27.79 2.5 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.843 -1.16 . . . . 1.35 110.682 -178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -74.75 -40.18 61.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.994 -1.066 . . . . 0.83 108.172 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.672 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 4.8 tmm? -68.6 -47.44 66.69 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.379 -1.451 . . . . 0.64 107.472 176.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -52.56 -37.55 58.09 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.416 -1.327 . . . . 1.68 107.416 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.52 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.5 mtpt -63.13 -32.84 74.32 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 105.351 -2.092 . . . . 1.12 105.351 176.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.672 ' HB3' ' O ' ' A' ' 45' ' ' MET . 65.0 t60 -69.54 -63.83 1.0 Allowed 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 107.813 -1.18 . . . . 0.61 107.813 177.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.469 ' C ' ' O ' ' A' ' 48' ' ' HIS . 70.5 p -39.9 -38.31 0.67 Allowed 'General case' 0 N--CA 1.482 1.154 0 O-C-N 120.4 -1.438 . . . . 0.51 110.249 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.613 ' CE1' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-85 -70.26 -35.17 73.6 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.166 -0.959 . . . . 0.51 109.503 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.629 HD13 ' OP2' ' B' ' 106' ' ' ' DA' . 4.4 pt -57.45 -21.25 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 C-N-CA 118.158 -1.417 . . . . 0.7 107.392 176.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . 0.286 77.9 m-70 -94.22 -35.86 12.28 Favored 'General case' 0 N--CA 1.53 3.556 0 O-C-N 120.917 -1.115 . . . . 0.77 112.998 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.465 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 68.6 p -74.67 -17.67 60.64 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.748 0.785 . . . . 0.65 109.094 -176.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.63 7.6 68.8 Favored Glycine 0 C--N 1.292 -1.876 0 N-CA-C 107.941 -2.064 . . . . 0.59 107.941 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.613 ' OE1' ' CE1' ' A' ' 50' ' ' PHE . 91.8 mt-10 -73.48 115.41 12.83 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 122.313 1.054 . . . . 1.53 112.409 -177.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 56.0 mttm -125.2 68.77 58.46 Favored Pre-proline 0 N--CA 1.495 1.818 0 N-CA-C 108.597 -0.89 . . . . 1.67 108.597 177.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.461 ' HD3' ' C ' ' A' ' 55' ' ' GLU . 31.6 Cg_exo -56.69 -10.55 5.45 Favored 'Trans proline' 0 N--CA 1.503 2.074 0 C-N-CA 123.425 2.75 . . . . 0.75 114.487 -179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.588 ' CE1' ' OG ' ' A' ' 70' ' ' SER . 98.7 m-70 -99.42 85.84 3.25 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.474 -1.391 . . . . 1.02 109.288 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -84.41 124.76 31.67 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.368 -0.833 . . . . 2.52 110.072 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.673 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 0.5 OUTLIER -54.41 -89.02 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.785 0 O-C-N 121.864 -0.523 . . . . 0.89 110.02 179.24 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.673 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 3.9 mm-40 120.06 -10.17 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.372 0 CA-C-O 121.79 0.805 . . . . 1.85 110.238 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.493 HG11 ' CG ' ' A' ' 80' ' ' HIS . 14.5 t -94.69 -53.21 8.6 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.21 0 CA-C-O 122.006 0.908 . . . . 1.35 108.631 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 26.8 p -108.48 -8.67 15.5 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.913 -0.585 . . . . 1.48 110.135 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.68 33.39 16.21 Favored Glycine 0 N--CA 1.498 2.795 0 O-C-N 121.17 -0.956 . . . . 1.06 113.123 177.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.474 ' NZ ' ' OP1' ' B' ' 104' ' ' ' DA' . 11.1 tttm -109.32 174.53 5.82 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.356 -1.673 . . . . 2.5 108.117 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -137.41 156.36 48.29 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.398 -1.439 . . . . 0.8 111.79 -177.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -137.75 147.77 45.01 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 122.522 1.153 . . . . 0.99 113.758 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.0 m -81.21 -27.15 35.41 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 115.023 -0.99 . . . . 1.39 109.428 178.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -120.67 144.15 48.34 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 118.916 -1.114 . . . . 3.01 111.0 -178.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.588 ' OG ' ' CE1' ' A' ' 58' ' ' HIS . 17.1 m -65.12 -42.6 93.77 Favored 'General case' 0 C--O 1.197 -1.674 0 C-N-CA 119.248 -0.981 . . . . 1.45 108.831 178.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.8 m -50.34 -44.26 54.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.038 -1.039 . . . . 1.71 108.524 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -69.04 -33.61 73.87 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 118.48 -1.288 . . . . 2.21 108.731 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.436 HD22 ' HB3' ' A' ' 58' ' ' HIS . 21.2 tp -73.05 -47.16 47.14 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.414 -1.429 . . . . 0.85 108.907 177.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.451 ' O ' ' HG3' ' A' ' 78' ' ' ARG . 67.8 mt -55.01 -52.68 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.544 -1.347 . . . . 1.54 108.307 178.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.668 HG22 ' NZ ' ' A' ' 79' ' ' LYS . 91.8 m -59.14 -47.96 83.37 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 118.878 -1.129 . . . . 1.51 108.182 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.2 t60 -54.75 -49.23 71.36 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.752 0.787 . . . . 0.82 109.84 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.0 t -67.89 -31.22 70.85 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.382 -1.449 . . . . 0.66 108.928 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 44.5 mtp180 -61.42 -31.63 71.57 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 106.805 -1.554 . . . . 2.75 106.805 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.668 ' NZ ' HG22 ' A' ' 75' ' ' THR . 61.5 mttp -67.42 -46.32 73.51 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 107.255 -1.387 . . . . 2.64 107.255 177.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.493 ' CG ' HG11 ' A' ' 62' ' ' VAL . 58.1 m-70 -59.98 -65.94 0.6 Allowed 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 117.383 -1.727 . . . . 0.83 109.275 178.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.5 m -54.74 -55.25 31.92 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.714 -0.616 . . . . 0.75 110.03 -178.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.518 0 N-CA-C 109.243 -1.543 . . . . 1.46 109.243 179.828 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.803 0 C4'-C3'-C2' 104.883 1.683 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' ' DA' . . . . . 0.498 ' N6 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.965 0 O4'-C4'-C3' 107.509 1.909 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' ' DT' . . . . . 0.544 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.747 0 C1'-O4'-C4' 105.801 -2.785 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' ' DA' . . . . . 0.544 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.97 0 C1'-O4'-C4' 107.577 -1.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' ' DA' . . . . . 0.429 ' C4 ' ' C2 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.116 0 O4'-C4'-C3' 107.151 1.551 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.629 ' OP2' HD13 ' A' ' 51' ' ' ILE . . . . . . . . 0 C5'--C4' 1.525 1.72 0 O4'-C4'-C3' 107.1 1.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' ' DT' . . . . . 0.406 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.902 0 C1'-O4'-C4' 106.279 -2.444 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' ' DC' . . . . . 0.692 " H3'" HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C5'--C4' 1.526 1.891 0 C1'-O4'-C4' 107.334 -1.69 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' ' DA' . . . . . 0.565 ' C2 ' ' N2 ' ' C' ' 209' ' ' ' DG' . . . . . . . . 0 P--O5' 1.605 1.186 0 P-O3'-C3' 121.309 1.341 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' ' DC' . . . . . 0.555 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.823 0 O4'-C4'-C3' 107.174 1.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.971 0 C1'-O4'-C4' 106.619 -2.201 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' ' DG' . . . . . 0.477 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.994 0 O4'-C4'-C3' 107.468 1.868 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.477 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O4'-C4'-C3' 107.318 1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.877 0 C4'-C3'-C2' 104.783 1.583 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.766 0 O4'-C4'-C3' 107.26 1.66 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.085 0 O4'-C4'-C3' 107.277 1.677 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.828 0 O4'-C4'-C3' 107.176 1.576 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.964 0 C4'-C3'-C2' 104.848 1.648 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 203' ' ' ' DG' . . . . . 0.554 ' C2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.906 0 C4'-C3'-C2' 104.828 1.628 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 204' ' ' ' DG' . . . . . 0.554 ' C4 ' ' C2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.899 0 C4'-C3'-C2' 104.806 1.606 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.853 0 O4'-C4'-C3' 107.321 1.721 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.702 0 O4'-C4'-C3' 107.218 1.618 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.915 0 O4'-C4'-C3' 107.125 1.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.779 0 C4'-C3'-C2' 104.792 1.592 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 209' ' ' ' DG' . . . . . 0.565 ' N2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.701 0 C1'-O4'-C4' 107.549 -1.536 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 210' ' ' ' DA' . . . . . 0.592 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.754 0 O4'-C4'-C3' 107.498 1.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 211' ' ' ' DT' . . . . . 0.533 ' C4 ' ' C6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.423 -2.092 0 C1'-O4'-C4' 106.676 -2.16 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.869 0 C1'-O4'-C4' 106.927 -1.98 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 213' ' ' ' DT' . . . . . 0.43 ' O4 ' ' O4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.426 -1.799 0 C4'-C3'-C2' 104.968 1.768 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 214' ' ' ' DA' . . . . . 0.498 ' N6 ' ' N6 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.861 0 O4'-C4'-C3' 107.383 1.783 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.89 0 C1'-O4'-C4' 107.189 -1.793 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.936 0 O4'-C4'-C3' 107.252 1.652 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 94.8 p . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.464 0.65 . . . . 1.16 110.349 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.598 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.5 m-85 -94.23 126.98 39.81 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.711 -0.848 . . . . 0.88 108.711 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.14 112.08 21.17 Favored 'General case' 0 N--CA 1.512 2.627 0 CA-C-O 122.797 1.284 . . . . 1.78 113.5 -176.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 0.1 OUTLIER -48.1 131.33 15.94 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-N 114.372 -1.286 . . . . 0.82 111.478 179.362 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -90.61 -22.36 21.26 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.649 -0.657 . . . . 2.42 112.003 -178.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.753 ' N ' HD12 ' A' ' 6' ' ' ILE . 1.1 mp -74.82 -69.29 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 O-C-N 120.253 -1.529 . . . . 0.91 111.479 -177.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.0 p -92.14 -18.77 23.05 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.727 -1.233 . . . . 0.87 110.018 -178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.86 51.59 2.8 Favored Glycine 0 N--CA 1.502 3.074 0 C-N-CA 119.999 -1.096 . . . . 0.83 114.552 175.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.401 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 27.9 mttp -121.63 160.89 23.45 Favored 'General case' 0 N--CA 1.513 2.682 0 CA-C-N 119.603 1.702 . . . . 1.27 108.251 176.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 36.8 m -112.42 149.83 31.99 Favored 'General case' 0 N--CA 1.51 2.566 0 CA-C-O 122.51 1.148 . . . . 1.33 113.7 -175.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.543 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.6 m-85 -130.33 123.3 29.67 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.176 -0.92 . . . . 0.77 110.484 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.496 ' N ' ' CD ' ' A' ' 12' ' ' LYS . 11.6 mptt -63.46 -20.64 65.75 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 109.091 -0.707 . . . . 3.25 109.091 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.69 ' HB2' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -121.26 137.25 54.77 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.679 -0.638 . . . . 1.27 109.625 -178.231 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.598 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 0.0 OUTLIER -61.36 -34.7 75.74 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 118.887 -1.125 . . . . 0.69 107.99 179.575 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.8 t -63.32 -44.58 94.56 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.682 -0.636 . . . . 1.07 110.139 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.69 ' OG1' ' HB2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -62.27 -32.8 73.56 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 106.637 -1.616 . . . . 0.56 106.637 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.9 tp -72.63 -35.87 67.91 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.527 -1.286 . . . . 0.64 107.527 177.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.458 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 18.5 m -59.31 -59.13 5.95 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.802 -1.186 . . . . 0.55 108.726 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 80.4 m -53.71 -35.73 61.47 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.102 -1.073 . . . . 0.46 108.102 178.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.543 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 55.1 t60 -66.34 -47.65 72.79 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 122.262 1.029 . . . . 0.45 108.719 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 49.3 mt -58.42 -29.97 66.52 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 107.545 -1.28 . . . . 0.58 107.545 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 18' ' ' SER . 86.7 mt -73.3 -27.76 61.72 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 107.724 -1.213 . . . . 0.5 107.724 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.438 HG12 HH22 ' A' ' 28' ' ' ARG . 72.4 mt -63.02 -33.78 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 106.988 -1.486 . . . . 0.53 106.988 177.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.485 ' ND1' HG21 ' A' ' 6' ' ' ILE . 79.7 m-70 -79.57 -44.08 21.76 Favored 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 119.805 -0.758 . . . . 0.72 111.168 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.418 ' O ' ' C ' ' A' ' 26' ' ' ASP . 1.2 m -85.86 2.97 43.76 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.201 -1.562 . . . . 0.84 108.57 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.418 ' C ' ' O ' ' A' ' 25' ' ' SER . 4.6 m-20 36.31 57.42 1.05 Allowed 'General case' 0 N--CA 1.498 1.975 0 CA-C-O 121.719 0.771 . . . . 1.4 111.155 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 58.2 m -68.85 -52.25 31.79 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.794 -0.817 . . . . 0.61 108.794 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.481 ' HD2' ' N ' ' A' ' 28' ' ' ARG . 5.5 mpt_? 43.12 61.1 10.1 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.318 -0.864 . . . . 0.6 110.503 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.47 19.75 0.31 Allowed 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.085 1.856 . . . . 0.55 113.731 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -126.8 88.92 53.37 Favored Pre-proline 0 N--CA 1.503 2.184 0 O-C-N 120.611 -1.306 . . . . 0.66 109.338 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.94 136.97 9.57 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.817 2.345 . . . . 0.56 114.095 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.602 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -60.56 129.74 43.06 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.536 -0.913 . . . . 0.36 108.536 179.399 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -74.06 -11.67 60.39 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-N 116.058 -0.519 . . . . 1.34 110.772 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.501 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 40.5 m-85 -113.86 -70.45 0.8 Allowed 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.507 -1.37 . . . . 0.48 112.541 -178.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.602 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 18.0 p -89.28 -7.54 55.21 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.893 -1.129 . . . . 0.34 111.18 -178.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.501 ' C ' ' HB3' ' A' ' 32' ' ' CYS . . . 87.88 -3.78 85.85 Favored Glycine 0 N--CA 1.5 2.901 0 N-CA-C 115.821 1.088 . . . . 0.39 115.821 175.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.569 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 19.4 mttm -48.08 148.07 1.9 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-N 121.795 2.797 . . . . 0.7 106.93 178.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -117.45 134.79 54.45 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.068 -1.645 . . . . 1.69 109.449 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 17.9 m-85 -119.19 175.48 5.77 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.433 -0.792 . . . . 0.53 109.016 179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.532 ' CD2' ' H ' ' A' ' 40' ' ' HIS . 5.0 p80 -113.31 8.56 18.07 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.639 -0.663 . . . . 0.98 111.362 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.507 ' O ' ' C ' ' A' ' 42' ' ' LYS . 28.1 mt-30 -143.1 111.51 6.24 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.453 -1.404 . . . . 1.48 110.421 179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' A' ' 45' ' ' MET . 49.4 tttm -30.95 -80.59 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.527 -0.733 . . . . 1.1 111.05 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 42' ' ' LYS . 10.8 p -36.12 -31.15 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.144 -0.973 . . . . 0.77 111.718 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -75.55 -40.9 56.18 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 118.359 -1.337 . . . . 0.81 108.349 179.796 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.617 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.5 tmm? -65.28 -46.23 81.27 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.434 -1.691 . . . . 0.69 106.434 177.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.569 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 52.9 mmtt -50.7 -36.83 38.07 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 107.476 -1.305 . . . . 1.44 107.476 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.626 ' O ' HG23 ' A' ' 51' ' ' ILE . 5.4 mtmp? -63.33 -32.09 73.41 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 106.395 -1.706 . . . . 1.92 106.395 177.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.637 ' O ' HG12 ' A' ' 51' ' ' ILE . 66.3 t60 -72.6 -67.32 0.56 Allowed 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.273 -1.38 . . . . 0.33 107.273 177.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.569 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 41.7 p -40.68 -32.28 0.2 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 120.136 -1.602 . . . . 0.42 109.61 177.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.553 ' CZ ' ' OE1' ' A' ' 55' ' ' GLU . 3.9 m-30 -70.41 -32.82 70.6 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 121.074 -1.016 . . . . 0.47 108.955 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.637 HG12 ' O ' ' A' ' 48' ' ' HIS . 15.6 pt -71.1 -16.75 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 C-N-CA 118.409 -1.316 . . . . 0.37 109.264 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.467 ' NE2' ' HB2' ' A' ' 34' ' ' TYR . 67.1 m-70 -90.86 -30.68 16.81 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.403 -1.436 . . . . 0.32 109.061 176.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 62.8 p -85.23 -11.2 55.43 Favored 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 112.608 0.596 . . . . 0.56 112.608 -176.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 83.15 14.75 73.86 Favored Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.071 -1.612 . . . . 0.45 109.071 -178.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.553 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 85.2 mt-10 -74.5 130.51 39.75 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.282 -1.128 . . . . 1.77 111.031 -177.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.1 mmtt -139.46 67.42 37.82 Favored Pre-proline 0 N--CA 1.487 1.418 0 N-CA-C 108.581 -0.896 . . . . 1.39 108.581 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.55 -7.7 11.35 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.9 2.4 . . . . 0.47 113.122 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.42 ' HB3' HD22 ' A' ' 73' ' ' LEU . 80.2 m-70 -105.73 93.19 4.51 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.734 -1.229 . . . . 0.54 109.019 179.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.464 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 91.5 mttt -94.31 123.72 37.88 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.068 -1.02 . . . . 1.34 110.761 -178.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.02 119.09 24.52 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.532 -1.284 . . . . 0.8 107.532 177.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.464 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 38.6 mm-40 -74.79 -16.17 60.72 Favored 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 112.439 0.533 . . . . 1.39 112.439 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.478 HG11 ' CG ' ' A' ' 80' ' ' HIS . 40.7 t -69.54 -55.97 13.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.039 0 O-C-N 120.187 -1.571 . . . . 1.04 111.469 -178.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.8 p -112.11 -0.07 15.74 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 119.305 -0.958 . . . . 0.92 110.83 -177.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.79 31.8 55.17 Favored Glycine 0 N--CA 1.498 2.803 0 C-N-CA 119.768 -1.206 . . . . 0.74 112.516 176.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -102.16 168.72 9.18 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 106.203 -1.777 . . . . 1.67 106.203 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -139.09 149.19 44.26 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.436 -1.415 . . . . 0.6 110.836 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.431 ' HZ ' ' CE1' ' A' ' 76' ' ' HIS . 31.2 m-85 -133.46 151.53 51.8 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-O 122.061 0.934 . . . . 0.54 112.905 -177.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 79.7 p -79.08 -27.39 43.02 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.717 -0.674 . . . . 0.64 109.777 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -116.72 140.13 49.77 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.877 -1.139 . . . . 2.25 111.189 -178.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.449 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -64.18 -45.28 89.05 Favored 'General case' 0 C--O 1.2 -1.538 0 N-CA-C 108.223 -1.028 . . . . 0.82 108.223 178.194 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.0 t -49.75 -35.87 23.85 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.299 -0.876 . . . . 0.99 108.923 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -74.96 -31.21 61.42 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.193 -1.41 . . . . 0.84 107.193 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' A' ' 70' ' ' SER . 43.7 tp -72.73 -54.52 8.72 Favored 'General case' 0 C--O 1.199 -1.582 0 N-CA-C 107.288 -1.375 . . . . 0.76 107.288 176.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.531 HD13 " H3'" ' C' ' 209' ' ' ' DG' . 72.0 mt -45.34 -51.14 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 O-C-N 120.438 -1.414 . . . . 1.02 108.549 178.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 57.2 m -62.43 -45.84 91.24 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 120.8 -1.188 . . . . 0.96 109.313 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.431 ' CE1' ' HZ ' ' A' ' 67' ' ' PHE . 22.1 t60 -60.84 -43.34 98.43 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 122.141 0.972 . . . . 0.8 109.593 -179.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -69.33 -32.55 71.71 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 120.779 -1.2 . . . . 1.34 108.283 178.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 82' ' ' GLY . 