data_1gjj_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 1gjj _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.691 ' HE1' ' HB3' ' A' ' 152' ' ' GLN . 8.4 mtp . . . . . 0 N--CA 1.489 1.525 0 N-CA-C 109.3 -0.63 . . . . 3.3999999999999999 109.3 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -49.96 147.87 14.04 Favored 'Trans proline' 0 N--CA 1.494 1.55 0 C-N-CA 122.699 2.266 . . . . 1.1599999999999999 112.145 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -57.82 124.85 20.6 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.011 -1.055 . . . . 2.6299999999999999 109.146 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 1.435 ' HB2' ' CZ ' ' A' ' 150' ' ' ARG . 83.3 m-85 -101.87 162.52 12.85 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 121.78 0.8 . . . . 0.60999999999999999 110.144 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.5 mt -67.06 139.89 57.61 Favored 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 119.916 -0.714 . . . . 1.1599999999999999 109.66 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -76.73 -5.85 49.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.555 -0.716 . . . . 2.27 109.43 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -143.04 77.2 16.22 Favored Pre-proline 0 N--CA 1.492 1.629 0 N-CA-C 108.044 -1.095 . . . . 1.27 108.044 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.42 -9.09 18.75 Favored 'Trans proline' 0 C--N 1.31 -1.484 0 C-N-CA 122.169 1.913 . . . . 0.5 112.762 -178.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.974 ' N ' HG21 ' A' ' 112' ' ' VAL . 34.6 m -59.05 -22.12 60.23 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.973 -1.079 . . . . 1.8 108.898 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 1.266 HG21 ' O ' ' A' ' 111' ' ' ASP . 21.8 m -75.45 -0.96 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.492 -0.755 . . . . 1.1499999999999999 109.046 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.542 ' N ' ' C ' ' A' ' 113' ' ' THR . 78.9 mt -92.26 154.48 18.59 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.338 -0.851 . . . . 1.0800000000000001 109.48 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 1.121 ' O ' ' HB2' ' A' ' 120' ' ' LEU . 59.2 p -82.52 165.59 20.01 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.322 -0.861 . . . . 1.9399999999999999 109.594 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 1.126 ' HZ3' ' CG1' ' A' ' 134' ' ' ILE . 10.9 tttm -62.72 -47.13 84.94 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.256 -0.903 . . . . 3.2000000000000002 110.123 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.885 ' C ' ' H ' ' A' ' 121' ' ' LEU . 22.4 t70 -60.99 -40.67 94.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.854 -1.154 . . . . 1.1399999999999999 109.519 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.71 ' O ' ' N ' ' A' ' 122' ' ' ASP . 10.6 tptm -63.13 -45.75 90.48 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.211 -0.931 . . . . 3.1499999999999999 109.312 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.709 HD22 HD12 ' A' ' 115' ' ' LEU . 19.8 mt -62.66 -36.5 83.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.254 -0.904 . . . . 1.0800000000000001 109.708 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 1.252 ' NZ ' ' HA ' ' A' ' 133' ' ' PRO . 74.5 tttt -61.35 -44.58 96.94 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.053 -1.03 . . . . 2.8100000000000001 109.319 -178.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.786 ' HA ' HG22 ' A' ' 125' ' ' VAL . 68.7 m -66.28 -34.6 78.36 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.263 -0.898 . . . . 1.9399999999999999 109.396 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.8 ' O ' ' HB2' ' A' ' 126' ' ' LYS . 73.0 mm-40 -60.5 -44.95 95.45 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.084 -1.01 . . . . 2.1600000000000001 108.759 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.915 ' CD2' HD11 ' A' ' 146' ' ' LEU . 89.6 mt -65.7 -38.5 89.41 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.685 -0.634 . . . . 1.1799999999999999 109.499 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 86.0 t -71.32 -39.82 72.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 120.962 -1.086 . . . . 1.0800000000000001 108.45 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.994 ' CB ' ' CD ' ' A' ' 126' ' ' LYS . . . -63.19 -26.19 68.69 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.808 -0.812 . . . . 1.1000000000000001 108.808 178.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 1.014 ' ND2' ' HB2' ' A' ' 126' ' ' LYS . 22.4 m-80 -98.67 20.31 13.18 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.316 -0.865 . . . . 1.98 109.586 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.833 ' OD1' ' O ' ' A' ' 127' ' ' TYR . 12.5 p30 45.49 28.32 0.48 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.248 -0.908 . . . . 1.9099999999999999 110.759 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 1.032 HG11 HD12 ' A' ' 149' ' ' LEU . 78.4 t -75.05 132.45 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 N-CA-C 108.243 -1.021 . . . . 1.0700000000000001 108.243 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 1.282 ' C ' HG12 ' A' ' 129' ' ' VAL . 44.6 p -89.18 125.32 35.01 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.003 -1.061 . . . . 1.1100000000000001 109.93 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 1.079 ' N ' HG13 ' A' ' 129' ' ' VAL . 11.6 mt -96.41 109.66 48.83 Favored Pre-proline 0 N--CA 1.498 1.931 0 O-C-N 121.841 -0.537 . . . . 1.24 109.619 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.947 ' HD2' ' HZ1' ' A' ' 145' ' ' LYS . 72.0 Cg_exo -49.32 142.12 22.97 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.95 1.767 . . . . 1.1499999999999999 112.342 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.06 158.2 34.7 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.349 -0.844 . . . . 1.3799999999999999 109.309 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 81.83 30.82 34.29 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.451 -1.46 . . . . 0.47999999999999998 109.451 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -146.76 110.7 5.0 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -1.152 . . . . 2.29 109.425 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 1.343 ' CB ' HG23 ' A' ' 135' ' ' VAL . 89.7 mt-30 -138.62 65.05 1.47 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.333 -0.854 . . . . 3.3599999999999999 109.532 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 1.403 ' CZ ' ' HG1' ' A' ' 137' ' ' THR . 14.4 mmm180 -130.58 137.86 49.87 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.635 -0.876 . . . . 5.0199999999999996 108.635 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 1.289 ' NZ ' ' CZ ' ' A' ' 139' ' ' ARG . 36.9 tttt -58.62 -50.13 74.97 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.064 -1.022 . . . . 3.23 109.923 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.57 ' OD2' ' CG ' ' A' ' 140' ' ' LYS . 5.8 t70 -55.01 -40.76 70.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.0 -1.062 . . . . 