93.0 mtt180 -62.83 -31.88 72.98 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 106.673 -1.602 . . . . 2.35 106.673 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.03 -43.55 87.27 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 118.134 -1.426 . . . . 1.76 107.29 178.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.478 ' CG ' HG11 ' A' ' 62' ' ' VAL . 68.3 m-70 -66.12 -33.41 75.72 Favored 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 118.099 -1.44 . . . . 1.12 109.506 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 17.5 p -103.0 16.79 25.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.303 -0.873 . . . . 1.57 111.265 -177.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.488 2.129 0 C-N-CA 119.237 -1.459 . . . . 1.59 109.686 179.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.729 0 O4'-C4'-C3' 107.223 1.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' ' DA' . . . . . 0.537 ' N6 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.825 0 O4'-C4'-C3' 107.204 1.604 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' ' DT' . . . . . 0.519 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.774 0 C1'-O4'-C4' 106.243 -2.469 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' ' DA' . . . . . 0.519 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.868 0 C1'-O4'-C4' 107.542 -1.541 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.039 0 O4'-C4'-C3' 107.139 1.539 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.607 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.086 0 C1'-O4'-C4' 107.216 -1.775 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' ' DT' . . . . . 0.449 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.142 0 C1'-O4'-C4' 106.628 -2.195 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.074 0 O4'-C4'-C3' 107.407 1.807 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' ' DA' . . . . . 0.625 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.556 0 N19-C1'-C2' 116.768 1.605 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' ' DC' . . . . . 0.625 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.931 0 P-O3'-C3' 121.853 1.794 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.034 0 C1'-O4'-C4' 107.09 -1.864 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' ' DG' . . . . . 0.51 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.023 0 O4'-C4'-C3' 107.224 1.624 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.51 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.034 0 O4'-C4'-C3' 107.295 1.695 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' ' DC' . . . . . 0.444 ' O2 ' ' N2 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.423 -2.056 0 C4'-C3'-C2' 104.869 1.669 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.822 0 O4'-C4'-C3' 107.154 1.554 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.93 0 O4'-C4'-C3' 107.314 1.714 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.863 0 O4'-C4'-C3' 107.156 1.556 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.106 0 O4'-C4'-C3' 107.434 1.834 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 203' ' ' ' DG' . . . . . 0.555 ' C2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.966 0 C1'-O4'-C4' 107.488 -1.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 204' ' ' ' DG' . . . . . 0.555 ' C4 ' ' C2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.931 0 C1'-O4'-C4' 107.217 -1.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 205' ' ' ' DC' . . . . . 0.417 ' N4 ' ' N6 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.051 0 C1'-O4'-C4' 107.411 -1.635 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 206' ' ' ' DA' . . . . . 0.417 ' N6 ' ' N4 ' ' C' ' 205' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.789 0 O4'-C4'-C3' 107.404 1.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.966 0 O4'-C4'-C3' 107.192 1.592 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.943 0 C4'-C3'-C2' 104.924 1.724 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 209' ' ' ' DG' . . . . . 0.58 ' C2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.895 0 O4'-C4'-C3' 107.29 1.69 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 210' ' ' ' DA' . . . . . 0.607 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.583 0 O4'-C4'-C3' 107.459 1.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 211' ' ' ' DT' . . . . . 0.552 ' C4 ' ' C6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.425 -1.924 0 C1'-O4'-C4' 106.542 -2.256 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.727 0 C1'-O4'-C4' 106.966 -1.953 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.732 0 C4'-C3'-C2' 104.85 1.65 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 214' ' ' ' DA' . . . . . 0.537 ' N6 ' ' N6 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O4'-C4'-C3' 107.115 1.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 215' ' ' ' DT' . . . . . 0.432 ' C4 ' ' C5 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.015 0 C1'-O4'-C4' 107.344 -1.683 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.131 0 O4'-C4'-C3' 107.281 1.681 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 N--CA 1.495 1.816 0 CA-C-O 121.815 0.816 . . . . 65.13 110.719 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.621 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.2 m-85 -101.12 128.65 47.1 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 109.113 -0.699 . . . . 70.07 109.113 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -113.72 120.79 42.04 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 122.526 1.155 . . . . 83.59 112.414 -177.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.506 ' O ' ' HA2' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -52.62 126.61 20.27 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 108.377 -0.972 . . . . 50.89 108.377 177.257 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.457 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.3 OUTLIER -86.31 -17.33 34.87 Favored 'General case' 0 C--N 1.289 -2.053 0 O-C-N 120.846 -1.159 . . . . 99.16 111.939 -177.895 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.9 mm -77.91 -72.75 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 120.822 -1.174 . . . . 112.28 112.592 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.5 p -87.3 -32.0 19.91 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 106.516 -1.661 . . . . 82.08 106.516 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.506 ' HA2' ' O ' ' A' ' 4' ' ' CYS . . . 95.94 53.77 1.47 Allowed Glycine 0 N--CA 1.496 2.652 0 C-N-CA 118.513 -1.803 . . . . 195.93 114.54 174.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -115.71 164.56 14.18 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 104.438 -2.43 . . . . 114.22 104.438 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 90.2 p -115.7 149.19 38.8 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 119.826 -1.796 . . . . 78.05 113.847 -175.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 17.3 m-85 -129.21 129.69 45.36 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.682 0.753 . . . . 54.66 110.453 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.3 mtpt -73.31 -22.2 60.4 Favored 'General case' 0 N--CA 1.497 1.894 0 CA-C-O 121.785 0.803 . . . . 101.13 109.562 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.479 ' CB ' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -113.63 131.03 56.28 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.693 -0.855 . . . . 74.89 108.693 -177.516 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.621 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 98.3 p -58.63 -32.44 69.04 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.771 -1.206 . . . . 25.87 107.899 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 76.0 p -64.68 -41.48 96.02 Favored 'General case' 0 N--CA 1.485 1.315 0 O-C-N 121.541 -0.724 . . . . 23.45 110.337 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.479 ' OG1' ' CB ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -65.38 -33.5 76.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.078 -1.452 . . . . 32.27 107.078 179.816 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 tp -72.83 -36.36 67.49 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 107.509 -1.293 . . . . 97.78 107.509 177.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.594 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 20.7 t -57.84 -60.44 3.71 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.067 -1.021 . . . . 34.23 108.794 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.488 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 58.3 m -52.36 -40.55 62.15 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-O 122.526 1.155 . . . . 30.69 109.32 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 61.8 t60 -63.31 -46.05 88.5 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 108.116 -1.068 . . . . 81.83 108.116 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.7 mt -58.44 -31.4 67.73 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 106.638 -1.616 . . . . 156.93 106.638 178.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 18' ' ' SER . 35.7 mt -70.02 -24.49 63.29 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 115.278 -0.874 . . . . 64.07 108.685 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 86.9 mt -68.32 -33.3 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 107.13 -1.433 . . . . 150.1 107.13 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.5 m-70 -80.71 -38.31 29.09 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.434 -1.307 . . . . 55.94 109.744 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 m -84.78 -3.63 58.7 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 120.596 -1.315 . . . . 89.1 108.846 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 22' ' ' LEU . 53.7 m-20 47.94 51.3 14.62 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 121.385 0.612 . . . . 62.89 110.248 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -91.55 130.67 37.34 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.354 -0.841 . . . . 115.68 109.509 179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.0 mtt-85 -144.84 76.06 14.07 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 120.98 -1.075 . . . . 115.33 109.374 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.46 10.23 1.3 Allowed 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 121.843 1.695 . . . . 90.27 113.385 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.466 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 73.5 m-85 -115.19 81.72 8.33 Favored Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 120.985 -1.072 . . . . 131.19 108.434 179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.81 126.07 7.06 Favored 'Trans proline' 0 C--N 1.312 -1.342 0 C-N-CA 122.509 2.139 . . . . 108.54 112.746 -178.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.501 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.1 OUTLIER -48.32 142.88 5.14 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.174 0.988 . . . . 43.4 110.08 178.204 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -83.36 -11.79 57.26 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.691 -0.631 . . . . 113.04 110.831 -179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.501 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 52.6 m-85 -117.67 -73.42 0.64 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.242 -1.536 . . . . 118.47 112.187 -178.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 18.3 p -79.21 -27.32 42.53 Favored 'General case' 0 N--CA 1.504 2.242 0 C-N-CA 119.088 -1.045 . . . . 56.06 110.634 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 104.94 1.46 42.23 Favored Glycine 0 N--CA 1.488 2.125 0 C-N-CA 119.405 -1.379 . . . . 19.15 114.218 175.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.483 ' NZ ' ' P ' ' B' ' 107' ' ' ' DT' . 2.8 mttm -54.73 153.32 6.09 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 121.12 2.46 . . . . 73.47 106.023 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -117.28 138.94 51.41 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.305 -1.497 . . . . 160.56 109.681 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.446 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 51.6 m-85 -120.18 160.53 22.73 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.078 -1.014 . . . . 72.45 110.153 -179.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.544 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -99.91 -7.67 24.96 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 116.234 -0.439 . . . . 97.77 110.542 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.517 ' O ' ' C ' ' A' ' 42' ' ' LYS . 88.3 mt-30 -130.3 109.24 10.61 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.885 -1.135 . . . . 106.11 109.32 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.585 ' O ' ' N ' ' A' ' 45' ' ' MET . 85.5 tttt -29.74 -82.47 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.781 -0.574 . . . . 136.29 111.199 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 42' ' ' LYS . 2.1 m -37.71 -30.42 0.03 OUTLIER 'General case' 0 C--N 1.291 -1.938 0 O-C-N 121.204 -0.935 . . . . 65.22 111.879 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 41' ' ' GLN . 57.6 t0 -72.35 -36.31 68.75 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.108 -1.62 . . . . 40.66 107.314 178.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.597 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.1 tmm? -71.31 -47.3 57.54 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.326 -1.361 . . . . 31.66 107.326 176.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.534 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 7.7 tptp -50.54 -39.06 48.01 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.21 -1.404 . . . . 103.12 107.21 -179.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.512 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.8 mtmt -64.41 -34.97 79.42 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 106.178 -1.786 . . . . 48.51 106.178 176.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.662 ' O ' HG12 ' A' ' 51' ' ' ILE . 64.8 t60 -65.38 -65.49 0.67 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 107.426 -1.324 . . . . 65.66 107.426 176.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.534 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 31.9 p -42.2 -33.32 0.59 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.227 -1.545 . . . . 47.02 109.9 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.508 ' CE2' ' OE1' ' A' ' 55' ' ' GLU . 2.6 m-85 -71.69 -27.65 63.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.86 -1.15 . . . . 54.63 109.572 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 48' ' ' HIS . 15.0 pt -74.96 -17.55 16.23 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 121.058 -1.026 . . . . 99.09 109.149 176.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.426 ' CE1' ' HB2' ' A' ' 34' ' ' TYR . 59.2 m-70 -89.34 -30.27 18.53 Favored 'General case' 0 N--CA 1.516 2.847 0 C-N-CA 118.065 -1.454 . . . . 59.33 107.916 176.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.465 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 38.6 p -77.18 -23.16 51.56 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.654 0.74 . . . . 97.33 109.061 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.69 22.64 35.9 Favored Glycine 0 N--CA 1.485 1.966 0 N-CA-C 108.276 -1.93 . . . . 23.68 108.276 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.508 ' OE1' ' CE2' ' A' ' 50' ' ' PHE . 86.5 mt-10 -85.66 127.1 34.4 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 122.394 1.092 . . . . 47.26 112.026 -177.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -137.76 78.83 35.58 Favored Pre-proline 0 C--N 1.296 -1.731 0 N-CA-C 107.588 -1.264 . . . . 86.79 107.588 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -67.37 -13.02 37.91 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 C-N-CA 123.101 2.534 . . . . 151.44 112.782 -178.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -96.34 91.32 5.79 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 118.437 -1.305 . . . . 42.67 108.623 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.404 ' O ' ' OE1' ' A' ' 61' ' ' GLN . 91.5 mttt -93.0 122.07 34.98 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.214 -0.929 . . . . 72.96 110.014 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.422 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -72.93 121.66 20.41 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.006 -1.109 . . . . 38.91 108.006 178.592 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.404 ' OE1' ' O ' ' A' ' 59' ' ' LYS . 1.6 mm100 -84.25 7.99 17.37 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.297 -0.877 . . . . 124.0 109.855 -178.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.788 HG11 ' CG ' ' A' ' 80' ' ' HIS . 21.7 t -91.65 -59.66 2.83 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 C-N-CA 119.566 -0.854 . . . . 56.07 109.546 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.1 p -111.22 -12.63 14.09 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.285 0.846 . . . . 63.83 113.285 -178.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.47 12.4 51.25 Favored Glycine 0 N--CA 1.505 3.247 0 O-C-N 120.057 -1.652 . . . . 23.81 112.867 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -86.18 166.79 15.47 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.087 -1.82 . . . . 120.74 106.087 177.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -132.41 144.76 50.73 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.481 -1.387 . . . . 39.51 109.702 -178.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.459 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 82.3 m-85 -128.49 147.03 50.65 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 122.237 1.018 . . . . 62.57 112.183 -177.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.1 m -74.31 -36.79 63.73 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.631 -0.713 . . . . 84.84 109.089 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -116.19 141.62 47.91 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-O 122.403 1.097 . . . . 93.39 111.751 -178.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.4 p -59.6 -40.83 88.79 Favored 'General case' 0 C--O 1.197 -1.664 0 N-CA-C 107.842 -1.169 . . . . 67.34 107.842 178.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.2 t -48.18 -41.9 28.27 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.374 -0.829 . . . . 68.68 110.004 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 -76.19 -29.73 57.76 Favored 'General case' 0 C--N 1.29 -1.985 0 C-N-CA 118.321 -1.351 . . . . 33.83 108.307 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' A' ' 74' ' ' ILE . 48.3 tp -70.44 -55.65 8.5 Favored 'General case' 0 C--O 1.195 -1.804 0 N-CA-C 107.517 -1.29 . . . . 75.65 107.517 176.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.403 ' C ' ' O ' ' A' ' 73' ' ' LEU . 79.9 mt -45.91 -52.23 3.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 O-C-N 120.666 -1.271 . . . . 27.72 108.985 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.3 m -61.45 -45.87 92.45 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.985 -1.072 . . . . 95.2 109.702 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.459 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 11.6 t60 -64.56 -38.07 89.73 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-O 122.496 1.141 . . . . 66.3 109.09 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.53 -31.93 70.45 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 107.332 -1.358 . . . . 87.23 107.332 178.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 82' ' ' GLY . 10.0 mmt85 -63.36 -38.9 92.94 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 107.709 -1.219 . . . . 73.27 107.709 177.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.4 ' CD ' ' OP2' ' B' ' 103' ' ' ' DT' . 47.0 mttm -60.41 -44.07 96.07 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 118.014 -1.474 . . . . 80.85 107.403 178.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.788 ' CG ' HG11 ' A' ' 62' ' ' VAL . 59.3 m-70 -61.3 -35.73 78.15 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 117.002 -1.879 . . . . 46.01 107.898 177.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.467 HG22 ' O ' ' A' ' 81' ' ' THR . 20.4 m -98.26 24.16 7.53 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 107.918 -1.142 . . . . 89.5 107.918 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 109.476 -1.45 . . . . 8.65 109.476 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.013 0 O4'-C4'-C3' 107.249 1.649 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' ' DA' . . . . . 0.532 ' N6 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.861 0 O4'-C4'-C3' 107.196 1.596 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' ' DT' . . . . . 0.572 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.572 0 C1'-O4'-C4' 106.012 -2.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' ' DA' . . . . . 0.572 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.789 0 O4'-C4'-C3' 107.056 1.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.965 0 O4'-C4'-C3' 107.219 1.619 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.583 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.752 0 C1'-O4'-C4' 107.283 -1.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' ' DT' . . . . . 0.499 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.068 0 C1'-O4'-C4' 106.586 -2.224 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' ' DC' . . . . . 0.458 ' N4 ' ' N6 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O4'-C4'-C3' 107.249 1.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' ' DA' . . . . . 0.678 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.442 0 N19-C1'-C2' 116.582 1.489 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' ' DC' . . . . . 0.678 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.987 0 P-O3'-C3' 121.979 1.899 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.996 0 C1'-O4'-C4' 107.144 -1.826 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' ' DG' . . . . . 0.464 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.845 0 O4'-C4'-C3' 107.49 1.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.464 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.938 0 O4'-C4'-C3' 107.326 1.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' ' DC' . . . . . 0.451 ' O2 ' ' N2 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.722 0 C4'-C3'-C2' 104.897 1.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.775 0 O4'-C4'-C3' 107.392 1.792 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.923 0 O4'-C4'-C3' 107.036 1.436 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.963 0 C1'-O4'-C4' 107.427 -1.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.996 0 O4'-C4'-C3' 107.159 1.559 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 203' ' ' ' DG' . . . . . 0.551 ' C2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.991 0 C4'-C3'-C2' 104.873 1.673 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 204' ' ' ' DG' . . . . . 0.551 ' C4 ' ' C2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.779 0 C4'-C3'-C2' 104.781 1.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 205' ' ' ' DC' . . . . . 0.534 ' N4 ' ' N6 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.043 0 C1'-O4'-C4' 107.269 -1.737 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 206' ' ' ' DA' . . . . . 0.534 ' N6 ' ' N4 ' ' C' ' 205' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.794 0 O4'-C4'-C3' 107.1 1.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.854 0 O4'-C4'-C3' 107.112 1.512 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.948 0 C4'-C3'-C2' 104.776 1.576 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 209' ' ' ' DG' . . . . . 0.557 ' C2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.721 0 O4'-C4'-C3' 107.226 1.626 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 210' ' ' ' DA' . . . . . 0.583 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.523 1.501 0 O4'-C4'-C3' 107.487 1.887 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 211' ' ' ' DT' . . . . . 0.556 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -1.963 0 C1'-O4'-C4' 106.709 -2.136 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.864 0 C1'-O4'-C4' 106.748 -2.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.849 0 C4'-C3'-C2' 104.782 1.582 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 214' ' ' ' DA' . . . . . 0.532 ' N6 ' ' N6 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.082 0 O4'-C4'-C3' 107.066 1.466 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 215' ' ' ' DT' . . . . . 0.441 ' N3 ' ' C6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.963 0 C1'-O4'-C4' 106.935 -1.975 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.058 0 O4'-C4'-C3' 107.35 1.75 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.9 p . . . . . 0 N--CA 1.489 1.478 0 N-CA-C 109.456 -0.572 . . . . 65.13 109.456 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.666 ' CE2' ' N ' ' A' ' 14' ' ' SER . 2.6 m-85 -102.52 124.87 48.86 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.229 -0.919 . . . . 70.07 109.152 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.7 139.56 40.93 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 122.272 1.034 . . . . 83.59 110.844 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -72.53 130.24 40.18 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 122.046 0.927 . . . . 50.89 110.593 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -92.95 22.89 4.55 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 109.311 -0.626 . . . . 99.16 109.311 -177.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.3 mm -123.72 -58.24 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.055 -1.028 . . . . 112.28 113.603 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.9 p -103.79 -38.5 7.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.706 -1.246 . . . . 82.08 110.537 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 133.04 13.58 1.54 Allowed Glycine 0 N--CA 1.506 3.362 0 CA-C-O 118.727 -1.041 . . . . 195.93 114.463 177.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -104.01 164.11 11.92 Favored 'General case' 0 N--CA 1.516 2.837 0 CA-C-N 121.167 2.483 . . . . 114.22 113.805 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.5 t -117.36 160.06 21.75 Favored 'General case' 0 N--CA 1.511 2.593 0 CA-C-O 122.511 1.148 . . . . 78.05 113.195 -176.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.539 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.9 m-85 -140.06 127.9 21.95 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-N 115.455 -0.793 . . . . 54.66 110.401 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -72.59 -23.63 60.98 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 122.612 1.196 . . . . 101.13 109.217 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.732 ' HE ' ' N ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -119.17 115.5 24.36 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 114.784 -1.098 . . . . 74.89 110.158 -177.275 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.666 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 1.3 t -50.39 -33.69 21.59 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 118.4 -1.32 . . . . 25.87 109.303 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 p -56.28 -39.96 73.5 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.262 -1.524 . . . . 23.45 109.304 -178.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.706 HG21 H2'' ' B' ' 109' ' ' ' DA' . 23.1 m -72.64 -32.02 65.56 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.389 -0.967 . . . . 32.27 108.389 178.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.7 tp -72.73 -44.98 60.99 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 106.395 -1.706 . . . . 97.78 106.395 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.621 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 45.1 m -44.35 -53.96 6.28 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.84 -1.17 . . . . 34.23 107.84 178.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.7 m -59.63 -41.33 90.22 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.911 0.863 . . . . 30.69 109.008 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.539 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 56.6 t60 -63.18 -35.73 81.26 Favored 'General case' 0 C--N 1.291 -1.94 0 CA-C-O 122.423 1.106 . . . . 81.83 108.602 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.2 mt -70.73 -34.69 72.16 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.103 -1.814 . . . . 156.93 106.103 178.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 18' ' ' SER . 22.2 mt -65.4 -21.48 66.67 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 107.215 -1.402 . . . . 64.07 107.215 177.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.581 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 80.2 mt -74.89 -41.05 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 120.864 -1.148 . . . . 150.1 109.262 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -76.01 -27.71 57.48 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 118.027 -1.469 . . . . 55.94 108.865 178.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -86.91 -25.75 24.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.3 -0.875 . . . . 89.1 108.694 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 64.64 50.9 2.01 Favored 'General case' 0 C--N 1.29 -1.998 0 O-C-N 121.404 -0.81 . . . . 62.89 109.56 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.454 ' C ' HH11 ' A' ' 28' ' ' ARG . 2.3 m -98.23 127.46 44.17 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.445 -0.784 . . . . 115.68 109.261 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.454 HH11 ' C ' ' A' ' 27' ' ' THR . 1.7 mpt_? -136.36 80.04 40.81 Favored Pre-proline 0 N--CA 1.495 1.783 0 O-C-N 121.147 -0.971 . . . . 115.33 109.878 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -75.69 17.88 0.65 Allowed 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 122.296 1.997 . . . . 90.27 114.13 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.498 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 61.9 m-85 -124.1 82.73 56.4 Favored Pre-proline 0 N--CA 1.497 1.9 0 N-CA-C 107.657 -1.238 . . . . 131.19 107.657 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 5.4 Cg_endo -79.41 147.49 20.23 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 C-N-CA 122.689 2.259 . . . . 108.54 114.396 -177.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.625 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.5 OUTLIER -71.78 137.29 47.54 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-O 121.674 0.75 . . . . 43.4 109.826 -179.029 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.429 ' HG2' ' H ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -81.56 -15.68 54.04 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 120.414 -0.515 . . . . 113.04 110.476 -179.435 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.413 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 25.0 m-85 -119.09 -51.82 2.32 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 115.185 1.55 . . . . 118.47 115.185 -175.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.625 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.6 p -100.54 -18.62 16.55 Favored 'General case' 0 N--CA 1.517 2.917 0 O-C-N 120.414 -1.429 . . . . 56.06 113.843 -175.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 124.54 -32.58 4.04 Favored Glycine 0 N--CA 1.512 3.744 0 O-C-N 119.597 -1.94 . . . . 19.15 114.548 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -51.67 160.69 0.61 Allowed 'General case' 0 C--N 1.292 -1.915 0 O-C-N 120.895 -1.356 . . . . 73.47 112.698 -177.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.46 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 0.3 OUTLIER -131.97 152.96 50.78 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 107.801 -1.185 . . . . 160.56 107.801 179.846 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.467 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 35.4 m-85 -135.02 162.18 33.19 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-O 121.979 0.895 . . . . 72.45 110.36 -178.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.492 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -94.17 -11.92 29.4 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 115.598 -0.728 . . . . 97.77 110.863 -178.796 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' C ' ' A' ' 42' ' ' LYS . 65.7 mt-30 -131.86 116.24 16.95 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.928 -1.107 . . . . 106.11 110.126 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.499 ' O ' ' N ' ' A' ' 45' ' ' MET . 81.9 tttt -34.32 -74.21 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.197 -0.939 . . . . 136.29 111.384 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -43.98 -34.43 1.7 Allowed 'General case' 0 C--N 1.295 -1.775 0 O-C-N 121.566 -0.709 . . . . 65.22 111.287 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -68.36 -40.74 81.39 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.332 -1.729 . . . . 40.66 106.332 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.662 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 9.1 tmm? -69.45 -47.61 63.46 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 119.965 -1.709 . . . . 31.66 108.05 176.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.556 ' O ' ' OG1' ' A' ' 49' ' ' THR . 31.7 ttmt -50.9 -35.97 35.75 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.681 -1.229 . . . . 103.12 107.681 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.519 ' O ' HG23 ' A' ' 51' ' ' ILE . 25.9 mtmm -67.9 -32.78 73.5 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 105.596 -2.002 . . . . 48.51 105.596 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.824 ' O ' HG12 ' A' ' 51' ' ' ILE . 73.9 t60 -64.67 -65.21 0.7 Allowed 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 106.121 -1.807 . . . . 65.66 106.121 174.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.556 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 41.0 p -40.79 -37.05 0.7 Allowed 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.934 -1.104 . . . . 47.02 110.521 178.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.485 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 4.0 m-30 -65.52 -36.99 85.46 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.034 -1.042 . . . . 54.63 109.082 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.824 HG12 ' O ' ' A' ' 48' ' ' HIS . 10.5 pt -59.91 -36.58 67.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 N-CA-C 106.857 -1.535 . . . . 99.09 106.857 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -74.4 -32.08 62.57 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.452 -1.405 . . . . 59.33 110.852 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.485 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 69.3 p -85.56 -8.7 58.14 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.551 -1.343 . . . . 97.33 111.626 -176.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 74.0 13.78 80.71 Favored Glycine 0 N--CA 1.49 2.284 0 O-C-N 120.761 -1.212 . . . . 23.68 110.082 -178.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -75.82 107.78 8.23 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.98 0.895 . . . . 47.26 110.657 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -115.49 79.66 7.32 Favored Pre-proline 0 C--N 1.292 -1.912 0 N-CA-C 108.241 -1.022 . . . . 86.79 108.241 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -75.06 -13.31 21.33 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.488 2.126 . . . . 151.44 114.125 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -90.73 82.08 5.77 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 120.267 -1.521 . . . . 42.67 109.421 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -77.31 140.03 39.92 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 122.003 0.906 . . . . 72.96 111.404 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.481 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -103.11 115.4 30.52 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.621 -1.992 . . . . 38.91 105.621 177.569 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -85.12 14.05 5.53 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.34 -1.475 . . . . 124.0 109.934 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.675 HG11 ' CG ' ' A' ' 80' ' ' HIS . 46.8 t -95.47 -38.93 9.22 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 O-C-N 121.255 -0.903 . . . . 56.07 110.439 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.7 p -131.3 -8.01 3.78 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 122.139 0.971 . . . . 63.83 108.877 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.16 31.94 33.2 Favored Glycine 0 C--N 1.29 -2.024 0 O-C-N 120.837 -1.164 . . . . 23.81 111.195 176.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -96.36 -172.4 2.52 Favored 'General case' 0 C--N 1.287 -2.127 0 N-CA-C 103.216 -2.883 . . . . 120.74 103.216 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -165.74 148.13 7.44 Favored 'General case' 0 C--N 1.265 -3.077 0 N-CA-C 105.739 -1.949 . . . . 39.51 105.739 -176.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.55 ' CZ ' ' CG ' ' A' ' 76' ' ' HIS . 2.7 m-85 -129.22 146.77 51.06 Favored 'General case' 0 C--N 1.28 -2.419 0 C-N-CA 117.79 -1.564 . . . . 62.57 113.401 -175.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.446 ' OG ' ' HG3' ' A' ' 69' ' ' GLN . 4.9 p -70.7 -8.03 49.06 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 115.277 -0.874 . . . . 84.84 108.993 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.446 ' HG3' ' OG ' ' A' ' 68' ' ' SER . 24.7 mt-30 -145.4 130.82 18.69 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.036 -1.04 . . . . 93.39 111.312 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.596 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -51.1 -48.9 61.59 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.767 -1.208 . . . . 67.34 109.3 177.224 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.436 ' C ' ' O ' ' A' ' 70' ' ' SER . 0.3 OUTLIER -44.6 -44.87 9.18 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.969 -1.082 . . . . 68.68 108.7 -179.304 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.407 ' O ' ' CB ' ' A' ' 76' ' ' HIS . 63.0 m-20 -70.66 -28.1 64.53 Favored 'General case' 0 C--N 1.291 -1.976 0 C-N-CA 118.187 -1.405 . . . . 33.83 108.145 178.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.596 ' N ' ' O ' ' A' ' 70' ' ' SER . 37.6 tp -70.19 -59.33 2.95 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 106.778 -1.564 . . . . 75.65 106.778 175.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.486 HD13 " H3'" ' C' ' 209' ' ' ' DG' . 91.5 mt -46.78 -54.34 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.376 -1.452 . . . . 27.72 109.875 178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 3.2 m -61.96 -43.27 99.19 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 119.631 -1.918 . . . . 95.2 109.004 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.55 ' CG ' ' CZ ' ' A' ' 67' ' ' PHE . 16.2 t60 -58.94 -45.65 89.91 Favored 'General case' 0 C--N 1.296 -1.76 0 O-C-N 121.12 -0.988 . . . . 66.3 109.39 -178.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.6 t -69.15 -33.78 73.95 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 120.244 -1.535 . . . . 87.23 107.997 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.449 ' HB2' ' O ' ' A' ' 75' ' ' THR . 4.3 mtt85 -50.83 -41.04 57.3 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 106.49 -1.67 . . . . 73.27 106.49 178.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -64.6 -45.02 88.75 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 118.252 -1.379 . . . . 80.85 108.582 178.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.675 ' CG ' HG11 ' A' ' 62' ' ' VAL . 63.7 m-70 -62.49 -35.28 78.85 Favored 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 116.52 -2.072 . . . . 46.01 108.52 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 50.6 p -96.09 19.1 12.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.085 -1.01 . . . . 89.5 109.786 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.552 0 N-CA-C 109.381 -1.487 . . . . 8.65 109.381 178.971 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.797 0 O4'-C4'-C3' 107.158 1.558 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.758 0 C1'-O4'-C4' 107.427 -1.624 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' ' DT' . . . . . 0.563 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.745 0 C1'-O4'-C4' 105.973 -2.662 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' ' DA' . . . . . 0.563 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.03 0 O4'-C4'-C3' 107.16 1.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' ' DA' . . . . . 0.457 ' C6 ' ' C5 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.021 0 O4'-C4'-C3' 107.114 1.514 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.607 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.812 0 C1'-O4'-C4' 106.885 -2.01 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' ' DT' . . . . . 0.549 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.942 0 C1'-O4'-C4' 106.233 -2.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' ' DC' . . . . . 0.581 " H3'" HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C3'--C2' 1.537 1.919 0 C1'-O4'-C4' 107.019 -1.915 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' ' DA' . . . . . 0.706 H2'' HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 P--O5' 1.608 1.493 0 N19-C1'-C2' 117.421 2.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' ' DC' . . . . . 0.548 ' C4 ' ' C5 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.942 0 P-O3'-C3' 121.687 1.656 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.886 0 C1'-O4'-C4' 107.152 -1.82 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' ' DG' . . . . . 0.568 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.818 0 O4'-C4'-C3' 107.416 1.816 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.568 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.873 0 O4'-C4'-C3' 107.095 1.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' ' DC' . . . . . 0.441 ' O2 ' ' N2 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.952 0 C4'-C3'-C2' 104.755 1.555 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.788 0 C1'-O4'-C4' 107.655 -1.46 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.054 0 O4'-C4'-C3' 107.222 1.622 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 201' ' ' ' DT' . . . . . 0.535 ' C2 ' ' N7 ' ' C' ' 202' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.893 0 O4'-C4'-C3' 107.087 1.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 202' ' ' ' DA' . . . . . 0.535 ' N7 ' ' C2 ' ' C' ' 201' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.053 0 O4'-C4'-C3' 107.513 1.913 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 203' ' ' ' DG' . . . . . 0.553 ' N2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.944 0 C4'-C3'-C2' 104.78 1.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 204' ' ' ' DG' . . . . . 0.553 ' C4 ' ' N2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.002 0 C1'-O4'-C4' 107.502 -1.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.018 0 C1'-O4'-C4' 107.317 -1.702 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.856 0 O4'-C4'-C3' 107.417 1.817 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.909 0 C4'-C3'-C2' 104.756 1.556 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.93 0 C4'-C3'-C2' 104.737 1.537 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 209' ' ' ' DG' . . . . . 0.559 ' N2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.986 0 O4'-C4'-C3' 107.184 1.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 210' ' ' ' DA' . . . . . 0.607 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.702 0 O4'-C4'-C3' 107.252 1.652 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 211' ' ' ' DT' . . . . . 0.545 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -2.032 0 C1'-O4'-C4' 106.83 -2.05 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.536 1.838 0 C1'-O4'-C4' 106.951 -1.964 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 213' ' ' ' DT' . . . . . 0.408 ' O4 ' ' O4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.426 -1.795 0 C4'-C3'-C2' 104.908 1.708 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 214' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.859 0 O4'-C4'-C3' 107.166 1.566 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.874 0 C1'-O4'-C4' 106.989 -1.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.127 0 O4'-C4'-C3' 107.287 1.687 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.6 p . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 121.399 0.618 . . . . 65.13 109.452 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.576 ' CE2' ' N ' ' A' ' 14' ' ' SER . 3.7 m-85 -103.39 121.51 42.95 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.473 -0.767 . . . . 70.07 109.158 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.904 ' O ' ' O ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -108.68 103.24 12.29 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 122.009 0.909 . . . . 83.59 110.761 -178.558 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.904 ' O ' ' O ' ' A' ' 3' ' ' ASP . 19.4 t -13.88 157.21 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.214 0 CA-C-N 114.621 -1.172 . . . . 50.89 109.573 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.7 mttp -120.36 20.44 11.92 Favored 'General case' 0 N--CA 1.507 2.385 0 N-CA-C 106.474 -1.676 . . . . 99.16 106.474 174.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.541 ' HB ' ' NE2' ' A' ' 24' ' ' HIS . 6.3 mm -126.13 -80.35 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 CA-C-N 115.333 -0.848 . . . . 112.28 110.361 -178.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.8 p -81.45 -36.2 29.66 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.269 -1.519 . . . . 82.08 109.384 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.88 43.44 1.12 Allowed Glycine 0 N--CA 1.506 3.302 0 C-N-CA 119.696 -1.24 . . . . 195.93 113.521 177.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.49 ' HG2' ' N ' ' A' ' 10' ' ' SER . 49.5 tttm -112.19 160.39 17.64 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.503 -1.586 . . . . 114.22 107.856 178.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.49 ' N ' ' HG2' ' A' ' 9' ' ' LYS . 57.6 p -112.32 146.96 37.34 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 123.499 1.619 . . . . 78.05 114.708 -174.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.531 ' HZ ' ' ND1' ' A' ' 20' ' ' HIS . 49.4 m-85 -130.22 125.69 35.52 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 113.35 -1.75 . . . . 54.66 110.047 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.1 mttp -70.82 -21.21 62.49 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 122.631 1.205 . . . . 101.13 108.507 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.563 ' NH2' ' H ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -114.68 136.82 52.64 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 114.893 -1.049 . . . . 74.89 110.19 -177.178 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.576 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 19.3 t -65.62 -36.4 83.6 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.041 -1.037 . . . . 25.87 108.978 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -38.99 90.01 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.186 -0.946 . . . . 23.45 110.293 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.602 ' CG2' H2'' ' B' ' 109' ' ' ' DA' . 3.8 m -66.11 -31.31 72.1 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 105.854 -1.906 . . . . 32.27 105.854 178.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 2' ' ' PHE . 14.9 tp -73.19 -35.14 66.33 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 106.712 -1.588 . . . . 97.78 106.712 176.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.635 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 40.3 p -57.91 -57.16 14.0 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.782 -1.199 . . . . 34.23 108.308 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.9 m -53.53 -41.17 66.12 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 122.439 1.114 . . . . 30.69 108.863 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.531 ' ND1' ' HZ ' ' A' ' 11' ' ' PHE . 55.3 t60 -62.78 -47.47 83.35 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-O 122.511 1.148 . . . . 81.83 108.411 178.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 37.9 mt -58.19 -30.72 66.65 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.025 -1.472 . . . . 156.93 107.025 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 18' ' ' SER . 61.3 mt -72.41 -26.69 61.96 Favored 'General case' 0 C--O 1.205 -1.246 0 N-CA-C 107.967 -1.123 . . . . 64.07 107.967 178.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.544 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 49.5 mt -64.07 -34.0 65.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 O-C-N 120.046 -1.659 . . . . 150.1 107.028 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.541 ' NE2' ' HB ' ' A' ' 6' ' ' ILE . 89.7 m-70 -81.21 -37.29 28.88 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 118.697 -1.201 . . . . 55.94 110.477 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.51 ' O ' ' C ' ' A' ' 26' ' ' ASP . 57.4 m -93.6 1.87 56.54 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.387 -1.446 . . . . 89.1 109.043 -179.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.51 ' C ' ' O ' ' A' ' 25' ' ' SER . 1.1 p30 32.47 59.86 0.38 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.436 0.636 . . . . 62.89 110.164 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 91.5 m -70.65 -54.54 11.53 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 108.077 -1.083 . . . . 115.68 108.077 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.431 HH11 ' HG2' ' A' ' 28' ' ' ARG . 23.3 mtt-85 40.69 67.64 2.76 Favored Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.731 -0.605 . . . . 115.33 110.843 179.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -89.1 26.24 0.57 Allowed 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.639 2.226 . . . . 90.27 113.847 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.531 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 63.9 m-85 -122.73 76.54 47.54 Favored Pre-proline 0 N--CA 1.495 1.808 0 O-C-N 120.694 -1.254 . . . . 131.19 107.634 179.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.29 125.81 12.28 Favored 'Trans proline' 0 N--CA 1.493 1.45 0 C-N-CA 122.696 2.264 . . . . 108.54 114.507 -176.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.9 OUTLIER -52.92 135.24 36.8 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.636 -0.876 . . . . 43.4 108.636 177.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.7 -11.57 58.24 Favored 'General case' 0 C--N 1.302 -1.461 0 C-N-CA 119.372 -0.931 . . . . 113.04 109.652 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.519 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 85.6 m-85 -104.71 -74.29 0.65 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.798 -1.189 . . . . 118.47 111.659 -178.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.555 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 28.4 p -85.98 -19.82 29.83 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 118.614 -1.234 . . . . 56.06 111.487 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.71 0.16 55.33 Favored Glycine 0 N--CA 1.498 2.771 0 O-C-N 120.409 -1.432 . . . . 19.15 114.867 175.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.413 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 25.5 mttp -54.57 164.84 0.66 Allowed 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 121.737 2.769 . . . . 73.47 107.42 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -123.85 107.56 11.52 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.454 -1.404 . . . . 160.56 109.132 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.608 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 31.6 m-85 -89.44 170.63 10.37 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.334 -0.854 . . . . 72.45 111.15 -178.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.776 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 0.3 OUTLIER -117.1 40.25 3.05 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 115.651 -0.704 . . . . 97.77 111.037 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.776 ' HG3' ' O ' ' A' ' 40' ' ' HIS . 12.9 mt-30 179.72 105.73 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 108.473 -0.936 . . . . 106.11 108.473 177.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 33.8 tttp -32.35 -65.37 0.15 Allowed 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 112.627 0.603 . . . . 