2.1899999999999999 110.127 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 1.396 ' CG1' HD23 ' A' ' 141' ' ' LEU . 49.6 t -59.16 -41.6 84.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 121.087 -1.008 . . . . 1.0900000000000001 109.085 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 1.692 ' CZ ' ' CE2' ' A' ' 142' ' ' TYR . 61.3 m-85 -72.24 -32.5 66.76 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.127 -0.983 . . . . 0.91000000000000003 109.529 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.858 HG23 ' OE1' ' A' ' 143' ' ' GLU . 66.1 t -69.92 -44.92 78.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 C-N-CA 118.62 -1.232 . . . . 1.0600000000000001 109.265 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.7 ' O ' ' C ' ' A' ' 145' ' ' LYS . 40.5 tt0 -70.49 -32.33 69.8 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.42 -0.912 . . . . 2.9199999999999999 109.84 -178.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 1.014 HD12 ' HA ' ' A' ' 142' ' ' TYR . 20.6 mt -61.86 -39.02 90.44 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 107.455 -1.313 . . . . 1.1000000000000001 107.455 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.913 ' CE1' HG11 ' A' ' 112' ' ' VAL . 28.7 t80 -62.3 -45.25 94.11 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.191 -1.04 . . . . 0.84999999999999998 108.191 178.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.0 mt -71.85 -38.52 70.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.253 -0.904 . . . . 1.04 109.852 178.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 1.388 ' CG ' ' HD2' ' A' ' 148' ' ' LYS . 49.0 tt0 -66.15 -41.33 90.53 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.486 -0.758 . . . . 2.5699999999999998 111.407 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.81 ' CD2' ' HG2' ' A' ' 145' ' ' LYS . 89.7 m-70 -86.02 -46.17 10.75 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.015 -1.053 . . . . 0.75 111.65 -177.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 1.657 HD22 ' CE1' ' A' ' 127' ' ' TYR . 14.3 mt -91.7 -71.13 0.65 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.953 -1.092 . . . . 1.1000000000000001 112.14 -177.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.929 ' O ' ' HA ' ' A' ' 151' ' ' GLU . 6.6 m -50.01 -49.87 49.29 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.927 -1.108 . . . . 1.5 110.113 -176.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.872 ' CB ' ' CD ' ' A' ' 151' ' ' GLU . . . -50.13 -22.15 1.57 Allowed 'General case' 0 C--N 1.295 -1.766 0 O-C-N 120.781 -1.2 . . . . 1.3100000000000001 110.427 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 1.249 ' HD2' ' CB ' ' A' ' 152' ' ' GLN . 32.2 mtt180 -125.06 -11.34 7.07 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.176 -0.953 . . . . 3.6899999999999999 110.536 -179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 1.023 ' HB2' ' O ' ' A' ' 150' ' ' ARG . 30.4 t-20 -71.63 22.47 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.015 -1.053 . . . . 2.21 109.875 -178.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.519 ' H ' ' C ' ' A' ' 48' ' ' ARG . 1.6 ptp180 . . . . . 0 N--CA 1.494 1.746 0 O-C-N 121.075 -1.016 . . . . 6.0899999999999999 109.267 -178.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 1.266 ' O ' HG21 ' A' ' 10' ' ' VAL . 72.1 m-20 . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 121.902 0.858 . . . . 3.1200000000000001 111.02 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.974 HG21 ' N ' ' A' ' 9' ' ' SER . 17.7 m -75.31 -20.33 16.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 CA-C-O 121.54 0.686 . . . . 1.6000000000000001 109.152 178.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' THR . . . . . 0.593 ' CG2' ' O ' ' A' ' 9' ' ' SER . 58.6 m -81.58 -19.02 42.82 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.467 -0.771 . . . . 1.3200000000000001 110.106 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.415 ' HB3' HG23 ' A' ' 10' ' ' VAL . 58.4 tt0 -87.5 -2.17 58.44 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.888 -1.133 . . . . 2.5699999999999998 110.053 -178.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.709 HD12 HD22 ' A' ' 16' ' ' LEU . 30.7 mt -74.76 145.14 43.24 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.92 -1.112 . . . . 1.3300000000000001 109.06 179.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.726 ' O ' ' O ' ' A' ' 12' ' ' THR . 13.5 m -80.23 151.72 29.48 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 121.268 0.556 . . . . 1.21 109.572 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 1.105 ' HB3' ' HB3' ' A' ' 13' ' ' LYS . 0.9 OUTLIER -44.07 -38.35 3.55 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.176 -0.952 . . . . 2.8999999999999999 109.566 -179.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.868 ' O ' ' O ' ' A' ' 14' ' ' ASP . 96.5 mt-10 -68.78 -51.01 45.64 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.493 -0.754 . . . . 2.4100000000000001 110.115 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.42 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 75.9 m-20 -63.88 -40.06 95.64 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.18 -0.95 . . . . 2.0499999999999998 110.661 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 1.121 ' HB2' ' O ' ' A' ' 12' ' ' THR . 24.3 tp -56.56 -37.5 70.63 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.091 -1.006 . . . . 1.1699999999999999 109.738 -179.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 1.06 HD23 ' C ' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -71.44 -37.07 71.45 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.127 -0.983 . . . . 2.1499999999999999 108.454 179.576 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.71 ' N ' ' O ' ' A' ' 15' ' ' LYS . 19.8 t70 -56.15 -41.47 75.45 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 119.496 -0.881 . . . . 1.1399999999999999 109.066 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.782 ' OE1' ' CE2' ' A' ' 41' ' ' TYR . 92.2 mt-30 -70.12 -42.32 72.78 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.192 -0.942 . . . . 2.9500000000000002 110.344 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.702 HD11 ' HA ' ' A' ' 17' ' ' LYS . 18.5 mt -60.09 -43.3 95.63 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.056 -1.028 . . . . 1.26 109.618 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . 0.786 HG22 ' HA ' ' A' ' 18' ' ' SER . 72.2 t -62.13 -37.09 77.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 O-C-N 121.125 -0.985 . . . . 1.1899999999999999 109.848 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 1.014 ' HB2' ' ND2' ' A' ' 23' ' ' ASN . 39.7 mttt -57.89 -33.78 69.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.359 -0.838 . . . . 3.2000000000000002 110.517 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' TYR . . . . . 1.657 ' CE1' HD22 ' A' ' 45' ' ' LEU . 75.7 m-85 -78.84 4.45 13.98 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.891 -1.13 . . . . 1.24 109.809 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 81.17 18.78 68.48 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.95 -1.26 . . . . 