136.29 112.627 -178.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.1 m -52.89 -39.15 62.46 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.502 -0.749 . . . . 65.22 111.11 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -64.74 -42.1 95.43 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.309 -1.367 . . . . 40.66 107.309 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.609 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 61.9 ttp -63.32 -44.9 93.62 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.33 -1.481 . . . . 31.66 107.22 177.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.638 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 22.9 mttm -51.41 -42.44 61.46 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 107.547 -1.279 . . . . 103.12 107.547 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.514 ' O ' HG23 ' A' ' 51' ' ' ILE . 51.7 mtmt -59.63 -30.99 69.11 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 106.361 -1.718 . . . . 48.51 106.361 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.614 ' O ' HG12 ' A' ' 51' ' ' ILE . 76.3 t60 -71.19 -65.14 0.78 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 107.419 -1.326 . . . . 65.66 107.419 176.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.638 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 19.4 p -43.99 -31.07 0.82 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.586 -1.321 . . . . 47.02 110.003 178.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -71.39 -34.02 70.02 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.457 -0.777 . . . . 54.63 109.198 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.0 pt -65.95 -36.64 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 C-N-CA 118.029 -1.468 . . . . 99.09 108.362 176.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.505 ' NE2' ' HB2' ' A' ' 34' ' ' TYR . 78.1 m-70 -69.48 -32.04 70.69 Favored 'General case' 0 N--CA 1.524 3.232 0 O-C-N 120.142 -1.599 . . . . 59.33 110.368 178.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 63.1 p -82.27 -17.48 45.76 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.506 -0.746 . . . . 97.33 109.599 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 84.13 17.38 65.08 Favored Glycine 0 N--CA 1.481 1.697 0 N-CA-C 107.359 -2.297 . . . . 23.68 107.359 -177.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -76.48 116.97 17.65 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 122.143 0.973 . . . . 47.26 110.348 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -125.72 78.47 69.03 Favored Pre-proline 0 N--CA 1.49 1.575 0 N-CA-C 108.76 -0.83 . . . . 86.79 108.76 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -65.0 -10.66 26.36 Favored 'Trans proline' 0 C--N 1.309 -1.548 0 C-N-CA 122.589 2.193 . . . . 151.44 112.804 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -112.34 95.79 5.65 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 117.762 -1.575 . . . . 42.67 109.434 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -97.96 129.49 44.86 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.22 -0.925 . . . . 72.96 110.219 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.405 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -71.84 120.55 17.59 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 107.147 -1.427 . . . . 38.91 107.147 178.523 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -88.2 9.7 22.01 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.275 -1.009 . . . . 124.0 108.275 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.457 HG11 ' CG ' ' A' ' 80' ' ' HIS . 14.2 t -94.56 -59.89 2.85 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 C-N-CA 119.929 -0.709 . . . . 56.07 111.026 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.4 p -114.56 -17.87 11.59 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 113.987 1.106 . . . . 63.83 113.987 -177.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 125.86 -11.75 7.37 Favored Glycine 0 N--CA 1.514 3.891 0 CA-C-N 122.112 2.233 . . . . 23.81 114.765 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.5 tttp -86.8 166.0 15.56 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.077 -1.837 . . . . 120.74 112.024 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.52 151.82 48.98 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.19 -0.944 . . . . 39.51 112.228 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.552 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 90.6 m-85 -132.49 144.18 50.27 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 122.264 1.03 . . . . 62.57 112.922 -177.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.9 t -78.47 -40.03 36.68 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.293 -1.003 . . . . 84.84 108.293 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -106.29 140.66 38.88 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.965 0.888 . . . . 93.39 110.747 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 75.2 p -62.33 -40.37 96.12 Favored 'General case' 0 C--O 1.195 -1.796 0 N-CA-C 107.86 -1.163 . . . . 67.34 107.86 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.621 ' OG ' ' N7 ' ' C' ' 210' ' ' ' DA' . 0.4 OUTLIER -51.66 -35.1 41.02 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.621 -0.674 . . . . 68.68 110.078 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -80.57 -32.77 36.5 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.012 -1.075 . . . . 33.83 108.581 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.6 tp -73.71 -35.21 65.1 Favored 'General case' 0 C--O 1.202 -1.402 0 N-CA-C 106.914 -1.513 . . . . 75.65 106.914 176.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.5 ' O ' ' OG ' ' A' ' 77' ' ' SER . 66.6 mt -59.25 -54.16 38.14 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 O-C-N 120.486 -1.384 . . . . 27.72 107.732 177.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.65 ' O ' ' N ' ' A' ' 78' ' ' ARG . 55.2 m -57.98 -61.76 2.31 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 122.705 1.24 . . . . 95.2 107.91 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.552 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 13.0 t60 -45.59 -40.7 9.13 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.079 -1.082 . . . . 66.3 108.079 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.5 ' OG ' ' O ' ' A' ' 74' ' ' ILE . 95.6 p -69.45 -32.07 70.77 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 107.207 -1.405 . . . . 87.23 107.207 177.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.65 ' N ' ' O ' ' A' ' 75' ' ' THR . 51.8 mtp85 -61.41 -39.76 91.9 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.071 -1.018 . . . . 73.27 108.915 178.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.523 ' NZ ' ' OP2' ' B' ' 103' ' ' ' DT' . 30.3 mttt -59.17 -45.72 90.27 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 105.622 -1.992 . . . . 80.85 105.622 178.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.457 ' CG ' HG11 ' A' ' 62' ' ' VAL . 47.7 m-70 -60.06 -43.13 95.62 Favored 'General case' 0 C--N 1.295 -1.78 0 C-N-CA 117.211 -1.796 . . . . 46.01 109.305 175.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 75.4 p -91.82 22.13 4.39 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.379 -1.45 . . . . 89.5 108.919 -179.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.486 2.002 0 N-CA-C 109.875 -1.29 . . . . 8.65 109.875 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.001 0 C1'-O4'-C4' 107.513 -1.562 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.896 0 C1'-O4'-C4' 107.574 -1.518 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' ' DT' . . . . . 0.523 ' OP2' ' NZ ' ' A' ' 79' ' ' LYS . . . . . . . . 0 O4'--C4' 1.425 -1.866 0 C1'-O4'-C4' 105.751 -2.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' ' DA' . . . . . 0.593 ' C6 ' ' C5 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.994 0 O4'-C4'-C3' 107.203 1.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' ' DA' . . . . . 0.602 ' C2 ' ' C4 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.179 0 O4'-C4'-C3' 107.078 1.478 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.602 ' C4 ' ' C2 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.844 0 P-O3'-C3' 123.102 2.835 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' ' DT' . . . . . 0.534 ' C4 ' ' C4 ' ' B' ' 108' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.537 1.944 0 C1'-O4'-C4' 106.427 -2.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' ' DC' . . . . . 0.544 " H3'" HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C3'--C2' 1.536 1.797 0 C1'-O4'-C4' 106.696 -2.146 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' ' DA' . . . . . 0.602 H2'' ' CG2' ' A' ' 16' ' ' THR . . . . . . . . 0 O4'--C1' 1.436 1.236 0 N19-C1'-C2' 116.752 1.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' ' DC' . . . . . 0.562 ' C5 ' ' C5 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.136 0 P-O3'-C3' 122.084 1.987 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.856 0 C1'-O4'-C4' 107.434 -1.619 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' ' DG' . . . . . 0.551 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.832 0 O4'-C4'-C3' 107.195 1.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.551 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.059 0 O4'-C4'-C3' 107.049 1.449 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.001 0 O4'-C4'-C3' 107.058 1.458 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.847 0 C1'-O4'-C4' 107.633 -1.477 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' ' DA' . . . . . 0.527 ' C2 ' ' C2 ' ' C' ' 202' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O4'-C4'-C3' 107.36 1.76 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.821 0 O4'-C4'-C3' 107.291 1.691 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 202' ' ' ' DA' . . . . . 0.527 ' C2 ' ' C2 ' ' B' ' 116' ' ' ' DA' . . . . . . . . 0 P--O5' 1.611 1.847 0 O4'-C4'-C3' 107.107 1.507 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.902 0 C1'-O4'-C4' 107.064 -1.883 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.001 0 C1'-O4'-C4' 107.342 -1.685 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.966 0 O4'-C4'-C3' 107.362 1.762 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 206' ' ' ' DA' . . . . . 0.513 ' N1 ' ' C6 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 P--O5' 1.612 1.873 0 O4'-C4'-C3' 107.355 1.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 207' ' ' ' DG' . . . . . 0.513 ' C6 ' ' N1 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.063 0 O4'-C4'-C3' 107.28 1.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.771 0 C1'-O4'-C4' 107.015 -1.918 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 209' ' ' ' DG' . . . . . 0.579 ' N2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.716 0 C4'-C3'-C2' 104.83 1.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 210' ' ' ' DA' . . . . . 0.621 ' N7 ' ' OG ' ' A' ' 71' ' ' SER . . . . . . . . 0 C5'--C4' 1.524 1.684 0 O4'-C4'-C3' 107.428 1.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 211' ' ' ' DT' . . . . . 0.6 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -2.011 0 C1'-O4'-C4' 106.167 -2.523 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 212' ' ' ' DT' . . . . . 0.404 ' N3 ' ' C4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.523 1.561 0 C1'-O4'-C4' 106.835 -2.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 213' ' ' ' DT' . . . . . 0.554 ' C4 ' ' C6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.808 0 C1'-O4'-C4' 107.288 -1.723 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 214' ' ' ' DA' . . . . . 0.554 ' C6 ' ' C4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.276 0 O4'-C4'-C3' 107.203 1.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.125 0 C1'-O4'-C4' 106.887 -2.009 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.092 0 O4'-C4'-C3' 107.268 1.668 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.8 m . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.345 -0.613 . . . . 65.13 109.345 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.474 ' CE2' ' N ' ' A' ' 14' ' ' SER . 1.7 m-85 -96.79 120.8 37.79 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.44 -0.948 . . . . 70.07 108.44 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.5 p-10 -103.23 128.42 50.24 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 122.483 1.135 . . . . 83.59 110.341 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.34 123.88 19.41 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 108.123 -1.066 . . . . 50.89 108.123 178.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.4 mttp -83.43 -8.7 59.34 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.297 -0.877 . . . . 99.16 109.758 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.404 ' HB ' ' CD2' ' A' ' 24' ' ' HIS . 6.3 mm -83.14 -70.0 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.767 -1.208 . . . . 112.28 110.618 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 24.2 p -94.42 -23.9 17.56 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 120.816 -1.177 . . . . 82.08 111.215 -178.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 101.93 37.32 3.44 Favored Glycine 0 N--CA 1.504 3.226 0 C-N-CA 119.214 -1.47 . . . . 195.93 114.047 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -113.86 161.87 17.05 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.556 -1.556 . . . . 114.22 107.512 177.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.3 t -114.02 166.3 11.74 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.377 -1.452 . . . . 78.05 112.739 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.544 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 53.0 m-85 -143.18 127.94 18.22 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 114.643 -1.162 . . . . 54.66 109.775 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.632 ' NZ ' ' NH1' ' A' ' 13' ' ' ARG . 7.0 mtmp? -70.36 -24.45 62.97 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.609 0.719 . . . . 101.13 109.433 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.884 ' HE ' ' H ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -118.5 138.24 52.65 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.611 -0.681 . . . . 74.89 109.309 -178.642 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.474 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 22.9 t -59.87 -34.13 72.74 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 120.95 -1.094 . . . . 25.87 108.706 -179.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.46 -44.18 97.03 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 121.245 -0.909 . . . . 23.45 109.004 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.546 ' OG1' ' HB2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -61.51 -32.72 72.77 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 106.977 -1.49 . . . . 32.27 106.977 179.675 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.422 HD22 ' HB3' ' A' ' 2' ' ' PHE . 18.5 tp -73.83 -37.64 64.79 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.112 -1.44 . . . . 97.78 107.112 177.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.649 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 31.9 p -57.6 -58.53 7.93 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 120.796 -1.19 . . . . 34.23 109.195 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.429 ' N ' ' OG ' ' A' ' 18' ' ' SER . 97.0 m -57.07 -34.96 68.81 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 122.026 0.917 . . . . 30.69 108.961 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 62.1 t60 -65.94 -49.55 67.52 Favored 'General case' 0 C--N 1.295 -1.761 0 O-C-N 121.003 -1.061 . . . . 81.83 108.488 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 71.1 mt -55.25 -30.27 59.71 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 106.743 -1.577 . . . . 156.93 106.743 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 18' ' ' SER . 26.0 mt -70.9 -29.2 65.2 Favored 'General case' 0 C--O 1.208 -1.088 0 N-CA-C 108.178 -1.045 . . . . 64.07 108.178 178.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.69 HD11 ' P ' ' B' ' 109' ' ' ' DA' . 65.4 mt -62.14 -36.1 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 O-C-N 119.877 -1.764 . . . . 150.1 107.728 177.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.404 ' CD2' ' HB ' ' A' ' 6' ' ' ILE . 88.7 m-70 -80.97 -31.15 34.92 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 118.765 -1.174 . . . . 55.94 111.192 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.8 m -92.98 -5.0 51.66 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.173 -1.579 . . . . 89.1 108.875 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 46.21 73.22 0.18 Allowed 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 109.245 -0.65 . . . . 62.89 109.245 -178.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.5 m -107.84 122.59 47.08 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.53 -0.915 . . . . 115.68 108.53 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -139.02 85.55 15.86 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.078 -1.014 . . . . 115.33 109.974 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -83.07 7.84 4.97 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 122.498 2.132 . . . . 90.27 113.388 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -112.27 93.94 24.38 Favored Pre-proline 0 N--CA 1.499 1.982 0 O-C-N 120.988 -1.07 . . . . 131.19 109.036 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.485 ' CB ' ' HE ' ' A' ' 38' ' ' ARG . 93.0 Cg_endo -85.78 129.29 3.5 Favored 'Trans proline' 0 N--CA 1.491 1.325 0 C-N-CA 122.636 2.224 . . . . 108.54 115.099 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.577 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -55.43 135.11 50.66 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.017 -1.105 . . . . 43.4 108.017 177.374 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -80.55 -16.27 54.62 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 121.826 -0.546 . . . . 113.04 110.954 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.48 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 13.9 m-85 -109.77 -66.61 1.05 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.603 -1.311 . . . . 118.47 112.333 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.577 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.9 p -91.01 12.72 18.84 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.602 -1.311 . . . . 56.06 112.209 -178.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 37' ' ' LYS . . . 69.79 -11.44 1.84 Allowed Glycine 0 N--CA 1.511 3.651 0 O-C-N 121.099 -1.001 . . . . 19.15 115.581 175.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.417 ' C ' ' O ' ' A' ' 36' ' ' GLY . 21.9 tttp -46.55 154.44 0.3 Allowed 'General case' 0 N--CA 1.507 2.411 0 CA-C-N 120.423 2.111 . . . . 73.47 108.717 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.485 ' HE ' ' CB ' ' A' ' 31' ' ' PRO . 1.1 mmt85 -120.23 147.6 44.74 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 120.081 -1.637 . . . . 160.56 109.785 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.541 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 77.5 m-85 -128.7 171.86 11.79 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.537 -0.727 . . . . 72.45 109.373 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.592 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 2.8 p-80 -109.58 -8.43 14.99 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.828 -0.545 . . . . 97.77 111.108 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -128.52 123.13 32.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.745 -1.222 . . . . 106.11 109.708 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -43.88 -66.1 0.42 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.887 -1.133 . . . . 136.29 111.177 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 21.9 t -47.18 -33.28 5.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.356 -0.84 . . . . 65.22 111.094 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -69.09 -45.2 70.86 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.129 -1.029 . . . . 40.66 108.28 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.554 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 35.7 ttp -63.03 -46.18 88.8 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.215 -1.402 . . . . 31.66 107.215 177.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.557 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 3.9 mmpt? -52.04 -40.74 61.54 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.33 -0.989 . . . . 103.12 108.33 -179.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 51' ' ' ILE . 42.6 mtmt -63.14 -32.83 74.31 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 107.272 -1.381 . . . . 48.51 107.272 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.554 ' HB3' ' O ' ' A' ' 45' ' ' MET . 53.6 t60 -69.4 -65.82 0.66 Allowed 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 106.753 -1.573 . . . . 65.66 106.753 177.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.557 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 25.6 p -42.38 -30.43 0.33 Allowed 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.832 -1.168 . . . . 47.02 109.936 177.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.56 ' CD1' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-30 -73.46 -34.99 65.66 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.301 -0.875 . . . . 54.63 110.283 -179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 48' ' ' HIS . 19.2 pt -69.13 -22.28 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 C-N-CA 118.191 -1.404 . . . . 99.09 107.583 177.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.458 ' CE1' ' HB2' ' A' ' 34' ' ' TYR . 45.0 m-70 -79.72 -32.48 41.2 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.022 -1.048 . . . . 59.33 108.86 176.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.505 HG23 ' O ' ' A' ' 49' ' ' THR . 76.3 p -87.88 -11.98 46.13 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.709 -0.62 . . . . 97.33 112.175 -177.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.57 19.58 65.83 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 107.87 -2.092 . . . . 23.68 107.87 -177.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.56 ' OE1' ' CD1' ' A' ' 50' ' ' PHE . 32.3 mt-10 -79.14 130.24 35.29 Favored 'General case' 0 C--N 1.306 -1.3 0 O-C-N 121.379 -1.071 . . . . 47.26 110.922 -177.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -145.85 62.47 8.41 Favored Pre-proline 0 N--CA 1.49 1.567 0 N-CA-C 109.065 -0.717 . . . . 86.79 109.065 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -53.1 -15.47 5.09 Favored 'Trans proline' 0 N--CA 1.501 1.962 0 C-N-CA 123.132 2.554 . . . . 151.44 113.314 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.596 ' CE1' ' OG ' ' A' ' 70' ' ' SER . 95.9 m-70 -94.54 96.16 9.28 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.85 -1.156 . . . . 42.67 108.86 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.444 ' O ' ' C ' ' A' ' 60' ' ' CYS . 95.9 mttt -93.6 120.46 33.9 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.035 -1.041 . . . . 72.96 110.615 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.664 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 3.9 t -38.47 -86.68 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.728 -0.607 . . . . 38.91 109.765 179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.664 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 8.7 mm100 117.1 -16.51 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.732 0 CA-C-O 122.173 0.987 . . . . 124.0 108.804 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.47 HG11 ' CG ' ' A' ' 80' ' ' HIS . 5.6 t -95.86 -63.04 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 CA-C-O 121.776 0.798 . . . . 56.07 109.994 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 23.8 p -101.42 -14.05 17.72 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.856 -0.528 . . . . 63.83 111.647 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.71 27.43 9.04 Favored Glycine 0 N--CA 1.504 3.207 0 O-C-N 120.372 -1.455 . . . . 23.81 111.709 178.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -105.37 164.0 12.19 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.514 -1.58 . . . . 120.74 107.41 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.444 ' C ' ' CD2' ' A' ' 67' ' ' PHE . . . -134.27 163.22 30.11 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.897 -1.127 . . . . 39.51 111.518 -177.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.444 ' CD2' ' C ' ' A' ' 66' ' ' ALA . 66.2 m-85 -145.5 147.18 31.87 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 122.569 1.176 . . . . 62.57 113.548 -177.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 78.6 p -81.6 -10.72 59.36 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 115.266 -0.879 . . . . 84.84 109.193 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -133.63 145.06 49.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.214 -0.928 . . . . 93.39 110.646 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.596 ' OG ' ' CE1' ' A' ' 58' ' ' HIS . 10.0 m -71.2 -47.44 57.42 Favored 'General case' 0 C--O 1.197 -1.685 0 C-N-CA 119.45 -0.9 . . . . 67.34 109.135 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.616 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.6 OUTLIER -50.45 -33.22 20.26 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.193 -0.942 . . . . 68.68 108.58 179.675 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -77.37 -34.09 55.12 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.976 -1.078 . . . . 33.83 108.347 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.0 tp -73.28 -39.41 65.39 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.105 -1.072 . . . . 75.65 108.105 177.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' A' ' 71' ' ' SER . 93.0 mt -57.86 -53.79 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 O-C-N 120.768 -1.207 . . . . 27.72 108.666 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.475 ' HA ' ' HE ' ' A' ' 78' ' ' ARG . 97.4 m -59.08 -43.86 91.83 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.865 -1.147 . . . . 95.2 108.372 179.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.409 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 31.8 t60 -58.54 -43.34 89.22 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 122.563 1.173 . . . . 66.3 108.149 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 36.4 t -68.38 -34.51 76.18 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.173 -0.955 . . . . 