0.73999999999999999 109.95 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 1.282 HG12 ' C ' ' A' ' 26' ' ' THR . 15.7 t -103.73 130.5 54.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.179 -1.189 . . . . 1.2 108.97 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -136.96 80.33 36.22 Favored Pre-proline 0 N--CA 1.494 1.725 0 O-C-N 121.082 -1.011 . . . . 3.1800000000000002 109.117 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . 0.403 ' CG ' ' HE1' ' A' ' 37' ' ' TYR . 98.0 Cg_endo -86.94 -148.7 0.03 OUTLIER 'Trans proline' 0 C--N 1.302 -1.901 0 C-N-CA 123.11 2.54 . . . . 1.3600000000000001 111.68 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.421 ' O ' ' OH ' ' A' ' 37' ' ' TYR . . . -93.34 155.88 22.46 Favored Glycine 0 N--CA 1.487 2.099 0 N-CA-C 108.854 -1.698 . . . . 2.1699999999999999 108.854 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . 1.252 ' HA ' ' NZ ' ' A' ' 17' ' ' LYS . 13.2 Cg_endo -58.75 112.56 1.24 Allowed 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.269 1.98 . . . . 2.0 112.188 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . 1.497 HG22 ' CD2' ' A' ' 37' ' ' TYR . 6.2 pt -33.59 113.71 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 CA-C-O 121.276 0.56 . . . . 1.6899999999999999 111.043 -179.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 1.343 HG23 ' CB ' ' A' ' 32' ' ' GLN . 57.3 t -76.01 -78.96 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.13 -0.981 . . . . 1.5 109.626 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -174.6 -8.04 0.02 OUTLIER Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.449 -1.46 . . . . 1.3700000000000001 109.449 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' THR . . . . . 1.403 ' HG1' ' CZ ' ' A' ' 33' ' ' ARG . 14.8 t -125.36 -13.64 6.6 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.254 -1.145 . . . . 1.3799999999999999 109.488 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' THR . . . . . 1.19 ' O ' ' HB ' ' A' ' 36' ' ' VAL . 4.0 t -98.94 -10.97 22.06 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.101 -0.999 . . . . 1.22 108.348 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 1.289 ' CZ ' ' NZ ' ' A' ' 34' ' ' LYS . 68.2 ttt180 -55.35 -39.89 70.58 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.844 -0.535 . . . . 4.3899999999999997 110.114 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.57 ' CG ' ' OD2' ' A' ' 35' ' ' ASP . 16.4 mtmm -63.05 -36.61 84.15 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.966 -1.084 . . . . 3.4399999999999999 109.926 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 1.396 HD23 ' CG1' ' A' ' 36' ' ' VAL . 11.6 tp -62.79 -45.41 92.78 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 120.969 -1.082 . . . . 1.75 109.491 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . 1.692 ' CE2' ' CZ ' ' A' ' 37' ' ' TYR . 70.4 m-85 -65.89 -36.63 83.95 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.45 -0.781 . . . . 1.1299999999999999 109.854 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.858 ' OE1' HG23 ' A' ' 38' ' ' VAL . 97.8 mt-10 -63.32 -41.93 98.95 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 120.926 -1.109 . . . . 1.6899999999999999 108.874 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . 0.595 ' O ' ' N ' ' A' ' 43' ' ' GLN . 62.7 tttt -68.09 -46.36 71.19 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.258 -0.901 . . . . 3.3100000000000001 109.213 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.947 ' HZ1' ' HD2' ' A' ' 28' ' ' PRO . 14.9 ttmt -58.47 -40.76 83.57 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.475 -0.766 . . . . 3.0800000000000001 109.295 -179.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.915 HD11 ' CD2' ' A' ' 20' ' ' LEU . 33.0 tp -55.48 -39.77 70.84 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.213 -0.929 . . . . 2.4500000000000002 109.077 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.753 ' O ' ' N ' ' A' ' 47' ' ' ALA . 79.3 mt -57.93 -37.88 74.89 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.379 -0.971 . . . . 1.1200000000000001 108.379 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 1.388 ' HD2' ' CG ' ' A' ' 43' ' ' GLN . 70.1 tttt -61.98 -46.7 88.09 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.557 -0.714 . . . . 3.1400000000000001 109.227 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 1.032 HD12 HG11 ' A' ' 25' ' ' VAL . 90.6 mt -63.55 -41.85 98.41 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.336 -0.853 . . . . 1.26 109.07 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . 1.435 ' CZ ' ' HB2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -60.03 -35.55 75.35 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.698 -0.852 . . . . 4.0099999999999998 108.698 179.778 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.953 ' CA ' ' H ' ' A' ' 49' ' ' ASN . 37.9 tt0 -58.52 -37.76 76.3 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 108.998 -0.741 . . . . 2.1299999999999999 108.998 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 1.249 ' CB ' ' HD2' ' A' ' 48' ' ' ARG . 32.3 tt0 -54.87 -31.9 60.2 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.392 -0.818 . . . . 3.4700000000000002 109.498 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.759 ' C ' ' HA ' ' A' ' 49' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.33 0 N-CA-C 110.212 -1.155 . . . . 3.3199999999999998 110.212 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.539 ' CE ' ' HG2' ' A' ' 152' ' ' GLN . 8.4 mtp . . . . . 0 N--CA 1.489 1.525 0 N-CA-C 109.3 -0.63 . . . . 2.99 109.3 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -49.96 147.87 14.04 Favored 'Trans proline' 0 N--CA 1.494 1.55 0 C-N-CA 122.699 2.266 . . . . 0.79 112.145 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -57.82 124.85 20.6 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.011 -1.055 . . . . 2.63 109.146 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 1.436 ' HB2' ' CZ ' ' A' ' 150' ' ' ARG . 83.3 m-85 -101.87 162.52 12.85 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 121.78 0.8 . . . . 0.55 110.144 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.595 HD12 HD21 ' A' ' 115' ' ' LEU . 31.5 mt -67.06 139.89 57.61 Favored 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 119.916 -0.714 . . . . 0.43 109.66 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -76.73 -5.85 49.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.555 -0.716 . . . . 2.27 109.43 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -143.04 77.2 16.22 Favored Pre-proline 0 N--CA 1.492 1.629 0 N-CA-C 108.044 -1.095 . . . . 1.27 108.044 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.42 -9.09 18.75 Favored 'Trans proline' 0 C--N 1.31 -1.484 0 C-N-CA 122.169 1.913 . . . . 0.44 112.762 -178.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.758 ' N ' HG23 ' A' ' 112' ' ' VAL . 34.6 m -59.05 -22.12 60.23 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.973 -1.079 . . . . 1.26 108.898 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 1.199 HG22 ' O ' ' A' ' 111' ' ' ASP . 21.8 m -75.45 -0.96 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.492 -0.755 . . . . 0.42 109.046 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.542 ' N ' ' C ' ' A' ' 113' ' ' THR . 78.9 mt -92.26 154.48 18.59 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.338 -0.851 . . . . 0.36 109.48 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . 1.132 ' O ' ' HB2' ' A' ' 120' ' ' LEU . 59.2 p -82.52 165.59 20.01 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.322 -0.861 . . . . 1.23 109.594 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 1.141 ' HB3' ' HB3' ' A' ' 117' ' ' ASN . 10.9 tttm -62.72 -47.13 84.94 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.256 -0.903 . . . . 2.73 110.123 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.922 ' C ' ' H ' ' A' ' 121' ' ' LEU . 22.4 t70 -60.99 -40.67 94.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.854 -1.154 . . . . 1.14 109.519 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.71 ' O ' ' N ' ' A' ' 122' ' ' ASP . 10.6 tptm -63.13 -45.75 90.48 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.211 -0.931 . . . . 2.72 109.312 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.806 HD21 HD12 ' A' ' 115' ' ' LEU . 19.8 mt -62.66 -36.5 83.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.254 -0.904 . . . . 0.25 109.708 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 1.172 ' NZ ' ' HA ' ' A' ' 133' ' ' PRO . 74.5 tttt -61.35 -44.58 96.94 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.053 -1.03 . . . . 2.32 109.319 -178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.709 ' O ' ' HB ' ' A' ' 125' ' ' VAL . 68.7 m -66.28 -34.6 78.36 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.263 -0.898 . . . . 1.42 109.396 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.799 ' O ' ' HB2' ' A' ' 126' ' ' LYS . 73.0 mm-40 -60.5 -44.95 95.45 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.084 -1.01 . . . . 2.16 108.759 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 1.025 HD21 HD13 ' A' ' 146' ' ' LEU . 89.6 mt -65.7 -38.5 89.41 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.685 -0.634 . . . . 0.46 109.499 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 125' ' ' VAL . 86.0 t -71.32 -39.82 72.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 120.962 -1.086 . . . . 0.25 108.45 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.994 ' CB ' ' CD ' ' A' ' 126' ' ' LYS . . . -63.19 -26.19 68.69 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.808 -0.812 . . . . 0.36 108.808 178.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 1.033 ' ND2' ' HB2' ' A' ' 126' ' ' LYS . 22.4 m-80 -98.67 20.31 13.18 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.316 -0.865 . . . . 1.19 109.586 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.833 ' OD1' ' O ' ' A' ' 127' ' ' TYR . 12.5 p30 45.49 28.32 0.48 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.248 -0.908 . . . . 1.17 110.759 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 1.01 HG21 HD13 ' A' ' 149' ' ' LEU . 78.4 t -75.05 132.45 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 N-CA-C 108.243 -1.021 . . . . 0.33 108.243 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . 1.583 ' C ' HG13 ' A' ' 129' ' ' VAL . 44.6 p -89.18 125.32 35.01 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.003 -1.061 . . . . 0.39 109.93 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 1.3 ' CG ' HG12 ' A' ' 129' ' ' VAL . 11.6 mt -96.41 109.66 48.83 Favored Pre-proline 0 N--CA 1.498 1.931 0 O-C-N 121.841 -0.537 . . . . 0.57 109.619 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.874 ' HD2' ' NZ ' ' A' ' 145' ' ' LYS . 72.0 Cg_exo -49.32 142.12 22.97 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.95 1.767 . . . . 0.84 112.342 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.06 158.2 34.7 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.349 -0.844 . . . . 0.8 109.309 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 81.83 30.82 34.29 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.451 -1.46 . . . . 0.42 109.451 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.511 ' O ' ' OH ' ' A' ' 142' ' ' TYR . 91.7 mt-10 -146.76 110.7 5.0 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -1.152 . . . . 2.29 109.425 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 1.069 ' CB ' HG23 ' A' ' 135' ' ' VAL . 89.7 mt-30 -138.62 65.05 1.47 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.333 -0.854 . . . . 2.73 109.532 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 1.271 HH11 ' CA ' ' A' ' 137' ' ' THR . 14.4 mmm180 -130.58 137.86 49.87 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.635 -0.876 . . . . 4.34 108.635 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 1.289 ' NZ ' ' CZ ' ' A' ' 139' ' ' ARG . 36.9 tttt -58.62 -50.13 74.97 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.064 -1.022 . . . . 2.8 109.923 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.57 ' OD2' ' CG ' ' A' ' 140' ' ' LYS . 5.8 t70 -55.01 -40.76 70.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.0 -1.062 . . . . 2.19 110.127 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 1.362 ' CG1' HD23 ' A' ' 141' ' ' LEU . 49.6 t -59.16 -41.6 84.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 121.087 -1.008 . . . . 0.23 109.085 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 1.692 ' CZ ' ' CE2' ' A' ' 142' ' ' TYR . 61.3 m-85 -72.24 -32.5 66.76 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.127 -0.983 . . . . 0.4 109.529 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.934 HG21 ' OE1' ' A' ' 143' ' ' GLU . 66.1 t -69.92 -44.92 78.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 C-N-CA 118.62 -1.232 . . . . 0.26 109.265 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.7 ' O ' ' C ' ' A' ' 145' ' ' LYS . 40.5 tt0 -70.49 -32.33 69.8 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.42 -0.912 . . . . 2.39 109.84 -178.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.053 HD12 ' HA ' ' A' ' 142' ' ' TYR . 20.6 mt -61.86 -39.02 90.44 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 107.455 -1.313 . . . . 0.33 107.455 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.782 ' CE2' ' OE1' ' A' ' 123' ' ' GLN . 28.7 t80 -62.3 -45.25 94.11 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.191 -1.04 . . . . 0.29 108.191 178.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.491 HD21 HG21 ' A' ' 112' ' ' VAL . 84.0 mt -71.85 -38.52 70.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.253 -0.904 . . . . 0.31 109.852 178.104 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 1.394 ' CG ' ' HD2' ' A' ' 148' ' ' LYS . 49.0 tt0 -66.15 -41.33 90.53 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.486 -0.758 . . . . 2.08 111.407 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.815 ' CD2' ' HG2' ' A' ' 145' ' ' LYS . 89.7 m-70 -86.02 -46.17 10.75 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.015 -1.053 . . . . 0.54 111.65 -177.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 1.427 HD21 ' CE1' ' A' ' 127' ' ' TYR . 