87.23 109.279 178.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.475 ' HE ' ' HA ' ' A' ' 75' ' ' THR . 28.1 mtm180 -61.38 -33.68 74.07 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 107.948 -1.13 . . . . 73.27 107.948 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.431 ' NZ ' ' OP2' ' B' ' 103' ' ' ' DT' . 0.0 OUTLIER -64.34 -47.9 77.59 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 107.19 -1.411 . . . . 80.85 107.19 178.339 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.47 ' CG ' HG11 ' A' ' 62' ' ' VAL . 53.3 m-70 -61.05 -44.96 96.61 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 117.834 -1.547 . . . . 46.01 109.077 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 33.8 m -50.31 -54.8 18.85 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.442 -0.786 . . . . 89.5 110.383 -177.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.65 -1.38 . . . . 8.65 109.65 179.995 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.946 0 C4'-C3'-C2' 104.737 1.537 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.794 0 O4'-C4'-C3' 107.212 1.612 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' ' DT' . . . . . 0.446 ' O4 ' ' O4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.848 0 C1'-O4'-C4' 106.506 -2.281 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' ' DA' . . . . . 0.562 ' C6 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.861 0 O4'-C4'-C3' 107.212 1.612 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' ' DA' . . . . . 0.58 ' C2 ' ' C4 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.12 0 O4'-C4'-C3' 107.163 1.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.58 ' C4 ' ' C2 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.93 0 O4'-C4'-C3' 107.551 1.951 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.539 2.059 0 C1'-O4'-C4' 106.547 -2.252 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.821 0 C1'-O4'-C4' 106.708 -2.137 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' ' DA' . . . . . 0.69 ' P ' HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C5'--C4' 1.521 1.252 0 O4'-C4'-C3' 107.04 1.44 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' ' DC' . . . . . 0.429 ' OP2' ' NH2' ' A' ' 13' ' ' ARG . . . . . . . . 0 C5'--C4' 1.526 1.888 0 O4'-C4'-C3' 107.109 1.509 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' ' DT' . . . . . 0.472 ' O2 ' ' C2 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.988 0 C1'-O4'-C4' 106.874 -2.018 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' ' DG' . . . . . 0.545 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.78 0 O4'-C4'-C3' 107.3 1.7 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.545 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.096 0 C1'-O4'-C4' 107.656 -1.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.825 0 C1'-O4'-C4' 107.162 -1.813 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.909 0 C4'-C3'-C2' 104.751 1.551 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.937 0 O4'-C4'-C3' 107.385 1.785 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.94 0 O4'-C4'-C3' 107.074 1.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.976 0 C1'-O4'-C4' 107.34 -1.685 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 203' ' ' ' DG' . . . . . 0.401 ' H8 ' ' HG ' ' A' ' 14' ' ' SER . . . . . . . . 0 O4'--C4' 1.425 -1.933 0 C1'-O4'-C4' 106.831 -2.05 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.051 0 C1'-O4'-C4' 107.362 -1.67 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.657 0 O4'-C4'-C3' 107.418 1.818 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 206' ' ' ' DA' . . . . . 0.524 ' C2 ' ' C5 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.809 0 O4'-C4'-C3' 107.352 1.752 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 207' ' ' ' DG' . . . . . 0.524 ' C5 ' ' C2 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.913 0 O4'-C4'-C3' 107.149 1.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.823 0 C1'-O4'-C4' 107.243 -1.755 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 209' ' ' ' DG' . . . . . 0.546 ' N2 ' ' N3 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.807 0 O4'-C4'-C3' 107.415 1.815 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 210' ' ' ' DA' . . . . . 0.584 ' C2 ' ' C2 ' ' C' ' 211' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.523 1.555 0 O4'-C4'-C3' 107.476 1.876 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 211' ' ' ' DT' . . . . . 0.584 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -1.984 0 C1'-O4'-C4' 106.714 -2.133 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.686 0 C1'-O4'-C4' 106.703 -2.141 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 213' ' ' ' DT' . . . . . 0.514 ' C4 ' ' C6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.883 0 C1'-O4'-C4' 107.133 -1.833 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 214' ' ' ' DA' . . . . . 0.514 ' C6 ' ' C4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.238 0 O4'-C4'-C3' 107.275 1.675 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.968 0 C1'-O4'-C4' 107.006 -1.924 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.983 0 O4'-C4'-C3' 107.122 1.522 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.6 t . . . . . 0 N--CA 1.491 1.617 0 N-CA-C 109.089 -0.708 . . . . 65.13 109.089 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.548 ' CE1' ' N ' ' A' ' 14' ' ' SER . 13.7 m-85 -119.13 126.9 52.7 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.222 -0.924 . . . . 70.07 108.834 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -104.96 137.36 42.83 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 122.287 1.041 . . . . 83.59 112.016 -178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.41 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 0.5 OUTLIER -75.57 130.26 38.52 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-N 115.199 -0.91 . . . . 50.89 110.34 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -98.82 32.12 2.72 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 121.216 0.532 . . . . 99.16 109.617 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.473 HG21 ' CG ' ' A' ' 24' ' ' HIS . 5.2 mm -126.92 -78.38 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.293 -0.879 . . . . 112.28 108.82 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.54 ' SG ' ' N ' ' A' ' 8' ' ' GLY . 31.7 p -83.26 -52.07 6.9 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.559 -1.645 . . . . 82.08 106.559 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.54 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . 121.46 62.77 0.23 Allowed Glycine 0 N--CA 1.496 2.659 0 C-N-CA 119.761 -1.209 . . . . 195.93 113.401 176.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.41 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 34.6 tttt -131.11 161.6 31.73 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 106.357 -1.72 . . . . 114.22 106.357 176.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.3 p -115.37 167.91 10.44 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.094 -1.629 . . . . 78.05 112.466 -176.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.508 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 55.3 m-85 -145.43 131.95 19.79 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 115.078 -0.965 . . . . 54.66 110.966 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -19.57 63.07 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 115.788 -0.642 . . . . 101.13 110.035 -179.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.426 ' O ' ' OG1' ' A' ' 16' ' ' THR . 0.1 OUTLIER -124.9 136.81 54.12 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.32 -0.863 . . . . 74.89 109.975 -178.32 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.548 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 30.5 t -56.07 -33.12 64.72 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 118.975 -1.09 . . . . 25.87 108.337 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.5 p -65.22 -42.06 93.81 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.039 -0.726 . . . . 23.45 109.039 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.464 HG22 " C2'" ' B' ' 109' ' ' ' DA' . 0.2 OUTLIER -63.44 -33.25 75.14 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.336 -1.357 . . . . 32.27 107.336 179.555 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.444 HD22 ' HB3' ' A' ' 2' ' ' PHE . 16.7 tp -72.37 -46.32 55.91 Favored 'General case' 0 C--O 1.199 -1.59 0 N-CA-C 106.009 -1.848 . . . . 97.78 106.009 177.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.65 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 19.1 t -48.74 -58.84 4.16 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.162 -0.961 . . . . 34.23 108.505 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 87.4 m -54.61 -36.49 64.51 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.06 0.933 . . . . 30.69 109.163 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.508 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 64.4 t60 -68.21 -47.08 68.85 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-O 122.5 1.143 . . . . 81.83 108.269 179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 21' ' ' LEU . 72.9 mt -59.97 -34.35 73.18 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 106.448 -1.686 . . . . 156.93 106.448 179.221 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.65 ' HG ' ' O ' ' A' ' 18' ' ' SER . 7.0 mt -62.36 -31.18 71.79 Favored 'General case' 0 C--O 1.205 -1.246 0 N-CA-C 107.237 -1.394 . . . . 64.07 107.237 178.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.432 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 65.1 mt -63.01 -34.88 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.38 -1.45 . . . . 150.1 108.112 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.473 ' CG ' HG21 ' A' ' 6' ' ' ILE . 97.2 m-70 -85.59 -14.39 45.89 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.248 -0.981 . . . . 55.94 109.434 178.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.537 ' O ' ' C ' ' A' ' 26' ' ' ASP . 4.9 p -108.62 0.24 20.59 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.945 -1.097 . . . . 89.1 109.457 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.537 ' C ' ' O ' ' A' ' 25' ' ' SER . 9.9 m-20 27.88 51.5 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.323 0.582 . . . . 62.89 109.845 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.581 HG21 HD13 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -66.53 -47.09 74.01 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.882 -0.784 . . . . 115.68 108.882 179.601 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.434 ' H ' ' HD2' ' A' ' 28' ' ' ARG . 9.6 mpt_? 37.33 65.76 2.42 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.694 -0.629 . . . . 115.33 111.354 178.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 40' ' ' HIS . 70.7 Cg_endo -83.07 31.58 0.52 Allowed 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.998 2.465 . . . . 90.27 113.378 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -136.13 76.23 51.79 Favored Pre-proline 0 N--CA 1.5 2.066 0 O-C-N 120.795 -1.191 . . . . 131.19 108.605 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.43 ' HB3' ' HE ' ' A' ' 38' ' ' ARG . 18.5 Cg_exo -66.09 160.4 44.84 Favored 'Trans proline' 0 N--CA 1.502 2.028 0 C-N-CA 123.331 2.688 . . . . 108.54 114.681 -178.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.565 ' SG ' ' N ' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -83.79 136.53 34.11 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 122.058 0.932 . . . . 43.4 108.633 178.215 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -79.23 -16.92 55.77 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 115.842 -0.617 . . . . 113.04 109.772 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.538 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 18.1 m-85 -111.89 -71.02 0.78 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.779 -1.201 . . . . 118.47 112.634 -179.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.565 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 20.1 p -83.03 -18.72 38.73 Favored 'General case' 0 N--CA 1.517 2.883 0 O-C-N 120.331 -1.481 . . . . 56.06 113.7 -177.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.567 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 114.05 -35.01 4.68 Favored Glycine 0 N--CA 1.511 3.65 0 O-C-N 120.189 -1.569 . . . . 19.15 113.518 176.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.567 ' O ' ' O ' ' A' ' 36' ' ' GLY . 5.8 mtpm? -26.57 149.34 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.862 0 O-C-N 121.075 -1.25 . . . . 73.47 110.772 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.433 ' NH2' ' O ' ' A' ' 36' ' ' GLY . 3.2 mmp_? -116.89 136.61 52.81 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.823 -1.176 . . . . 160.56 107.823 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.424 ' CZ ' ' CG ' ' A' ' 48' ' ' HIS . 34.1 m-85 -124.91 176.78 6.41 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.311 -0.996 . . . . 72.45 108.311 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.63 ' O ' ' CD2' ' A' ' 40' ' ' HIS . 1.5 t-80 -113.34 -19.38 11.76 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.73 -0.788 . . . . 97.77 111.563 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.473 ' O ' ' HB2' ' A' ' 44' ' ' ASP . 67.5 mt-30 -121.88 128.43 51.59 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 120.728 -1.232 . . . . 106.11 111.635 -178.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.42 ' C ' ' O ' ' A' ' 41' ' ' GLN . 35.1 tptt -41.98 -71.05 0.09 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.227 -0.921 . . . . 136.29 110.109 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.411 ' C ' ' O ' ' A' ' 42' ' ' LYS . 26.0 p -43.5 -29.26 0.44 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.909 -1.12 . . . . 65.22 110.619 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 41' ' ' GLN . 4.8 m-20 -70.57 -47.59 59.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.377 -1.452 . . . . 40.66 107.822 178.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.497 ' O ' ' N ' ' A' ' 48' ' ' HIS . 6.0 tmm? -63.98 -48.01 78.12 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.425 -1.422 . . . . 31.66 107.796 178.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.579 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 90.2 mttt -51.1 -36.02 38.25 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.041 -1.096 . . . . 103.12 108.041 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.638 ' O ' HG23 ' A' ' 51' ' ' ILE . 30.3 mtpt -68.49 -34.52 76.06 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.106 -1.442 . . . . 48.51 107.106 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.813 ' O ' HG12 ' A' ' 51' ' ' ILE . 66.3 t60 -70.94 -64.49 0.89 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 106.9 -1.518 . . . . 65.66 106.9 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.579 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 16.9 p -42.66 -33.6 0.75 Allowed 'General case' 0 C--N 1.31 -1.148 0 O-C-N 120.414 -1.429 . . . . 47.02 108.775 177.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.531 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.1 m-85 -69.54 -28.06 65.69 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.057 -1.027 . . . . 54.63 108.233 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.813 HG12 ' O ' ' A' ' 48' ' ' HIS . 12.6 pt -73.34 -19.12 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 120.74 -1.225 . . . . 99.09 109.32 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.439 ' CD2' ' HB2' ' A' ' 34' ' ' TYR . 69.4 m-70 -89.9 -31.49 17.27 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.367 -1.458 . . . . 59.33 108.754 177.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.531 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 41.3 p -84.65 -20.73 30.84 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-N 115.345 -0.843 . . . . 97.33 109.329 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 71.72 49.06 25.41 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 108.606 -1.798 . . . . 23.68 108.606 -177.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.42 110.49 22.5 Favored 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.515 -0.991 . . . . 47.26 109.025 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -117.86 70.75 7.51 Favored Pre-proline 0 N--CA 1.494 1.725 0 O-C-N 121.5 -0.75 . . . . 86.79 110.556 -178.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -60.76 -8.2 8.91 Favored 'Trans proline' 0 N--CA 1.505 2.163 0 C-N-CA 123.841 3.027 . . . . 151.44 114.082 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.553 ' HB3' HD22 ' A' ' 73' ' ' LEU . 96.7 m-70 -101.83 93.0 5.07 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.549 -1.345 . . . . 42.67 108.315 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.457 ' CB ' ' NZ ' ' A' ' 59' ' ' LYS . 7.3 mtpm? -94.78 128.12 41.27 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.281 -0.887 . . . . 72.96 110.151 -178.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.1 OUTLIER -79.43 124.64 28.64 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.702 0.763 . . . . 38.91 109.586 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -85.66 11.26 11.23 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.254 -0.904 . . . . 124.0 110.046 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.827 HG11 ' CG ' ' A' ' 80' ' ' HIS . 22.3 t -98.81 -58.1 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 120.865 -1.147 . . . . 56.07 111.049 -178.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 31.8 p -107.15 -25.5 11.52 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.157 -0.964 . . . . 63.83 109.76 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 109.39 10.85 22.96 Favored Glycine 0 N--CA 1.5 2.94 0 O-C-N 120.901 -1.125 . . . . 23.81 111.687 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 tttm -88.81 174.54 7.92 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.446 -1.62 . . . . 120.74 108.765 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -137.65 150.38 47.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.761 -1.212 . . . . 39.51 111.419 -177.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.508 ' CZ ' ' ND1' ' A' ' 76' ' ' HIS . 63.8 m-85 -132.09 147.68 52.45 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 122.167 0.984 . . . . 62.57 111.534 -178.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.8 m -83.55 -19.6 35.33 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 108.934 -0.765 . . . . 84.84 108.934 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -122.53 146.1 47.71 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.121 -1.032 . . . . 93.39 111.697 -177.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 10.6 m -65.45 -40.82 93.69 Favored 'General case' 0 C--O 1.199 -1.571 0 N-CA-C 106.794 -1.558 . . . . 67.34 106.794 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.444 ' OG ' ' H72' ' C' ' 211' ' ' ' DT' . 29.5 t -50.24 -45.69 54.23 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.479 -0.763 . . . . 68.68 109.356 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -73.25 -30.99 63.84 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 118.72 -1.192 . . . . 33.83 109.459 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.553 HD22 ' HB3' ' A' ' 58' ' ' HIS . 18.2 tp -74.4 -39.76 62.47 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.869 -1.144 . . . . 75.65 108.987 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.453 HD13 " H3'" ' C' ' 209' ' ' ' DG' . 97.3 mt -63.6 -50.4 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 120.254 -1.529 . . . . 27.72 107.67 177.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.7 m -57.98 -49.8 75.58 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 122.286 1.041 . . . . 95.2 108.64 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.508 ' ND1' ' CZ ' ' A' ' 67' ' ' PHE . 28.3 t60 -58.64 -48.7 80.15 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.783 0.801 . . . . 66.3 110.717 -178.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.1 t -70.09 -34.29 72.97 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 120.136 -1.602 . . . . 87.23 108.656 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.406 ' CG ' ' O ' ' A' ' 74' ' ' ILE . 19.8 mmt180 -55.9 -32.13 63.46 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 107.083 -1.451 . . . . 73.27 107.083 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -69.29 -47.9 63.21 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.946 -1.131 . . . . 80.85 107.946 177.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.827 ' CG ' HG11 ' A' ' 62' ' ' VAL . 60.1 m-70 -56.98 -58.04 9.9 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 117.078 -1.849 . . . . 46.01 107.9 178.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 49.5 m -49.12 -52.27 27.11 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.102 -1.073 . . . . 89.5 108.102 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 109.392 -1.483 . . . . 8.65 109.392 179.928 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.973 0 C1'-O4'-C4' 107.391 -1.649 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.134 0 C4'-C3'-C2' 104.962 1.762 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.679 0 C1'-O4'-C4' 106.599 -2.215 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' ' DA' . . . . . 0.555 ' C6 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.064 0 O4'-C4'-C3' 107.009 1.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' ' DA' . . . . . 0.578 ' C6 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.935 0 C1'-O4'-C4' 107.362 -1.67 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.578 ' C6 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.431 -1.353 0 O4'-C4'-C3' 107.638 2.038 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.044 0 C1'-O4'-C4' 106.305 -2.425 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.135 0 C1'-O4'-C4' 106.721 -2.128 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' ' DA' . . . . . 0.533 ' C2 ' ' C2 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.441 0 O4'-C4'-C3' 107.067 1.467 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' ' DC' . . . . . 0.533 ' C2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.062 0 O4'-C4'-C3' 107.169 1.569 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' ' DT' . . . . . 0.496 ' C4 ' ' C4 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.844 0 C1'-O4'-C4' 107.213 -1.777 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' ' DG' . . . . . 0.606 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.835 0 O4'-C4'-C3' 106.795 1.195 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.606 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.984 0 O4'-C4'-C3' 107.074 1.474 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.046 0 C1'-O4'-C4' 107.399 -1.644 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.989 0 C1'-O4'-C4' 107.273 -1.733 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.99 0 O4'-C4'-C3' 107.344 1.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.01 0 C4'-C3'-C2' 104.738 1.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.859 0 O4'-C4'-C3' 107.178 1.578 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.009 0 C1'-O4'-C4' 107.095 -1.86 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.085 0 C1'-O4'-C4' 107.309 -1.708 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.846 0 O4'-C4'-C3' 107.124 1.524 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.757 0 O4'-C4'-C3' 107.311 1.711 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 207' ' ' ' DG' . . . . . 0.438 ' N2 ' ' O2 ' ' B' ' 111' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.865 0 O4'-C4'-C3' 107.319 1.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 208' ' ' ' DT' . . . . . 0.419 ' C2 ' ' C2 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.987 0 C1'-O4'-C4' 107.153 -1.819 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 209' ' ' ' DG' . . . . . 0.453 " H3'" HD13 ' A' ' 74' ' ' ILE . . . . . . . . 0 C5'--C4' 1.526 1.924 0 O4'-C4'-C3' 107.153 1.553 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 210' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.892 0 O4'-C4'-C3' 107.399 1.799 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 211' ' ' ' DT' . . . . . 0.444 ' H72' ' OG ' ' A' ' 71' ' ' SER . . . . . . . . 0 O4'--C4' 1.425 -1.864 0 C1'-O4'-C4' 106.378 -2.373 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.765 0 C1'-O4'-C4' 106.472 -2.306 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.912 0 C1'-O4'-C4' 106.895 -2.003 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 214' ' ' ' DA' . . . . . 0.451 ' C5 ' ' C4 ' ' C' ' 215' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.996 0 O4'-C4'-C3' 107.362 1.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 215' ' ' ' DT' . . . . . 0.451 ' C4 ' ' C5 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.424 -2.044 0 C1'-O4'-C4' 107.227 -1.766 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.915 0 O4'-C4'-C3' 107.028 1.428 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.2 t . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.397 -0.594 . . . . 2.19 109.397 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 2' ' ' PHE . 0.4 OUTLIER -111.55 127.88 55.86 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 107.51 -1.293 . . . . 1.35 107.51 178.872 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.573 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 0.5 OUTLIER -110.63 132.99 53.71 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 122.532 1.158 . . . . 1.67 110.95 -178.755 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.29 129.82 41.88 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 113.886 -1.506 . . . . 0.92 111.037 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -103.64 30.6 4.93 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.276 -0.89 . . . . 2.46 109.315 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.615 HD12 ' CD2' ' A' ' 24' ' ' HIS . 29.0 mt -121.45 -29.59 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 119.754 -0.778 . . . . 1.51 111.0 -178.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.5 p -142.07 -27.75 0.63 Allowed 'General case' 0 C--N 1.298 -1.667 0 C-N-CA 118.995 -1.082 . . . . 1.5 109.784 -179.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 112.06 61.58 0.46 Allowed Glycine 0 N--CA 1.498 2.792 0 C-N-CA 119.489 -1.338 . . . . 1.27 114.1 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.0 tttm -142.83 150.95 40.6 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.543 -1.563 . . . . 1.33 107.817 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 3' ' ' ASP . 3.6 p -109.86 158.8 17.8 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.731 -1.231 . . . . 0.8 111.911 -176.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.629 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 63.1 m-85 -136.68 128.17 28.55 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 115.275 -0.875 . . . . 0.7 111.335 -178.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -69.99 -21.1 63.26 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 115.447 -0.797 . . . . 2.61 108.96 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.401 ' HB2' ' OG1' ' A' ' 16' ' ' THR . 0.0 OUTLIER -127.82 140.82 51.8 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 122.123 0.964 . . . . 2.04 109.976 -177.762 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.5 t -59.49 -33.36 71.24 Favored 'General case' 0 C--N 1.289 -2.029 0 O-C-N 120.48 -1.388 . . . . 1.27 107.411 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.1 p -61.55 -52.0 66.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 119.94 -0.704 . . . . 1.48 109.462 -178.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.468 HG22 H2'' ' B' ' 109' ' ' ' DA' . 0.0 OUTLIER -58.2 -36.02 72.5 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.184 -1.043 . . . . 0.95 108.184 -179.865 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.8 tp -69.62 -40.51 76.55 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 107.128 -1.434 . . . . 0.62 107.128 177.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.674 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.5 t -53.12 -50.25 64.88 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.283 -0.886 . . . . 0.74 109.389 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 74.9 m -65.09 -38.26 90.17 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.948 -1.095 . . . . 1.2 108.816 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.629 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 43.8 t60 -61.27 -41.95 97.8 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.218 -1.03 . . . . 0.8 108.218 178.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 54.2 mt -62.51 -35.34 79.08 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 106.969 -1.493 . . . . 0.82 106.969 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 18' ' ' SER . 31.9 mt -65.5 -30.05 70.77 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.643 -1.243 . . . . 1.16 107.643 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.525 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 67.8 mt -59.87 -40.11 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 O-C-N 120.102 -1.624 . . . . 1.38 106.64 177.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.615 ' CD2' HD12 ' A' ' 6' ' ' ILE . 77.7 m-70 -72.76 -60.88 2.02 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 118.432 -1.307 . . . . 1.29 109.44 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.424 ' O ' ' C ' ' A' ' 26' ' ' ASP . 20.2 m -62.11 -5.7 2.45 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.835 -1.165 . . . . 1.63 112.148 -178.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 25' ' ' SER . 65.3 m-20 43.73 63.18 1.66 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.844 -1.16 . . . . 1.45 109.132 -177.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.546 ' C ' HH11 ' A' ' 28' ' ' ARG . 1.8 m -99.4 111.26 23.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.424 -0.797 . . . . 1.22 109.294 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.546 HH11 ' C ' ' A' ' 27' ' ' THR . 1.7 mpt_? -125.45 79.22 67.25 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.47 -0.769 . . . . 0.97 110.225 -179.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -78.54 9.08 3.33 Favored 'Trans proline' 0 C--N 1.313 -1.314 0 C-N-CA 122.682 2.255 . . . . 1.1 112.437 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.507 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 60.0 m-85 -117.92 84.94 21.98 Favored Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 121.303 -0.873 . . . . 0.8 109.435 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -83.43 143.03 10.85 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.321 2.014 . . . . 0.85 112.943 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.478 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -67.15 149.72 50.11 Favored 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 119.298 -0.961 . . . . 0.51 109.796 -179.307 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.447 HE21 HG21 ' A' ' 49' ' ' THR . 0.4 OUTLIER -87.42 -23.54 24.48 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.93 -0.708 . . . . 1.31 111.633 -178.53 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.491 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 5.2 m-85 -102.91 -69.78 0.78 Allowed 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 117.364 -1.734 . . . . 0.76 111.289 -179.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 15.3 p -81.15 -23.34 38.34 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.559 -1.338 . . . . 0.51 111.728 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.609 ' O ' ' NH1' ' A' ' 38' ' ' ARG . . . 102.72 -4.33 50.05 Favored Glycine 0 N--CA 1.514 3.855 0 O-C-N 120.201 -1.562 . . . . 0.54 116.441 174.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.5 ' C ' ' O ' ' A' ' 36' ' ' GLY . 36.0 mttp -47.14 156.91 0.2 Allowed 'General case' 0 N--CA 1.509 2.489 0 CA-C-N 122.39 3.095 . . . . 1.38 108.649 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.609 ' NH1' ' O ' ' A' ' 36' ' ' GLY . 9.6 mmt-85 -111.09 123.54 50.4 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 107.465 -1.309 . . . . 2.11 107.465 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.459 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 82.9 m-85 -113.85 164.62 13.52 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.712 -1.242 . . . . 0.69 109.889 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.512 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -103.19 -6.64 21.94 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 116.243 -0.435 . . . . 1.03 111.073 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -133.33 119.67 20.03 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.538 -1.351 . . . . 1.03 110.201 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.507 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 71.8 tttt -41.61 -61.32 1.1 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.521 -0.737 . . . . 0.59 110.895 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.4 p -53.7 -30.14 42.28 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.254 -0.904 . . . . 1.42 111.971 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 47' ' ' LYS . 51.4 m-20 -76.67 -39.71 51.3 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 117.385 -1.726 . . . . 1.48 107.588 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.655 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 7.6 tmm? -60.81 -46.72 89.44 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 105.728 -1.953 . . . . 0.48 105.728 176.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.511 ' O ' ' OG1' ' A' ' 49' ' ' THR . 59.8 tttp -54.2 -38.0 65.16 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.105 -1.072 . . . . 2.61 108.105 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.576 ' O ' HG23 ' A' ' 51' ' ' ILE . 47.5 mtpt -66.47 -32.65 74.14 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 106.582 -1.636 . . . . 1.55 106.582 177.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.684 ' O ' HG12 ' A' ' 51' ' ' ILE . 71.0 t60 -64.74 -60.12 3.47 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 107.016 -1.476 . . . . 0.45 107.016 176.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.511 ' OG1' ' O ' ' A' ' 46' ' ' LYS . 54.2 p -47.46 -36.67 10.39 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 120.944 -1.098 . . . . 0.56 111.154 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.443 ' CD1' ' OE1' ' A' ' 55' ' ' GLU . 3.2 m-85 -69.3 -31.77 70.46 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.633 -1.292 . . . . 0.8 109.666 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.684 HG12 ' O ' ' A' ' 48' ' ' HIS . 3.0 pt -65.21 -32.49 58.49 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.236 0 C-N-CA 118.423 -1.311 . . . . 0.76 108.159 177.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.444 ' CE1' ' HB2' ' A' ' 34' ' ' TYR 0.251 60.6 m-70 -77.07 -33.88 57.08 Favored 'General case' 0 N--CA 1.537 3.879 0 O-C-N 120.492 -1.38 . . . . 0.84 111.054 177.48 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 49' ' ' THR . 73.9 p -79.66 -16.68 55.31 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 106.17 -1.789 . . . . 0.99 106.17 -178.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 67.58 68.98 1.48 Allowed Glycine 0 C--O 1.203 -1.831 0 N-CA-C 104.396 -3.481 . . . . 1.09 104.396 -174.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.443 ' OE1' ' CD1' ' A' ' 50' ' ' PHE . 50.1 mt-10 -120.91 128.48 52.82 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.449 -0.945 . . . . 1.92 108.449 -179.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.9 mmtm -133.36 79.03 61.9 Favored Pre-proline 0 C--N 1.297 -1.702 0 C-N-CA 119.938 -0.705 . . . . 1.27 109.335 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.87 0.9 5.05 Favored 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 122.158 1.905 . . . . 0.77 112.801 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.5 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 97.1 m-70 -112.85 89.86 3.19 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.101 -1.0 . . . . 0.75 108.851 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.434 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 62.3 mttp -94.5 133.43 38.12 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.092 -1.005 . . . . 1.79 112.268 -177.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.405 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -80.35 117.81 21.44 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 106.821 -1.548 . . . . 0.39 106.821 176.875 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.434 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 22.0 mm-40 -84.19 12.64 6.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.56 -0.713 . . . . 2.78 109.221 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.405 ' HB ' ' SG ' ' A' ' 60' ' ' CYS . 13.7 t -98.03 -65.67 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.888 0 C-N-CA 120.044 -0.662 . . . . 0.47 111.088 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.2 p -107.26 -7.62 16.68 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.504 -0.878 . . . . 0.59 113.179 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 111.25 -11.78 28.76 Favored Glycine 0 N--CA 1.515 3.963 0 C-N-CA 118.437 -1.84 . . . . 0.53 113.884 176.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -78.58 169.11 18.77 Favored 'General case' 0 N--CA 1.509 2.515 0 CA-C-N 120.171 1.986 . . . . 0.77 111.526 -177.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -138.42 150.67 46.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.374 -0.829 . . . . 0.65 109.487 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.573 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 35.9 m-85 -133.31 152.38 51.92 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 122.482 1.134 . . . . 0.56 112.794 -177.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.9 p -81.62 -29.94 33.04 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 115.055 -0.975 . . . . 1.64 108.537 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -117.28 146.91 43.0 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 122.114 0.959 . . . . 1.59 111.604 -178.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.451 ' O ' HG13 ' A' ' 74' ' ' ILE . 6.1 m -65.96 -44.07 86.06 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 118.792 -1.163 . . . . 1.23 107.937 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.582 ' OG ' ' H73' ' C' ' 211' ' ' ' DT' . 15.2 t -49.13 -42.49 39.52 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.149 -0.969 . . . . 1.8 109.136 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.8 m-20 -71.48 -33.71 69.53 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 117.673 -1.611 . . . . 0.82 108.096 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 58' ' ' HIS . 11.1 tp -64.62 -52.43 57.51 Favored 'General case' 0 N--CA 1.504 2.23 0 N-CA-C 106.182 -1.784 . . . . 0.52 106.182 175.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 70' ' ' SER . 45.1 mt -52.13 -55.52 9.72 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 O-C-N 121.135 -0.978 . . . . 0.83 110.865 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.0 m -59.63 -41.52 90.63 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 119.778 -1.826 . . . . 0.7 107.725 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.573 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 42.0 t60 -62.04 -45.42 93.65 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.951 0.881 . . . . 0.42 109.726 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 38.8 t -68.11 -32.89 73.51 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.003 -1.11 . . . . 0.56 108.003 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -61.04 -38.79 87.4 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.768 -1.197 . . . . 1.7 107.768 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -44.86 95.03 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 118.185 -1.406 . . . . 1.93 107.331 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -57.83 -53.37 58.98 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 118.014 -1.474 . . . . 0.65 109.273 178.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 56.5 p -58.85 -48.02 82.85 Favored 'General case' 0 C--N 1.296 -1.75 0 C-N-CA 118.391 -1.323 . . . . 1.03 108.999 -177.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.041 0 C-N-CA 118.948 -1.596 . . . . 1.85 109.797 179.102 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.805 0 C4'-C3'-C2' 104.739 1.539 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' ' DA' . . . . . 0.546 ' C2 ' ' C2 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.424 -1.998 0 C4'-C3'-C2' 104.847 1.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' ' DT' . . . . . 0.546 ' C2 ' ' C2 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.833 0 C1'-O4'-C4' 106.48 -2.3 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' ' DA' . . . . . 0.584 ' C6 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.174 0 O4'-C4'-C3' 107.26 1.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' ' DA' . . . . . 0.584 ' C6 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.072 0 C1'-O4'-C4' 107.569 -1.522 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.558 ' N1 ' ' C6 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.653 0 O4'-C4'-C3' 107.737 2.137 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.071 0 C1'-O4'-C4' 106.28 -2.443 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' ' DC' . . . . . 0.525 " H3'" HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C5'--C4' 1.527 1.943 0 C1'-O4'-C4' 107.308 -1.709 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' ' DA' . . . . . 0.539 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.532 1.42 0 N19-C1'-C2' 117.193 1.87 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' ' DC' . . . . . 0.539 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.953 0 P-O3'-C3' 121.761 1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' ' DT' . . . . . 0.478 ' O2 ' ' N2 ' ' C' ' 207' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.19 0 C4'-C3'-C2' 104.809 1.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' ' DG' . . . . . 0.521 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.853 0 O4'-C4'-C3' 107.02 1.42 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.521 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.145 0 O4'-C4'-C3' 107.297 1.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.008 0 C1'-O4'-C4' 107.58 -1.514 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.812 0 C1'-O4'-C4' 107.156 -1.817 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.95 0 O4'-C4'-C3' 107.402 1.802 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.852 0 O4'-C4'-C3' 107.143 1.543 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.778 0 C4'-C3'-C2' 104.89 1.69 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.018 0 C1'-O4'-C4' 107.254 -1.747 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.992 0 C1'-O4'-C4' 107.071 -1.878 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.692 0 O4'-C4'-C3' 107.351 1.751 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.926 0 O4'-C4'-C3' 107.259 1.659 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 207' ' ' ' DG' . . . . . 0.478 ' N2 ' ' O2 ' ' B' ' 111' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.901 0 O4'-C4'-C3' 107.286 1.686 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.202 0 C1'-O4'-C4' 107.384 -1.654 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 209' ' ' ' DG' . . . . . 0.45 ' OP2' ' CB ' ' A' ' 70' ' ' SER . . . . . . . . 0 C5'--C4' 1.525 1.771 0 O4'-C4'-C3' 107.558 1.958 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 210' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.789 0 O4'-C4'-C3' 107.302 1.702 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 211' ' ' ' DT' . . . . . 0.582 ' H73' ' OG ' ' A' ' 71' ' ' SER . . . . . . . . 0 O4'--C4' 1.426 -1.801 0 C1'-O4'-C4' 106.074 -2.59 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.896 0 C1'-O4'-C4' 106.578 -2.23 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.014 0 C1'-O4'-C4' 106.861 -2.028 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 214' ' ' ' DA' . . . . . 0.519 ' C2 ' ' C2 ' ' C' ' 215' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.91 0 O4'-C4'-C3' 107.191 1.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 215' ' ' ' DT' . . . . . 0.519 ' C2 ' ' C2 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.02 0 C1'-O4'-C4' 107.294 -1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.944 0 O4'-C4'-C3' 107.172 1.572 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.5 t . . . . . 0 N--CA 1.488 1.471 0 N-CA-C 109.323 -0.621 . . . . 2.39 109.323 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.46 ' HB3' HD22 ' A' ' 17' ' ' LEU . 6.1 m-85 -109.97 125.51 52.94 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.188 -0.945 . . . . 1.96 109.633 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -109.18 144.91 36.64 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 122.474 1.13 . . . . 2.6 111.579 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -84.69 127.93 34.35 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.03 -0.986 . . . . 2.37 109.998 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.8 mttp -94.97 37.24 1.16 Allowed 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.207 -0.933 . . . . 2.62 109.455 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.664 HG21 ' CG ' ' A' ' 24' ' ' HIS . 12.8 mm -131.5 -26.75 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.488 -1.382 . . . . 2.82 112.345 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.4 p -136.78 -35.6 0.71 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.6 -1.312 . . . . 3.03 110.233 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.04 46.08 0.39 Allowed Glycine 0 N--CA 1.509 3.504 0 O-C-N 120.553 -1.342 . . . . 2.97 113.549 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -136.89 159.62 41.33 Favored 'General case' 0 N--CA 1.511 2.618 0 CA-C-N 119.286 1.543 . . . . 3.12 110.611 177.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.9 p -116.76 154.5 30.54 Favored 'General case' 0 N--CA 1.512 2.671 0 N-CA-C 113.913 1.079 . . . . 2.96 113.913 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -131.81 131.75 43.15 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-O 122.144 0.973 . . . . 2.27 111.746 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.684 ' H ' ' NH1' ' A' ' 13' ' ' ARG . 37.2 mmtm -74.61 -22.56 58.88 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 122.187 0.994 . . . . 3.79 109.259 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.684 ' NH1' ' H ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -118.21 136.12 53.84 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 115.172 -0.922 . . . . 2.93 111.39 -177.239 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 t -65.2 -34.34 78.15 Favored 'General case' 0 C--O 1.195 -1.809 0 C-N-CA 118.379 -1.328 . . . . 1.38 108.917 178.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 p -59.37 -37.48 78.0 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.318 -1.489 . . . . 1.5 109.718 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.529 HG21 ' OP2' ' B' ' 110' ' ' ' DC' . 29.8 m -73.77 -29.83 62.43 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.622 -1.298 . . . . 1.81 107.612 178.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.46 HD22 ' HB3' ' A' ' 2' ' ' PHE . 14.1 tp -72.45 -50.39 26.53 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 106.239 -1.764 . . . . 1.44 106.239 176.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.682 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 75.8 m -49.04 -61.27 2.16 Favored 'General case' 0 C--N 1.289 -2.044 0 O-C-N 120.835 -1.166 . . . . 1.27 109.071 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.657 HG23 ' NE2' ' A' ' 40' ' ' HIS . 27.3 m -52.78 -36.38 58.1 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.039 -1.038 . . . . 1.16 109.094 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -68.16 -44.76 75.25 Favored 'General case' 0 C--N 1.294 -1.807 0 O-C-N 121.303 -0.873 . . . . 2.02 109.17 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.0 mt -60.71 -29.25 69.23 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 105.532 -2.025 . . . . 1.55 105.532 177.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.682 ' HG ' ' O ' ' A' ' 18' ' ' SER . 27.3 mt -71.22 -27.34 63.41 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.745 -1.205 . . . . 1.16 107.745 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.546 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 66.8 mt -62.57 -44.4 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 120.086 -1.634 . . . . 1.98 108.268 178.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.664 ' CG ' HG21 ' A' ' 6' ' ' ILE . 77.2 m-70 -69.84 -59.35 2.99 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 118.455 -1.298 . . . . 2.25 108.99 177.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.4 m -58.5 -12.39 3.92 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.664 -1.272 . . . . 1.8 110.783 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.546 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 5.0 m-20 50.19 57.94 6.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.652 -0.655 . . . . 1.58 109.614 -178.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.8 m -90.42 105.66 17.97 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.31 -0.869 . . . . 2.67 109.596 179.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -122.74 80.56 48.78 Favored Pre-proline 0 N--CA 1.497 1.918 0 O-C-N 121.256 -0.902 . . . . 2.83 109.63 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -84.0 15.76 2.07 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 123.114 2.543 . . . . 1.56 114.361 -179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.489 ' CE1' ' HB2' ' A' ' 42' ' ' LYS . 85.8 m-85 -118.86 86.53 30.98 Favored Pre-proline 0 N--CA 1.501 2.114 0 O-C-N 120.963 -1.086 . . . . 1.4 108.476 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -82.93 128.85 5.24 Favored 'Trans proline' 0 C--N 1.31 -1.469 0 C-N-CA 122.739 2.293 . . . . 1.21 112.844 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.617 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 0.4 OUTLIER -47.94 142.6 4.84 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 122.426 1.108 . . . . 0.98 109.722 178.879 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.444 ' CG ' HG22 ' A' ' 49' ' ' THR . 0.0 OUTLIER -82.9 -11.83 57.87 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.549 -0.751 . . . . 1.62 109.925 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.541 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 22.9 m-85 -118.13 -73.88 0.63 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.429 -1.42 . . . . 0.85 111.168 -179.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.575 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 14.2 p -84.02 19.48 1.76 Allowed 'General case' 0 N--CA 1.515 2.813 0 CA-C-O 121.889 0.852 . . . . 1.04 110.242 -179.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.482 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 42.87 10.42 0.01 OUTLIER Glycine 0 N--CA 1.503 3.123 0 CA-C-N 114.095 -1.411 . . . . 1.17 114.407 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.617 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 69.6 tttt -52.42 172.84 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 121.977 2.888 . . . . 2.07 105.698 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.5 mtp85 -131.03 142.1 50.28 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 119.427 -2.046 . . . . 2.27 110.683 -178.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.503 ' HZ ' ' ND1' ' A' ' 48' ' ' HIS . 60.0 m-85 -126.6 167.47 15.62 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.748 -0.834 . . . . 1.16 108.748 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.657 ' NE2' HG23 ' A' ' 19' ' ' THR . 0.0 OUTLIER -100.59 -24.2 14.5 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.859 -0.526 . . . . 1.56 111.239 -178.764 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.456 ' O ' ' C ' ' A' ' 42' ' ' LYS . 46.8 mt-30 -118.02 116.8 27.62 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.277 -1.515 . . . . 1.75 111.607 -178.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.542 ' HZ3' ' HE2' ' A' ' 46' ' ' LYS . 62.6 tttm -34.02 -66.2 0.17 Allowed 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.058 -1.026 . . . . 2.19 112.32 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 93.4 p -48.62 -31.2 6.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.971 -1.081 . . . . 