14.3 mt -91.7 -71.13 0.65 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.953 -1.092 . . . . 0.36 112.14 -177.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.931 ' O ' ' HA ' ' A' ' 151' ' ' GLU . 6.6 m -50.01 -49.87 49.29 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.927 -1.108 . . . . 0.89 110.113 -176.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 1.173 ' HB1' ' OE1' ' A' ' 151' ' ' GLU . . . -50.13 -22.15 1.57 Allowed 'General case' 0 C--N 1.295 -1.766 0 O-C-N 120.781 -1.2 . . . . 0.47 110.427 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 1.244 ' HD2' ' CB ' ' A' ' 152' ' ' GLN . 32.2 mtt180 -125.06 -11.34 7.07 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.176 -0.953 . . . . 3.21 110.536 -179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 1.021 ' HB2' ' O ' ' A' ' 150' ' ' ARG . 30.4 t-20 -71.63 22.47 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.015 -1.053 . . . . 1.85 109.875 -178.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.5 ' H ' ' C ' ' A' ' 48' ' ' ARG . 1.6 ptp180 . . . . . 0 N--CA 1.494 1.746 0 O-C-N 121.075 -1.016 . . . . 5.45 109.267 -178.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 1.199 ' O ' HG22 ' A' ' 10' ' ' VAL . 72.1 m-20 . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 121.902 0.858 . . . . 3.12 111.02 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.758 HG23 ' N ' ' A' ' 9' ' ' SER . 17.7 m -75.31 -20.33 16.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 CA-C-O 121.54 0.686 . . . . 1.06 109.152 178.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.593 ' CG2' ' O ' ' A' ' 9' ' ' SER . 58.6 m -81.58 -19.02 42.82 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.467 -0.771 . . . . 0.78 110.106 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -87.5 -2.17 58.44 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.888 -1.133 . . . . 2.57 110.053 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.806 HD12 HD21 ' A' ' 16' ' ' LEU . 30.7 mt -74.76 145.14 43.24 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.92 -1.112 . . . . 0.75 109.06 179.185 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.726 ' O ' ' O ' ' A' ' 12' ' ' THR . 13.5 m -80.23 151.72 29.48 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 121.268 0.556 . . . . 0.51 109.572 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 1.141 ' HB3' ' HB3' ' A' ' 13' ' ' LYS . 0.9 OUTLIER -44.07 -38.35 3.55 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.176 -0.952 . . . . 2.26 109.566 -179.819 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.868 ' O ' ' O ' ' A' ' 14' ' ' ASP . 96.5 mt-10 -68.78 -51.01 45.64 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.493 -0.754 . . . . 2.41 110.115 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.445 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 75.9 m-20 -63.88 -40.06 95.64 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.18 -0.95 . . . . 2.05 110.661 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 1.132 ' HB2' ' O ' ' A' ' 12' ' ' THR . 24.3 tp -56.56 -37.5 70.63 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.091 -1.006 . . . . 0.5 109.738 -179.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 1.091 HD23 ' C ' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -71.44 -37.07 71.45 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.127 -0.983 . . . . 1.55 108.454 179.576 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.71 ' N ' ' O ' ' A' ' 15' ' ' LYS . 19.8 t70 -56.15 -41.47 75.45 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 119.496 -0.881 . . . . 1.14 109.066 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.782 ' OE1' ' CE2' ' A' ' 41' ' ' TYR . 92.2 mt-30 -70.12 -42.32 72.78 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.192 -0.942 . . . . 2.34 110.344 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 17' ' ' LYS . 18.5 mt -60.09 -43.3 95.63 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.056 -1.028 . . . . 0.65 109.618 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 17' ' ' LYS . 72.2 t -62.13 -37.09 77.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 O-C-N 121.125 -0.985 . . . . 0.47 109.848 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 1.033 ' HB2' ' ND2' ' A' ' 23' ' ' ASN . 39.7 mttt -57.89 -33.78 69.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.359 -0.838 . . . . 2.71 110.517 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' TYR . . . . . 1.427 ' CE1' HD21 ' A' ' 45' ' ' LEU . 75.7 m-85 -78.84 4.45 13.98 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.891 -1.13 . . . . 0.8 109.809 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 81.17 18.78 68.48 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.95 -1.26 . . . . 0.63 109.95 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 1.583 HG13 ' C ' ' A' ' 26' ' ' THR . 15.7 t -103.73 130.5 54.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.179 -1.189 . . . . 0.61 108.97 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -136.96 80.33 36.22 Favored Pre-proline 0 N--CA 1.494 1.725 0 O-C-N 121.082 -1.011 . . . . 2.58 109.117 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.404 ' CG ' ' HE1' ' A' ' 37' ' ' TYR . 98.0 Cg_endo -86.94 -148.7 0.03 OUTLIER 'Trans proline' 0 C--N 1.302 -1.901 0 C-N-CA 123.11 2.54 . . . . 1.17 111.68 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.408 ' O ' ' OH ' ' A' ' 37' ' ' TYR . . . -93.34 155.88 22.46 Favored Glycine 0 N--CA 1.487 2.099 0 N-CA-C 108.854 -1.698 . . . . 1.77 108.854 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' PRO . . . . . 1.172 ' HA ' ' NZ ' ' A' ' 17' ' ' LYS . 13.2 Cg_endo -58.75 112.56 1.24 Allowed 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.269 1.98 . . . . 1.57 112.188 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ILE . . . . . 1.508 HG22 ' CD2' ' A' ' 37' ' ' TYR . 6.2 pt -33.59 113.71 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 CA-C-O 121.276 0.56 . . . . 1.16 111.043 -179.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 1.069 HG23 ' CB ' ' A' ' 32' ' ' GLN . 57.3 t -76.01 -78.96 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.13 -0.981 . . . . 1.5 109.626 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -174.6 -8.04 0.02 OUTLIER Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.449 -1.46 . . . . 1.37 109.449 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' THR . . . . . 1.271 ' CA ' HH11 ' A' ' 33' ' ' ARG . 14.8 t -125.36 -13.64 6.6 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.254 -1.145 . . . . 0.98 109.488 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' THR . . . . . 1.198 ' O ' ' HB ' ' A' ' 36' ' ' VAL . 4.0 t -98.94 -10.97 22.06 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.101 -0.999 . . . . 0.56 108.348 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 1.289 ' CZ ' ' NZ ' ' A' ' 34' ' ' LYS . 68.2 ttt180 -55.35 -39.89 70.58 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.844 -0.535 . . . . 3.77 110.114 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.57 ' CG ' ' OD2' ' A' ' 35' ' ' ASP . 16.4 mtmm -63.05 -36.61 84.15 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.966 -1.084 . . . . 