1.33 110.366 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.449 ' N ' ' O ' ' A' ' 41' ' ' GLN . 96.7 m-20 -70.09 -44.07 69.81 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.66 -1.275 . . . . 1.31 107.652 177.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.562 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 18.9 ttp -64.98 -46.16 82.63 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 120.696 -1.252 . . . . 1.01 107.976 177.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.542 ' HE2' ' HZ3' ' A' ' 42' ' ' LYS . 5.3 tppt? -53.31 -37.96 62.72 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.367 -1.346 . . . . 2.44 107.367 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.569 ' O ' HG23 ' A' ' 51' ' ' ILE . 9.4 mtpt -64.25 -33.18 75.23 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 106.25 -1.759 . . . . 2.65 106.25 177.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.717 ' O ' HG12 ' A' ' 51' ' ' ILE . 58.7 t60 -69.06 -62.61 1.31 Allowed 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 107.702 -1.221 . . . . 0.85 107.702 177.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.444 HG22 ' CG ' ' A' ' 33' ' ' GLN . 75.8 p -43.61 -36.05 1.98 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 120.639 -1.288 . . . . 0.78 110.329 178.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.619 ' CZ ' ' OE1' ' A' ' 55' ' ' GLU . 3.4 m-30 -68.59 -32.45 72.36 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 108.416 -0.957 . . . . 0.99 108.416 179.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.717 HG12 ' O ' ' A' ' 48' ' ' HIS . 7.1 pt -64.6 -31.81 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 C-N-CA 118.058 -1.457 . . . . 0.85 108.846 177.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 -77.74 -33.47 52.91 Favored 'General case' 0 N--CA 1.521 3.079 0 O-C-N 120.729 -1.232 . . . . 0.8 110.404 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.4 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 73.5 p -87.54 -6.98 58.1 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.92 0.867 . . . . 0.8 109.66 -179.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 52.71 69.84 1.08 Allowed Glycine 0 C--N 1.292 -1.881 0 N-CA-C 106.139 -2.784 . . . . 0.62 106.139 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.619 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 33.0 mt-10 -115.24 130.1 56.82 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 105.319 -2.104 . . . . 1.97 105.319 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.7 mttm -138.74 80.98 23.99 Favored Pre-proline 0 C--N 1.304 -1.373 0 O-C-N 120.911 -1.118 . . . . 2.28 110.467 -177.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -73.31 13.7 0.66 Allowed 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.863 2.375 . . . . 0.92 112.615 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -116.2 83.44 1.95 Allowed 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.045 -1.035 . . . . 1.23 110.064 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -87.18 138.41 31.51 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.122 -0.986 . . . . 1.73 111.434 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.576 ' SG ' ' HB ' ' A' ' 62' ' ' VAL . 0.0 OUTLIER -99.27 120.05 38.92 Favored 'General case' 0 C--N 1.289 -2.053 0 N-CA-C 107.383 -1.34 . . . . 0.94 107.383 177.537 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -85.36 16.46 3.69 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 108.619 -0.882 . . . . 2.73 108.619 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.764 HG11 ' CG ' ' A' ' 80' ' ' HIS . 20.1 t -95.25 -57.16 4.58 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.746 0 CA-C-O 121.622 0.725 . . . . 1.44 109.151 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.8 p -115.16 -7.65 12.42 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.495 -0.753 . . . . 0.98 111.775 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.4 -3.42 56.51 Favored Glycine 0 N--CA 1.509 3.503 0 O-C-N 120.143 -1.598 . . . . 0.69 112.779 177.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.7 tttp -84.26 153.44 23.57 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.266 -1.726 . . . . 2.33 111.885 -177.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -121.03 145.09 48.14 Favored 'General case' 0 N--CA 1.514 2.768 0 O-C-N 121.753 -0.592 . . . . 1.07 110.935 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.443 ' HZ ' ' CE1' ' A' ' 76' ' ' HIS . 31.3 m-85 -128.05 161.85 28.22 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 122.128 0.966 . . . . 1.67 112.689 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.9 t -84.86 -35.7 22.05 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 115.536 -0.756 . . . . 1.7 110.239 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -113.87 141.69 47.02 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 120.929 -1.107 . . . . 2.23 110.746 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.5 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.4 OUTLIER -63.04 -46.23 88.53 Favored 'General case' 0 C--O 1.202 -1.414 0 N-CA-C 108.03 -1.1 . . . . 2.66 108.03 178.219 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.457 ' C ' ' O ' ' A' ' 70' ' ' SER . 91.9 p -44.16 -39.59 4.43 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.023 -1.048 . . . . 2.76 108.695 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -76.29 -32.97 59.07 Favored 'General case' 0 C--N 1.293 -1.856 0 C-N-CA 118.783 -1.167 . . . . 2.42 108.721 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.5 ' N ' ' O ' ' A' ' 70' ' ' SER . 26.4 tp -70.33 -53.36 17.02 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 106.491 -1.67 . . . . 2.03 106.491 175.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.533 HD11 ' P ' ' C' ' 209' ' ' ' DG' . 86.9 mt -46.97 -54.58 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 O-C-N 121.029 -1.045 . . . . 2.95 109.065 177.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.519 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 21.1 m -60.06 -46.64 88.89 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-O 122.539 1.161 . . . . 3.09 108.97 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.443 ' CE1' ' HZ ' ' A' ' 67' ' ' PHE . 26.4 t60 -56.02 -48.07 76.62 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.655 -0.702 . . . . 2.35 109.613 -179.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -33.02 73.56 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 119.932 -1.73 . . . . 2.39 107.621 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 74' ' ' ILE . 35.0 mtp85 -54.34 -31.32 54.1 Favored 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 105.985 -1.857 . . . . 4.98 105.985 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -73.46 -49.89 24.48 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.223 -0.991 . . . . 3.18 108.765 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.764 ' CG ' HG11 ' A' ' 62' ' ' VAL . 61.5 m-70 -56.23 -61.67 2.23 Favored 'General case' 0 N--CA 1.501 2.08 0 C-N-CA 116.841 -1.943 . . . . 2.47 108.785 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 31.7 m -57.57 -53.1 61.99 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.264 -1.013 . . . . 3.27 108.264 -179.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.514 0 N-CA-C 109.363 -1.495 . . . . 3.59 109.363 179.862 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.773 0 C4'-C3'-C2' 104.834 1.634 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.077 0 C4'-C3'-C2' 104.823 1.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' ' DT' . . . . . 0.424 ' O4 ' ' O4 ' ' C' ' 213' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.678 0 C1'-O4'-C4' 105.899 -2.715 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' ' DA' . . . . . 0.509 ' C2 ' ' C4 ' ' B' ' 105' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.919 0 C1'-O4'-C4' 107.581 -1.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' ' DA' . . . . . 0.509 ' C4 ' ' C2 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 P--O5' 1.612 1.93 0 O4'-C4'-C3' 107.177 1.577 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.548 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.745 0 C1'-O4'-C4' 107.039 -1.901 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' ' DT' . . . . . 0.442 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.099 0 C1'-O4'-C4' 106.012 -2.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.912 0 O4'-C4'-C3' 107.113 1.513 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' ' DA' . . . . . 0.571 ' C4 ' ' C5 ' ' B' ' 110' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.576 0 C3'-C2'-C1' 99.961 -1.956 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' ' DC' . . . . . 0.571 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.657 0 P-O3'-C3' 122.011 1.926 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.536 1.812 0 C1'-O4'-C4' 107.16 -1.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' ' DG' . . . . . 0.608 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.723 0 O4'-C4'-C3' 107.454 1.854 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.608 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.814 0 C4'-C3'-C2' 104.787 1.587 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 C4'-C3'-C2' 105.09 1.89 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.744 0 O4'-C4'-C3' 107.222 1.622 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.06 0 O4'-C4'-C3' 107.449 1.849 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 201' ' ' ' DT' . . . . . 0.531 ' C2 ' ' N7 ' ' C' ' 202' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.85 0 O4'-C4'-C3' 107.217 1.617 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 202' ' ' ' DA' . . . . . 0.531 ' N7 ' ' C2 ' ' C' ' 201' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.087 0 O4'-C4'-C3' 107.433 1.833 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 203' ' ' ' DG' . . . . . 0.513 ' N2 ' ' N3 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.794 0 C4'-C3'-C2' 104.871 1.671 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 204' ' ' ' DG' . . . . . 0.513 ' N3 ' ' N2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.777 0 C1'-O4'-C4' 107.019 -1.915 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.992 0 C4'-C3'-C2' 104.904 1.704 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.824 0 O4'-C4'-C3' 107.47 1.87 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 207' ' ' ' DG' . . . . . 0.404 ' O6 ' ' N6 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.732 0 C4'-C3'-C2' 104.774 1.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.199 0 C4'-C3'-C2' 104.885 1.685 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 209' ' ' ' DG' . . . . . 0.533 ' P ' HD11 ' A' ' 74' ' ' ILE . . . . . . . . 0 C5'--C4' 1.527 1.96 0 O4'-C4'-C3' 107.067 1.467 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 210' ' ' ' DA' . . . . . 0.548 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.71 0 O4'-C4'-C3' 107.314 1.714 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 211' ' ' ' DT' . . . . . 0.41 ' C4 ' ' C6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.425 -1.868 0 C1'-O4'-C4' 106.085 -2.582 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.934 0 C1'-O4'-C4' 107.147 -1.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 213' ' ' ' DT' . . . . . 0.424 ' O4 ' ' O4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.588 0 C4'-C3'-C2' 104.779 1.579 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 214' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.863 0 O4'-C4'-C3' 107.299 1.699 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.052 0 C1'-O4'-C4' 107.111 -1.849 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.926 0 O4'-C4'-C3' 107.272 1.672 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.8 m . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 109.484 -0.562 . . . . 2.85 109.484 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.538 ' CE1' ' N ' ' A' ' 14' ' ' SER . 0.9 OUTLIER -99.29 125.09 44.85 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.011 -1.056 . . . . 2.01 108.517 179.627 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -107.53 135.61 48.7 Favored 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 122.539 1.161 . . . . 2.25 112.33 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.736 ' HB3' ' H ' ' A' ' 9' ' ' LYS . 4.1 t -60.5 121.35 11.91 Favored 'General case' 0 N--CA 1.499 2.021 0 CA-C-N 114.625 -1.171 . . . . 1.74 109.432 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.7 mttp -94.8 28.5 2.67 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.204 -0.935 . . . . 2.44 108.828 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.3 mm -128.86 -63.38 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 N-CA-C 107.538 -1.282 . . . . 2.36 107.538 -178.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.636 ' N ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -126.4 45.98 2.55 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 124.015 1.864 . . . . 2.54 110.0 179.29 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 20.45 60.73 0.01 OUTLIER Glycine 0 CA--C 1.568 3.403 0 N-CA-C 121.525 3.37 . . . . 2.38 121.525 172.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.736 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 9.9 ttmm -115.07 139.89 49.5 Favored 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 105.663 -1.977 . . . . 2.27 105.663 171.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.3 t -93.52 145.05 24.8 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-O 122.438 1.113 . . . . 2.56 112.715 -177.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.519 ' HZ ' ' ND1' ' A' ' 20' ' ' HIS . 77.3 m-85 -127.16 130.27 49.46 Favored 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 121.912 0.863 . . . . 2.14 110.204 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -68.92 -27.93 66.21 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.948 -0.76 . . . . 3.29 108.948 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.459 ' HD3' HH11 ' A' ' 13' ' ' ARG . 0.4 OUTLIER -121.65 140.51 52.18 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 121.699 0.762 . . . . 3.55 109.624 -178.928 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.538 ' N ' ' CE1' ' A' ' 2' ' ' PHE . 0.6 OUTLIER -60.2 -32.73 71.37 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 118.042 -1.463 . . . . 2.01 108.088 179.202 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 97.5 p -55.7 -60.95 2.72 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.192 -0.942 . . . . 2.71 109.069 -178.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.604 HG21 H2'' ' B' ' 109' ' ' ' DA' . 23.0 m -53.36 -32.12 47.82 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.517 -0.92 . . . . 2.37 108.517 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 tp -72.08 -39.72 68.76 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 118.077 -1.449 . . . . 1.37 107.657 177.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.736 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 58.6 m -53.01 -50.86 63.36 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.965 -1.084 . . . . 1.5 108.479 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.3 m -59.57 -36.63 76.58 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.975 0.893 . . . . 2.12 108.876 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.519 ' ND1' ' HZ ' ' A' ' 11' ' ' PHE . 23.4 t60 -69.01 -38.38 79.2 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 107.552 -1.277 . . . . 1.1 107.552 179.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.423 ' O ' ' N ' ' A' ' 24' ' ' HIS . 87.3 mt -67.41 -38.4 84.54 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 119.853 -1.78 . . . . 1.28 106.397 177.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.736 ' HG ' ' O ' ' A' ' 18' ' ' SER . 28.9 mt -56.17 -35.35 67.12 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 105.953 -1.869 . . . . 2.14 105.953 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.496 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 82.3 mt -61.07 -31.41 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 N-CA-C 107.256 -1.387 . . . . 1.18 107.256 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.423 ' N ' ' O ' ' A' ' 21' ' ' LEU . 87.8 m-70 -88.4 -19.51 26.49 Favored 'General case' 0 N--CA 1.514 2.774 0 C-N-CA 118.472 -1.291 . . . . 2.07 111.231 179.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.417 ' O ' ' C ' ' A' ' 26' ' ' ASP . 61.1 m -101.16 3.76 41.41 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 107.441 -1.318 . . . . 2.46 107.441 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.576 ' OD1' ' N ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER 41.03 53.97 3.31 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.875 -0.787 . . . . 1.96 108.875 -179.218 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.616 HG22 ' HD3' ' A' ' 29' ' ' PRO . 1.3 m -97.3 110.74 23.23 Favored 'General case' 0 N--CA 1.485 1.285 0 O-C-N 121.528 -0.732 . . . . 2.4 109.393 -179.123 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.431 ' HD3' ' O ' ' A' ' 27' ' ' THR . 19.2 mmt180 -129.51 63.33 67.47 Favored Pre-proline 0 N--CA 1.49 1.538 0 N-CA-C 107.996 -1.113 . . . . 2.94 107.996 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.616 ' HD3' HG22 ' A' ' 27' ' ' THR . 50.8 Cg_endo -72.56 17.63 0.36 Allowed 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 121.803 1.669 . . . . 1.45 113.973 -177.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -113.72 80.85 5.28 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 120.876 -1.14 . . . . 1.35 108.991 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.34 131.54 8.66 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 C-N-CA 122.109 1.873 . . . . 2.12 113.888 -178.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.429 ' SG ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -58.94 149.29 27.58 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-O 121.696 0.76 . . . . 2.29 109.868 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -82.34 -15.44 52.85 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.77 -0.581 . . . . 3.89 112.45 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.545 ' CD1' ' N ' ' A' ' 34' ' ' TYR . 3.9 m-85 -113.95 -50.67 2.81 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.224 -1.548 . . . . 2.88 113.37 -178.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 16.1 p -103.72 7.09 37.25 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.487 -1.383 . . . . 3.03 111.16 -177.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.542 ' O ' ' O ' ' A' ' 37' ' ' LYS . . . 73.85 -1.6 45.7 Favored Glycine 0 N--CA 1.492 2.427 0 O-C-N 121.29 -0.881 . . . . 2.64 114.312 176.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.542 ' O ' ' O ' ' A' ' 36' ' ' GLY . 11.8 mttp -41.89 166.0 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.212 0 CA-C-N 120.679 2.24 . . . . 3.06 108.85 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.423 ' N ' ' HE ' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -128.81 133.13 47.93 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.401 -0.963 . . . . 3.4 108.401 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -126.71 174.34 8.81 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.34 -0.85 . . . . 1.49 109.255 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.573 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -115.36 -7.26 12.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 122.0 -0.437 . . . . 2.07 110.505 -179.383 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.416 ' O ' ' C ' ' A' ' 42' ' ' LYS . 85.0 mt-30 -132.13 124.0 28.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.694 -1.254 . . . . 2.11 109.358 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.416 ' C ' ' O ' ' A' ' 41' ' ' GLN . 84.6 tttt -42.05 -65.15 0.49 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.129 -0.982 . . . . 1.95 110.257 -178.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.8 p -49.2 -32.98 11.39 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.733 -0.604 . . . . 1.09 111.101 -178.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.2 -48.63 70.01 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.752 -1.217 . . . . 1.9 107.744 177.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.541 ' O ' ' HB3' ' A' ' 48' ' ' HIS . 10.8 tmm? -62.84 -46.84 86.05 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.472 -1.392 . . . . 0.95 108.617 177.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.499 ' O ' ' OG1' ' A' ' 49' ' ' THR . 35.1 mmtt -53.34 -41.21 65.53 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 120.87 -1.144 . . . . 2.03 108.711 -178.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -63.51 -32.82 74.38 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.168 -1.419 . . . . 1.65 107.168 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.703 ' O ' HG12 ' A' ' 51' ' ' ILE . 47.0 t60 -68.66 -61.25 1.9 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.896 -1.52 . . . . 1.78 106.896 176.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.501 ' O ' HG23 ' A' ' 53' ' ' THR . 24.1 p -41.9 -34.77 0.72 Allowed 'General case' 0 N--CA 1.486 1.35 0 O-C-N 120.323 -1.485 . . . . 1.07 109.281 178.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.605 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 5.2 m-30 -69.26 -32.27 71.35 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.806 -1.184 . . . . 0.86 108.918 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.703 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.0 pt -61.85 -34.16 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 C-N-CA 118.318 -1.353 . . . . 1.93 107.72 175.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -75.07 -27.72 60.06 Favored 'General case' 0 N--CA 1.51 2.548 0 C-N-CA 117.775 -1.57 . . . . 2.21 109.309 176.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.605 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 68.1 p -91.53 -2.06 57.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.16 -0.962 . . . . 1.31 110.279 -177.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.36 17.89 2.07 Favored Glycine 0 N--CA 1.502 3.038 0 N-CA-C 109.944 -1.262 . . . . 1.07 109.944 -177.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.611 ' O ' ' C ' ' A' ' 56' ' ' LYS . 77.4 mt-10 -75.74 20.27 0.18 Allowed 'General case' 0 N--CA 1.506 2.339 0 N-CA-C 115.836 1.791 . . . . 1.27 115.836 -176.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.611 ' C ' ' O ' ' A' ' 55' ' ' GLU . 3.0 mptp? -24.57 96.81 0.06 OUTLIER Pre-proline 0 N--CA 1.508 2.457 0 O-C-N 121.058 -1.026 . . . . 1.14 110.867 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.448 ' N ' ' O ' ' A' ' 55' ' ' GLU . 2.4 Cg_endo -78.86 -19.84 10.75 Favored 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 122.971 2.447 . . . . 0.73 112.431 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -81.65 102.65 10.82 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.908 -1.145 . . . . 0.74 107.908 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.672 ' O ' ' NE2' ' A' ' 61' ' ' GLN . 86.5 mttt -104.55 118.02 35.55 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.915 -1.115 . . . . 0.94 111.595 -177.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 26.8 t -83.71 125.37 31.81 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.229 -0.919 . . . . 1.11 108.739 178.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.672 ' NE2' ' O ' ' A' ' 59' ' ' LYS . 1.1 mm-40 -96.92 13.82 27.52 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.212 -0.93 . . . . 1.9 111.26 -177.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.728 HG11 ' CG ' ' A' ' 80' ' ' HIS . 97.1 t -87.13 -34.88 7.85 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.086 0 N-CA-C 106.338 -1.727 . . . . 1.65 106.338 178.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 26.6 p -123.58 -30.13 3.66 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 114.846 -1.07 . . . . 1.53 108.261 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.02 13.51 31.33 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 111.16 -0.776 . . . . 1.23 111.16 178.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -97.33 132.77 42.75 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.283 -1.716 . . . . 2.2 111.206 -177.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.19 148.24 23.07 Favored 'General case' 0 N--CA 1.508 2.456 0 CA-C-O 122.227 1.013 . . . . 0.76 113.685 -177.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.456 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 88.5 m-85 -128.92 151.13 49.98 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-O 121.992 0.901 . . . . 0.75 111.534 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.447 ' OG ' ' HG3' ' A' ' 69' ' ' GLN . 16.9 p -86.63 -10.35 54.04 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 115.798 -0.637 . . . . 1.19 109.768 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.556 ' NE2' ' N7 ' ' B' ' 105' ' ' ' DA' . 56.5 mt-30 -132.31 142.97 49.56 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.249 -0.907 . . . . 1.75 111.146 -177.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.7 p -66.51 -44.48 82.42 Favored 'General case' 0 C--O 1.198 -1.638 0 N-CA-C 107.174 -1.417 . . . . 1.12 107.174 177.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.444 ' OG ' ' N7 ' ' C' ' 210' ' ' ' DA' . 23.2 t -52.41 -42.59 64.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.231 -0.918 . . . . 1.41 109.915 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.442 ' O ' ' HB3' ' A' ' 76' ' ' HIS . 2.9 m-20 -70.16 -30.29 67.4 Favored 'General case' 0 C--N 1.298 -1.674 0 C-N-CA 118.084 -1.446 . . . . 1.35 107.913 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.9 tp -73.49 -42.1 62.27 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.941 -1.133 . . . . 0.74 107.941 177.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.47 HD11 ' P ' ' C' ' 209' ' ' ' DG' . 90.7 mt -59.67 -53.63 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 O-C-N 120.826 -1.171 . . . . 1.11 109.111 179.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 78' ' ' ARG . 2.5 m -63.97 -48.98 74.33 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 122.374 1.083 . . . . 0.82 108.746 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.456 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 15.8 t60 -51.65 -45.47 63.38 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 123.079 1.418 . . . . 