2.99 109.926 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 1.362 HD23 ' CG1' ' A' ' 36' ' ' VAL . 11.6 tp -62.79 -45.41 92.78 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 120.969 -1.082 . . . . 1.08 109.491 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' TYR . . . . . 1.692 ' CE2' ' CZ ' ' A' ' 37' ' ' TYR . 70.4 m-85 -65.89 -36.63 83.95 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.45 -0.781 . . . . 0.64 109.854 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.934 ' OE1' HG21 ' A' ' 38' ' ' VAL . 97.8 mt-10 -63.32 -41.93 98.95 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 120.926 -1.109 . . . . 1.69 108.874 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LYS . . . . . 0.595 ' O ' ' N ' ' A' ' 43' ' ' GLN . 62.7 tttt -68.09 -46.36 71.19 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.258 -0.901 . . . . 2.82 109.213 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.874 ' NZ ' ' HD2' ' A' ' 28' ' ' PRO . 14.9 ttmt -58.47 -40.76 83.57 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.475 -0.766 . . . . 2.57 109.295 -179.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 20' ' ' LEU . 33.0 tp -55.48 -39.77 70.84 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.213 -0.929 . . . . 1.88 109.077 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.753 ' O ' ' N ' ' A' ' 47' ' ' ALA . 79.3 mt -57.93 -37.88 74.89 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.379 -0.971 . . . . 0.48 108.379 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 1.394 ' HD2' ' CG ' ' A' ' 43' ' ' GLN . 70.1 tttt -61.98 -46.7 88.09 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.557 -0.714 . . . . 2.73 109.227 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 1.01 HD13 HG21 ' A' ' 25' ' ' VAL . 90.6 mt -63.55 -41.85 98.41 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.336 -0.853 . . . . 0.66 109.07 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ARG . . . . . 1.436 ' CZ ' ' HB2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -60.03 -35.55 75.35 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.698 -0.852 . . . . 3.46 108.698 179.778 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 1.173 ' OE1' ' HB1' ' A' ' 47' ' ' ALA . 37.9 tt0 -58.52 -37.76 76.3 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 108.998 -0.741 . . . . 2.13 108.998 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 1.244 ' CB ' ' HD2' ' A' ' 48' ' ' ARG . 32.3 tt0 -54.87 -31.9 60.2 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.392 -0.818 . . . . 3.07 109.498 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.777 ' C ' ' HA ' ' A' ' 49' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.33 0 N-CA-C 110.212 -1.155 . . . . 3.32 110.212 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.539 ' CE ' ' HG2' ' A' ' 152' ' ' GLN . 8.4 mtp . . . . . 0 N--CA 1.489 1.525 0 N-CA-C 109.3 -0.63 . . . . 2.99 109.3 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -49.96 147.87 14.04 Favored 'Trans proline' 0 N--CA 1.494 1.55 0 C-N-CA 122.699 2.266 . . . . 0.79 112.145 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -57.82 124.85 20.6 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.011 -1.055 . . . . 2.63 109.146 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 1.436 ' HB2' ' CZ ' ' A' ' 150' ' ' ARG . 83.3 m-85 -101.87 162.52 12.85 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-O 121.78 0.8 . . . . 0.55 110.144 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.595 HD12 HD21 ' A' ' 115' ' ' LEU . 31.5 mt -67.06 139.89 57.61 Favored 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 119.916 -0.714 . . . . 0.43 109.66 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -76.73 -5.85 49.75 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.555 -0.716 . . . . 2.27 109.43 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -143.04 77.2 16.22 Favored Pre-proline 0 N--CA 1.492 1.629 0 N-CA-C 108.044 -1.095 . . . . 1.27 108.044 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.42 -9.09 18.75 Favored 'Trans proline' 0 C--N 1.31 -1.484 0 C-N-CA 122.169 1.913 . . . . 0.44 112.762 -178.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.758 ' N ' HG23 ' A' ' 112' ' ' VAL . 34.6 m -59.05 -22.12 60.23 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.973 -1.079 . . . . 1.26 108.898 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 1.199 HG22 ' O ' ' A' ' 111' ' ' ASP . 21.8 m -75.45 -0.96 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.492 -0.755 . . . . 0.42 109.046 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.542 ' N ' ' C ' ' A' ' 113' ' ' THR . 78.9 mt -92.26 154.48 18.59 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.338 -0.851 . . . . 0.36 109.48 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 1.132 ' O ' ' HB2' ' A' ' 120' ' ' LEU . 59.2 p -82.52 165.59 20.01 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.322 -0.861 . . . . 1.23 109.594 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 1.141 ' HB3' ' HB3' ' A' ' 117' ' ' ASN . 10.9 tttm -62.72 -47.13 84.94 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.256 -0.903 . . . . 2.73 110.123 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.922 ' C ' ' H ' ' A' ' 121' ' ' LEU . 22.4 t70 -60.99 -40.67 94.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.854 -1.154 . . . . 1.14 109.519 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.71 ' O ' ' N ' ' A' ' 122' ' ' ASP . 10.6 tptm -63.13 -45.75 90.48 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.211 -0.931 . . . . 2.72 109.312 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.806 HD21 HD12 ' A' ' 115' ' ' LEU . 19.8 mt -62.66 -36.5 83.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.254 -0.904 . . . . 0.25 109.708 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 1.172 ' NZ ' ' HA ' ' A' ' 133' ' ' PRO . 74.5 tttt -61.35 -44.58 96.94 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.053 -1.03 . . . . 2.32 109.319 -178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.709 ' O ' ' HB ' ' A' ' 125' ' ' VAL . 68.7 m -66.28 -34.6 78.36 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.263 -0.898 . . . . 1.42 109.396 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.799 ' O ' ' HB2' ' A' ' 126' ' ' LYS . 73.0 mm-40 -60.5 -44.95 95.45 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.084 -1.01 . . . . 2.16 108.759 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 1.025 HD21 HD13 ' A' ' 146' ' ' LEU . 89.6 mt -65.7 -38.5 89.41 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.685 -0.634 . . . . 0.46 109.499 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 125' ' ' VAL . 86.0 t -71.32 -39.82 72.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 120.962 -1.086 . . . . 0.25 108.45 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.994 ' CB ' ' CD ' ' A' ' 126' ' ' LYS . . . -63.19 -26.19 68.69 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.808 -0.812 . . . . 0.36 108.808 178.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 1.033 ' ND2' ' HB2' ' A' ' 126' ' ' LYS . 22.4 m-80 -98.67 20.31 13.18 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.316 -0.865 . . . . 1.19 109.586 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.833 ' OD1' ' O ' ' A' ' 127' ' ' TYR . 12.5 p30 45.49 28.32 0.48 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.248 -0.908 . . . . 1.17 110.759 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 1.01 HG21 HD13 ' A' ' 149' ' ' LEU . 78.4 t -75.05 132.45 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 N-CA-C 108.243 -1.021 . . . . 0.33 108.243 178.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 1.583 ' C ' HG13 ' A' ' 129' ' ' VAL . 44.6 p -89.18 125.32 35.01 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.003 -1.061 . . . . 0.39 109.93 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 1.3 ' CG ' HG12 ' A' ' 129' ' ' VAL . 11.6 mt -96.41 109.66 48.83 Favored Pre-proline 0 N--CA 1.498 1.931 0 O-C-N 121.841 -0.537 . . . . 0.57 109.619 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.874 ' HD2' ' NZ ' ' A' ' 145' ' ' LYS . 72.0 Cg_exo -49.32 142.12 22.97 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.95 1.767 . . . . 0.84 112.342 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.06 158.2 34.7 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.349 -0.844 . . . . 0.8 109.309 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 81.83 30.82 34.29 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.451 -1.46 . . . . 0.42 109.451 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.511 ' O ' ' OH ' ' A' ' 142' ' ' TYR . 91.7 mt-10 -146.76 110.7 5.0 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -1.152 . . . . 2.29 109.425 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 1.069 ' CB ' HG23 ' A' ' 135' ' ' VAL . 89.7 mt-30 -138.62 65.05 1.47 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.333 -0.854 . . . . 2.73 109.532 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 1.271 HH11 ' CA ' ' A' ' 137' ' ' THR . 14.4 mmm180 -130.58 137.86 49.87 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.635 -0.876 . . . . 4.34 108.635 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 1.289 ' NZ ' ' CZ ' ' A' ' 139' ' ' ARG . 36.9 tttt -58.62 -50.13 74.97 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.064 -1.022 . . . . 2.8 109.923 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.57 ' OD2' ' CG ' ' A' ' 140' ' ' LYS . 5.8 t70 -55.01 -40.76 70.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.0 -1.062 . . . . 2.19 110.127 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 1.362 ' CG1' HD23 ' A' ' 141' ' ' LEU . 49.6 t -59.16 -41.6 84.22 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 121.087 -1.008 . . . . 0.23 109.085 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 1.692 ' CZ ' ' CE2' ' A' ' 142' ' ' TYR . 61.3 m-85 -72.24 -32.5 66.76 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.127 -0.983 . . . . 0.4 109.529 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.934 HG21 ' OE1' ' A' ' 143' ' ' GLU . 66.1 t -69.92 -44.92 78.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 C-N-CA 118.62 -1.232 . . . . 0.26 109.265 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.7 ' O ' ' C ' ' A' ' 145' ' ' LYS . 40.5 tt0 -70.49 -32.33 69.8 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.42 -0.912 . . . . 2.39 109.84 -178.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.053 HD12 ' HA ' ' A' ' 142' ' ' TYR . 20.6 mt -61.86 -39.02 90.44 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 107.455 -1.313 . . . . 0.33 107.455 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.782 ' CE2' ' OE1' ' A' ' 123' ' ' GLN . 28.7 t80 -62.3 -45.25 94.11 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.191 -1.04 . . . . 0.29 108.191 178.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.491 HD21 HG21 ' A' ' 112' ' ' VAL . 84.0 mt -71.85 -38.52 70.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.253 -0.904 . . . . 0.31 109.852 178.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 1.394 ' CG ' ' HD2' ' A' ' 148' ' ' LYS . 49.0 tt0 -66.15 -41.33 90.53 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.486 -0.758 . . . . 2.08 111.407 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.815 ' CD2' ' HG2' ' A' ' 145' ' ' LYS . 89.7 m-70 -86.02 -46.17 10.75 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.015 -1.053 . . . . 0.54 111.65 -177.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 1.427 HD21 ' CE1' ' A' ' 127' ' ' TYR . 14.3 mt -91.7 -71.13 0.65 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.953 -1.092 . . . . 0.36 112.14 -177.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.931 ' O ' ' HA ' ' A' ' 151' ' ' GLU . 6.6 m -50.01 -49.87 49.29 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.927 -1.108 . . . . 0.89 110.113 -176.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 1.173 ' HB1' ' OE1' ' A' ' 151' ' ' GLU . . . -50.13 -22.15 1.57 Allowed 'General case' 0 C--N 1.295 -1.766 0 O-C-N 120.781 -1.2 . . . . 0.47 110.427 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 1.244 ' HD2' ' CB ' ' A' ' 152' ' ' GLN . 32.2 mtt180 -125.06 -11.34 7.07 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.176 -0.953 . . . . 3.21 110.536 -179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 1.021 ' HB2' ' O ' ' A' ' 150' ' ' ARG . 30.4 t-20 -71.63 22.47 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.015 -1.053 . . . . 1.85 109.875 -178.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.5 ' H ' ' C ' ' A' ' 48' ' ' ARG . 1.6 ptp180 . . . . . 0 N--CA 1.494 1.746 0 O-C-N 121.075 -1.016 . . . . 5.45 109.267 -178.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 1.199 ' O ' HG22 ' A' ' 10' ' ' VAL . 72.1 m-20 . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 121.902 0.858 . . . . 3.12 111.02 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.758 HG23 ' N ' ' A' ' 9' ' ' SER . 17.7 m -75.31 -20.33 16.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 CA-C-O 121.54 0.686 . . . . 1.06 109.152 178.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.593 ' CG2' ' O ' ' A' ' 9' ' ' SER . 58.6 m -81.58 -19.02 42.82 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.467 -0.771 . . . . 0.78 110.106 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -87.5 -2.17 58.44 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.888 -1.133 . . . . 2.57 110.053 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.806 HD12 HD21 ' A' ' 16' ' ' LEU . 30.7 mt -74.76 145.14 43.24 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.92 -1.112 . . . . 0.75 109.06 179.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.726 ' O ' ' O ' ' A' ' 12' ' ' THR . 13.5 m -80.23 151.72 29.48 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 121.268 0.556 . . . . 0.51 109.572 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 1.141 ' HB3' ' HB3' ' A' ' 13' ' ' LYS . 0.9 OUTLIER -44.07 -38.35 3.55 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.176 -0.952 . . . . 2.26 109.566 -179.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.868 ' O ' ' O ' ' A' ' 14' ' ' ASP . 96.5 mt-10 -68.78 -51.01 45.64 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.493 -0.754 . . . . 