0.94 107.852 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 44.8 t -67.23 -35.61 79.93 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 120.581 -1.324 . . . . 1.21 108.288 178.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 82' ' ' GLY . 2.2 mmm180 -55.81 -35.14 66.0 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 106.986 -1.487 . . . . 2.36 106.986 178.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -63.98 -44.37 92.9 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.193 -1.403 . . . . 1.19 108.061 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.728 ' CG ' HG11 ' A' ' 62' ' ' VAL . 68.5 m-70 -57.44 -62.61 1.65 Allowed 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 116.139 -2.225 . . . . 1.5 108.304 178.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.446 ' O ' ' C ' ' A' ' 82' ' ' GLY . 29.4 p -80.19 21.48 0.59 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.516 -0.74 . . . . 1.56 109.509 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 78' ' ' ARG . . . . . . . . 0 N--CA 1.494 2.548 0 N-CA-C 109.796 -1.321 . . . . 2.6 109.796 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.952 0 C4'-C3'-C2' 104.847 1.647 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' ' DA' . . . . . 0.523 ' N6 ' ' N6 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.743 0 O4'-C4'-C3' 107.19 1.59 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' ' DT' . . . . . 0.532 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.777 0 C1'-O4'-C4' 106.553 -2.248 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' ' DA' . . . . . 0.532 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.922 0 O4'-C4'-C3' 107.109 1.509 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' ' DA' . . . . . 0.556 ' N7 ' ' NE2' ' A' ' 69' ' ' GLN . . . . . . . . 0 C5'--C4' 1.528 2.087 0 O4'-C4'-C3' 107.096 1.496 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.56 ' C6 ' ' C4 ' ' B' ' 107' ' ' ' DT' . . . . . . . . 0 P--O5' 1.61 1.749 0 C1'-O4'-C4' 106.975 -1.946 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' ' DT' . . . . . 0.56 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.878 0 C1'-O4'-C4' 106.034 -2.619 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' ' DC' . . . . . 0.496 " H3'" HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C5'--C4' 1.526 1.874 0 C1'-O4'-C4' 107.005 -1.925 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' ' DA' . . . . . 0.604 H2'' HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 P--O5' 1.608 1.459 0 N19-C1'-C2' 116.841 1.651 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' ' DC' . . . . . 0.515 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.059 0 C1'-O4'-C4' 107.453 -1.605 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' ' DT' . . . . . 0.431 ' H73' ' OG1' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.527 1.975 0 C1'-O4'-C4' 107.282 -1.727 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' ' DG' . . . . . 0.553 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.723 0 O4'-C4'-C3' 107.359 1.759 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.553 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.932 0 O4'-C4'-C3' 107.079 1.479 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 114' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.153 0 C1'-O4'-C4' 107.66 -1.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.991 0 C1'-O4'-C4' 107.374 -1.662 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.867 0 O4'-C4'-C3' 107.207 1.607 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 201' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.864 0 O4'-C4'-C3' 107.165 1.565 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 202' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.93 0 C4'-C3'-C2' 104.809 1.609 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.789 0 O4'-C4'-C3' 107.324 1.724 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 204' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.861 0 C1'-O4'-C4' 107.401 -1.642 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 205' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.976 0 C1'-O4'-C4' 107.549 -1.537 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.81 0 O4'-C4'-C3' 107.295 1.695 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.783 0 C1'-O4'-C4' 107.613 -1.491 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.772 0 C1'-O4'-C4' 107.426 -1.624 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 209' ' ' ' DG' . . . . . 0.561 ' N2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.74 0 O4'-C4'-C3' 107.242 1.642 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 210' ' ' ' DA' . . . . . 0.549 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.728 0 O4'-C4'-C3' 107.274 1.674 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 211' ' ' ' DT' . . . . . 0.545 ' C2 ' ' C2 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.423 -2.124 0 C1'-O4'-C4' 106.344 -2.397 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.714 0 C1'-O4'-C4' 106.925 -1.982 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 213' ' ' ' DT' . . . . . 0.406 ' O4 ' ' O4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.883 0 O4'-C4'-C3' 107.199 1.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 214' ' ' ' DA' . . . . . 0.523 ' N6 ' ' N6 ' ' B' ' 102' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.901 0 O4'-C4'-C3' 107.211 1.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 215' ' ' ' DT' . . . . . 0.48 ' C4 ' ' C5 ' ' C' ' 214' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.983 0 C1'-O4'-C4' 107.035 -1.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.206 0 O4'-C4'-C3' 107.314 1.714 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 98.2 p . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 109.333 -0.617 . . . . 1.36 109.333 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.599 ' CB ' HD22 ' A' ' 17' ' ' LEU . 0.5 OUTLIER -117.91 124.63 48.75 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.259 -0.901 . . . . 1.15 109.569 -179.677 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.505 ' OD2' ' N ' ' A' ' 5' ' ' LYS . 8.5 t70 -108.61 142.99 38.26 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 121.998 0.904 . . . . 2.37 110.269 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.522 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER -66.67 -36.48 82.63 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.142 -0.688 . . . . 2.2 109.142 179.212 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 4' ' ' CYS . 73.6 mttt 75.06 -23.81 0.23 Allowed 'General case' 0 N--CA 1.498 1.956 0 CA-C-O 121.037 0.446 . . . . 2.81 110.159 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.591 ' HB ' ' CD2' ' A' ' 24' ' ' HIS . 12.7 mm -67.84 -66.95 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 O-C-N 120.932 -1.105 . . . . 2.96 109.746 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.9 p -94.31 -24.5 17.39 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.275 -0.89 . . . . 3.14 109.95 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.94 38.51 1.69 Allowed Glycine 0 N--CA 1.496 2.695 0 C-N-CA 120.081 -1.057 . . . . 2.68 112.404 177.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.413 ' O ' ' OD1' ' A' ' 3' ' ' ASP . 19.0 ttmm -115.08 154.37 29.02 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.482 -1.599 . . . . 2.82 108.49 178.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.54 ' C ' ' CD1' ' A' ' 11' ' ' PHE . 44.8 m -112.04 163.7 13.98 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 122.112 0.958 . . . . 1.78 111.985 -177.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.636 ' CZ ' ' CG ' ' A' ' 20' ' ' HIS . 44.2 m-85 -141.46 124.71 16.47 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-O 122.226 1.012 . . . . 1.25 110.738 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -68.67 -30.56 69.26 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 122.175 0.988 . . . . 2.04 109.158 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.95 132.79 56.37 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-N 115.646 -0.707 . . . . 2.51 109.296 -178.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.408 ' N ' ' CE2' ' A' ' 2' ' ' PHE . 7.2 t -59.21 -30.41 68.21 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 118.741 -1.184 . . . . 1.65 109.903 -178.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.3 t -63.37 -47.53 81.71 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 120.278 -1.514 . . . . 2.34 109.365 -179.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.742 HG21 H2'' ' B' ' 109' ' ' ' DA' . 23.9 m -61.81 -30.73 71.01 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.312 -1.366 . . . . 1.36 107.312 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.599 HD22 ' CB ' ' A' ' 2' ' ' PHE . 11.5 tp -74.2 -35.84 63.95 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 107.022 -1.473 . . . . 1.04 107.022 177.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.6 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 32.7 t -56.42 -58.9 6.04 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.718 -1.239 . . . . 1.13 108.223 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.505 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 55.1 m -55.87 -38.77 70.57 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.726 0.774 . . . . 1.47 109.83 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.636 ' CG ' ' CZ ' ' A' ' 11' ' ' PHE . 45.3 t60 -66.65 -44.37 82.07 Favored 'General case' 0 C--N 1.294 -1.843 0 O-C-N 120.742 -1.224 . . . . 1.68 108.247 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.7 mt -61.46 -29.75 70.16 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 106.363 -1.717 . . . . 1.28 106.363 178.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 18' ' ' SER . 21.9 mt -66.16 -29.9 70.27 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 106.621 -1.622 . . . . 1.04 106.621 177.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.588 HD11 " H3'" ' B' ' 108' ' ' ' DC' . 88.4 mt -65.33 -36.58 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 O-C-N 120.577 -1.327 . . . . 2.13 108.304 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.591 ' CD2' ' HB ' ' A' ' 6' ' ' ILE . 72.1 m-70 -82.06 -28.99 32.11 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 118.149 -1.42 . . . . 2.15 110.563 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.449 ' OG ' ' OG1' ' A' ' 27' ' ' THR . 35.0 p -92.42 -1.82 56.74 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.681 -1.262 . . . . 1.07 108.22 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 48.4 m-20 44.5 65.35 1.08 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 115.95 -0.568 . . . . 1.04 110.134 -179.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.449 ' OG1' ' OG ' ' A' ' 25' ' ' SER . 0.6 OUTLIER -104.65 112.2 25.2 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.425 -0.954 . . . . 1.06 108.425 179.262 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.586 HH21 ' CG ' ' A' ' 40' ' ' HIS . 0.4 OUTLIER -124.16 72.7 56.53 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.311 -0.868 . . . . 2.36 108.81 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -74.43 9.77 1.74 Allowed 'Trans proline' 0 C--N 1.312 -1.38 0 C-N-CA 122.037 1.825 . . . . 1.61 113.514 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -114.49 81.73 7.11 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.005 -1.06 . . . . 1.92 108.656 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 50.0 Cg_endo -75.93 137.98 20.33 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.253 1.968 . . . . 1.84 113.037 -178.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.597 ' HB3' ' N ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -64.79 137.27 57.68 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 107.893 -1.151 . . . . 1.91 107.893 179.223 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.473 ' H ' ' CD ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -78.1 -15.04 59.23 Favored 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.497 -0.752 . . . . 2.78 110.663 -178.834 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.435 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 40.4 m-85 -110.97 -72.88 0.7 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.613 -1.304 . . . . 2.49 111.747 -178.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.554 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 16.9 p -85.16 2.04 45.38 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.071 -1.018 . . . . 2.69 111.472 -178.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.458 ' C ' ' HB3' ' A' ' 32' ' ' CYS . . . 80.84 -12.49 35.47 Favored Glycine 0 N--CA 1.504 3.19 0 O-C-N 120.94 -1.1 . . . . 2.24 114.289 175.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.597 ' N ' ' HB3' ' A' ' 32' ' ' CYS . 1.8 mttm -47.58 119.39 2.71 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 119.561 1.68 . . . . 2.44 109.247 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.459 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 35.6 mtt180 -98.77 135.69 39.87 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.945 -1.097 . . . . 2.52 110.976 -178.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.516 ' CD1' ' N ' ' A' ' 39' ' ' PHE . 28.2 m-85 -115.23 174.47 5.98 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.416 -0.803 . . . . 1.14 110.147 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.599 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -107.05 -19.68 13.54 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 116.306 -0.407 . . . . 1.76 110.751 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.53 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 48.8 mt-30 -114.46 110.48 19.91 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 120.718 -1.239 . . . . 2.83 110.032 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.491 ' C ' ' O ' ' A' ' 41' ' ' GLN . 44.6 tttp -34.33 -57.11 0.5 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.232 -0.917 . . . . 2.74 110.892 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.06 -33.79 63.03 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.408 -0.808 . . . . 2.53 111.073 -178.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.734 ' OD1' ' N ' ' A' ' 45' ' ' MET . 35.2 p30 -71.18 -37.5 72.15 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.181 -1.408 . . . . 2.2 108.072 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.734 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 9.9 ttp -67.71 -47.42 69.43 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 120.319 -1.488 . . . . 1.47 108.061 177.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.488 ' HA ' ' OG1' ' A' ' 49' ' ' THR . 36.6 mttm -50.2 -41.23 49.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.636 -1.29 . . . . 2.66 107.565 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.592 ' O ' HG23 ' A' ' 51' ' ' ILE . 36.5 mttm -60.85 -35.06 75.6 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 106.709 -1.589 . . . . 3.38 106.709 178.01 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.712 ' O ' HG12 ' A' ' 51' ' ' ILE . 61.5 t60 -67.37 -67.64 0.44 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.494 -1.298 . . . . 1.42 107.494 177.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.488 ' OG1' ' HA ' ' A' ' 46' ' ' LYS . 32.0 p -40.75 -33.02 0.25 Allowed 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.657 -1.277 . . . . 0.84 110.546 178.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.566 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 3.4 m-85 -70.96 -35.83 72.31 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 120.804 -1.185 . . . . 1.68 109.352 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.712 HG12 ' O ' ' A' ' 48' ' ' HIS . 9.1 pt -63.45 -29.19 46.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 C-N-CA 118.461 -1.295 . . . . 1.82 108.508 176.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -81.0 -29.44 35.21 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 120.315 -1.491 . . . . 1.74 109.92 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.566 ' OG1' ' HA ' ' A' ' 50' ' ' PHE . 75.0 p -91.29 2.29 56.49 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.237 -0.914 . . . . 0.83 112.181 -176.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 58.73 56.08 27.26 Favored Glycine 0 N--CA 1.486 2.033 0 N-CA-C 107.706 -2.157 . . . . 1.18 107.706 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.465 ' OE1' ' CZ ' ' A' ' 50' ' ' PHE . 62.0 mt-10 -114.12 128.58 56.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.456 -1.026 . . . . 2.01 109.943 -178.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 68' ' ' SER . 38.1 mttm -143.29 67.27 16.72 Favored Pre-proline 0 C--N 1.304 -1.372 0 N-CA-C 108.754 -0.832 . . . . 1.69 108.754 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.48 -11.71 14.75 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 122.29 1.993 . . . . 1.56 112.532 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.537 ' HB2' ' O ' ' A' ' 67' ' ' PHE . 94.5 m-70 -101.19 90.61 4.19 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.996 -1.113 . . . . 1.53 107.996 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 26.3 mtpt -91.99 125.82 36.83 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 121.799 0.809 . . . . 2.42 110.778 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.661 ' O ' ' CB ' ' A' ' 61' ' ' GLN . 1.7 t -43.48 -91.52 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.837 -0.539 . . . . 1.38 110.718 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.661 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 6.6 mm-40 122.31 -20.9 0.01 OUTLIER 'General case' 0 N--CA 1.526 3.345 0 CA-C-O 121.604 0.716 . . . . 2.22 110.574 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.401 ' HB ' ' NE2' ' A' ' 80' ' ' HIS . 21.8 t -87.98 -43.26 15.42 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.136 0 CA-C-O 122.038 0.923 . . . . 1.86 109.274 -179.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 18.8 p -122.92 -6.15 8.48 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.675 -0.693 . . . . 2.1 109.966 -178.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.49 29.58 32.52 Favored Glycine 0 N--CA 1.496 2.682 0 O-C-N 120.942 -1.099 . . . . 1.83 111.858 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 60' ' ' CYS . 6.6 tttp -101.29 157.22 16.95 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 105.558 -2.016 . . . . 2.42 105.558 176.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -131.97 152.18 51.27 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.462 -1.399 . . . . 1.38 112.966 -176.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.611 ' HZ ' ' ND1' ' A' ' 76' ' ' HIS . 60.6 m-85 -134.71 138.93 44.82 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 122.151 0.977 . . . . 1.51 112.369 -178.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 34.0 p -68.89 -26.38 65.08 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.738 -1.208 . . . . 1.74 107.738 177.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -116.51 151.62 35.74 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 122.002 0.906 . . . . 2.56 112.851 -176.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.627 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.9 OUTLIER -78.29 -47.27 18.21 Favored 'General case' 0 C--O 1.19 -2.037 0 N-CA-C 107.57 -1.27 . . . . 2.11 107.57 175.399 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.577 ' C ' ' O ' ' A' ' 70' ' ' SER . 15.7 p -39.75 -41.4 1.09 Allowed 'General case' 0 C--N 1.301 -1.519 0 O-C-N 120.441 -1.412 . . . . 2.32 107.782 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -79.79 -31.99 40.82 Favored 'General case' 0 C--N 1.291 -1.94 0 C-N-CA 119.65 -0.82 . . . . 2.16 108.916 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.627 ' N ' ' O ' ' A' ' 70' ' ' SER . 30.7 tp -72.76 -40.78 65.73 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.601 -1.312 . . . . 1.38 108.553 177.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.455 HD13 " H3'" ' C' ' 209' ' ' ' DG' . 97.2 mt -59.92 -52.19 64.04 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 O-C-N 120.937 -1.102 . . . . 2.1 108.255 178.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.2 m -60.33 -47.32 86.56 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.866 -1.146 . . . . 2.41 109.511 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.611 ' ND1' ' HZ ' ' A' ' 67' ' ' PHE . 19.4 t60 -56.86 -39.95 75.25 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 122.419 1.104 . . . . 1.8 108.191 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 53.4 p -71.51 -34.39 70.06 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.898 -1.127 . . . . 1.74 108.684 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -57.83 -32.67 67.83 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.428 -1.323 . . . . 2.71 107.428 178.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.444 ' CD ' ' OP2' ' B' ' 103' ' ' ' DT' . 20.5 mttm -69.16 -48.26 62.75 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.904 -1.147 . . . . 3.5 107.904 178.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.401 ' NE2' ' HB ' ' A' ' 62' ' ' VAL . 50.9 m-70 -58.39 -55.25 37.42 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 117.283 -1.767 . . . . 2.34 109.247 178.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 60.6 m -56.98 -52.79 63.83 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.114 -1.034 . . . . 2.64 108.895 -178.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.63 -1.388 . . . . 2.98 109.63 179.55 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.851 0 C4'-C3'-C2' 104.78 1.58 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.839 0 C4'-C3'-C2' 104.717 1.517 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' ' DT' . . . . . 0.541 ' C4 ' ' C6 ' ' B' ' 104' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.625 0 C1'-O4'-C4' 105.634 -2.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' ' DA' . . . . . 0.541 ' C6 ' ' C4 ' ' B' ' 103' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.878 0 O4'-C4'-C3' 107.115 1.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' ' DA' . . . . . 0.406 ' C6 ' ' C5 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.085 0 O4'-C4'-C3' 107.177 1.577 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.55 ' H61' ' N6 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.428 -1.659 0 C1'-O4'-C4' 106.376 -2.374 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' ' DT' . . . . . 0.534 ' C4 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.888 0 C1'-O4'-C4' 106.114 -2.562 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' ' DC' . . . . . 0.588 " H3'" HD11 ' A' ' 23' ' ' ILE . . . . . . . . 0 C5'--C4' 1.526 1.886 0 O4'-C4'-C3' 107.121 1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' ' DA' . . . . . 0.742 H2'' HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 P--O5' 1.607 1.405 0 N19-C1'-C2' 117.475 2.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' ' DC' . . . . . 0.551 ' C5 ' ' C4 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.018 0 P-O3'-C3' 121.73 1.692 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.833 0 C1'-O4'-C4' 107.405 -1.64 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' ' DG' . . . . . 0.561 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.916 0 O4'-C4'-C3' 107.436 1.836 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.561 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.786 0 O4'-C4'-C3' 107.145 1.545 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 114' ' ' ' DC' . . . . . 0.472 ' O2 ' ' N2 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.032 0 C1'-O4'-C4' 107.473 -1.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.841 0 O4'-C4'-C3' 107.239 1.639 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.03 0 O4'-C4'-C3' 107.371 1.771 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 201' ' ' ' DT' . . . . . 0.438 ' O2 ' ' N7 ' ' C' ' 202' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.935 0 O4'-C4'-C3' 107.181 1.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 202' ' ' ' DA' . . . . . 0.438 ' N7 ' ' O2 ' ' C' ' 201' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.92 0 O4'-C1'-C2' 107.645 1.405 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 203' ' ' ' DG' . . . . . 0.54 ' C2 ' ' C4 ' ' C' ' 204' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.944 0 C4'-C3'-C2' 104.801 1.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 204' ' ' ' DG' . . . . . 0.54 ' C4 ' ' C2 ' ' C' ' 203' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.8 0 C1'-O4'-C4' 107.184 -1.797 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 205' ' ' ' DC' . . . . . 0.541 ' N4 ' ' N6 ' ' C' ' 206' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.885 0 C4'-C3'-C2' 104.768 1.568 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 206' ' ' ' DA' . . . . . 0.541 ' N6 ' ' N4 ' ' C' ' 205' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.809 0 O4'-C4'-C3' 107.348 1.748 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 207' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.742 0 C1'-O4'-C4' 107.174 -1.804 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.737 0 O4'-C4'-C3' 107.157 1.557 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 209' ' ' ' DG' . . . . . 0.539 ' C2 ' ' C2 ' ' B' ' 109' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.74 0 O4'-C4'-C3' 107.178 1.578 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 210' ' ' ' DA' . . . . . 0.55 ' N6 ' ' H61' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.523 1.535 0 O4'-C4'-C3' 107.425 1.825 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 211' ' ' ' DT' . . . . . 0.537 ' C4 ' ' C5 ' ' C' ' 210' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.423 -2.059 0 C1'-O4'-C4' 106.555 -2.247 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 212' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.806 0 C1'-O4'-C4' 106.818 -2.059 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 213' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.753 0 C4'-C3'-C2' 104.869 1.669 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 214' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.866 0 O4'-C4'-C3' 107.293 1.693 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 215' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.937 0 C1'-O4'-C4' 107.16 -1.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.987 0 O4'-C4'-C3' 107.212 1.612 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_