2.41 110.115 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.445 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 75.9 m-20 -63.88 -40.06 95.64 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.18 -0.95 . . . . 2.05 110.661 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 1.132 ' HB2' ' O ' ' A' ' 12' ' ' THR . 24.3 tp -56.56 -37.5 70.63 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.091 -1.006 . . . . 0.5 109.738 -179.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 1.091 HD23 ' C ' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -71.44 -37.07 71.45 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.127 -0.983 . . . . 1.55 108.454 179.576 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.71 ' N ' ' O ' ' A' ' 15' ' ' LYS . 19.8 t70 -56.15 -41.47 75.45 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 119.496 -0.881 . . . . 1.14 109.066 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.782 ' OE1' ' CE2' ' A' ' 41' ' ' TYR . 92.2 mt-30 -70.12 -42.32 72.78 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.192 -0.942 . . . . 2.34 110.344 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 17' ' ' LYS . 18.5 mt -60.09 -43.3 95.63 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.056 -1.028 . . . . 0.65 109.618 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 17' ' ' LYS . 72.2 t -62.13 -37.09 77.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 O-C-N 121.125 -0.985 . . . . 0.47 109.848 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 1.033 ' HB2' ' ND2' ' A' ' 23' ' ' ASN . 39.7 mttt -57.89 -33.78 69.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.359 -0.838 . . . . 2.71 110.517 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' TYR . . . . . 1.427 ' CE1' HD21 ' A' ' 45' ' ' LEU . 75.7 m-85 -78.84 4.45 13.98 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.891 -1.13 . . . . 0.8 109.809 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 81.17 18.78 68.48 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.95 -1.26 . . . . 0.63 109.95 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 1.583 HG13 ' C ' ' A' ' 26' ' ' THR . 15.7 t -103.73 130.5 54.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.179 -1.189 . . . . 0.61 108.97 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -136.96 80.33 36.22 Favored Pre-proline 0 N--CA 1.494 1.725 0 O-C-N 121.082 -1.011 . . . . 2.58 109.117 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.404 ' CG ' ' HE1' ' A' ' 37' ' ' TYR . 98.0 Cg_endo -86.94 -148.7 0.03 OUTLIER 'Trans proline' 0 C--N 1.302 -1.901 0 C-N-CA 123.11 2.54 . . . . 1.17 111.68 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.408 ' O ' ' OH ' ' A' ' 37' ' ' TYR . . . -93.34 155.88 22.46 Favored Glycine 0 N--CA 1.487 2.099 0 N-CA-C 108.854 -1.698 . . . . 1.77 108.854 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . 1.172 ' HA ' ' NZ ' ' A' ' 17' ' ' LYS . 13.2 Cg_endo -58.75 112.56 1.24 Allowed 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.269 1.98 . . . . 1.57 112.188 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . 1.508 HG22 ' CD2' ' A' ' 37' ' ' TYR . 6.2 pt -33.59 113.71 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 CA-C-O 121.276 0.56 . . . . 1.16 111.043 -179.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 1.069 HG23 ' CB ' ' A' ' 32' ' ' GLN . 57.3 t -76.01 -78.96 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.13 -0.981 . . . . 1.5 109.626 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -174.6 -8.04 0.02 OUTLIER Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.449 -1.46 . . . . 1.37 109.449 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . 1.271 ' CA ' HH11 ' A' ' 33' ' ' ARG . 14.8 t -125.36 -13.64 6.6 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.254 -1.145 . . . . 0.98 109.488 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 1.198 ' O ' ' HB ' ' A' ' 36' ' ' VAL . 4.0 t -98.94 -10.97 22.06 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.101 -0.999 . . . . 0.56 108.348 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 1.289 ' CZ ' ' NZ ' ' A' ' 34' ' ' LYS . 68.2 ttt180 -55.35 -39.89 70.58 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.844 -0.535 . . . . 3.77 110.114 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.57 ' CG ' ' OD2' ' A' ' 35' ' ' ASP . 16.4 mtmm -63.05 -36.61 84.15 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.966 -1.084 . . . . 2.99 109.926 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 1.362 HD23 ' CG1' ' A' ' 36' ' ' VAL . 11.6 tp -62.79 -45.41 92.78 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 120.969 -1.082 . . . . 1.08 109.491 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . 1.692 ' CE2' ' CZ ' ' A' ' 37' ' ' TYR . 70.4 m-85 -65.89 -36.63 83.95 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.45 -0.781 . . . . 0.64 109.854 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.934 ' OE1' HG21 ' A' ' 38' ' ' VAL . 97.8 mt-10 -63.32 -41.93 98.95 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 120.926 -1.109 . . . . 1.69 108.874 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . 0.595 ' O ' ' N ' ' A' ' 43' ' ' GLN . 62.7 tttt -68.09 -46.36 71.19 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.258 -0.901 . . . . 2.82 109.213 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.874 ' NZ ' ' HD2' ' A' ' 28' ' ' PRO . 14.9 ttmt -58.47 -40.76 83.57 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.475 -0.766 . . . . 2.57 109.295 -179.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 20' ' ' LEU . 33.0 tp -55.48 -39.77 70.84 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.213 -0.929 . . . . 1.88 109.077 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.753 ' O ' ' N ' ' A' ' 47' ' ' ALA . 79.3 mt -57.93 -37.88 74.89 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.379 -0.971 . . . . 0.48 108.379 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 1.394 ' HD2' ' CG ' ' A' ' 43' ' ' GLN . 70.1 tttt -61.98 -46.7 88.09 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.557 -0.714 . . . . 2.73 109.227 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 1.01 HD13 HG21 ' A' ' 25' ' ' VAL . 90.6 mt -63.55 -41.85 98.41 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.336 -0.853 . . . . 0.66 109.07 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . 1.436 ' CZ ' ' HB2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -60.03 -35.55 75.35 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.698 -0.852 . . . . 3.46 108.698 179.778 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 1.173 ' OE1' ' HB1' ' A' ' 47' ' ' ALA . 37.9 tt0 -58.52 -37.76 76.3 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 108.998 -0.741 . . . . 2.13 108.998 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 1.244 ' CB ' ' HD2' ' A' ' 48' ' ' ARG . 32.3 tt0 -54.87 -31.9 60.2 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.392 -0.818 . . . . 3.07 109.498 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.777 ' C ' ' HA ' ' A' ' 49' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.33 0 N-CA-C 110.212 -1.155 . . . . 3.32 110.212 -179.573 . . . . . . . . 1 1 . 1 stop_ save_