data_1nk2_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 1nk2 _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 ' P' P ' 116' ' ' PHE . . . . . 0.668 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.0 OUTLIER . . . . . 0 C--O 1.254 1.331 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -68.14 147.53 52.17 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -174.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -43.96 -37.16 2.77 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 112.824 -1.989 . . . . 0.0 109.165 -177.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.5 -65.26 0.6 Allowed 'General case' 0 C--N 1.383 2.024 0 CA-C-O 124.071 1.891 . . . . 0.0 109.279 174.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.531 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.6 mt-30 -48.24 -49.58 32.7 Favored 'General case' 0 C--N 1.382 1.991 0 CA-C-N 112.56 -2.109 . . . . 0.0 109.394 175.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.528 ' HA ' HD13 ' P' ' 124' ' ' LEU . 22.6 m -49.07 -55.76 11.14 Favored 'General case' 0 C--N 1.382 1.987 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 170.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.685 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.19 -46.1 68.85 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-O 122.504 1.145 . . . . 0.0 110.224 -169.47 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.837 ' HG3' HG23 ' P' ' 146' ' ' ILE . 0.1 OUTLIER -66.16 -40.05 90.23 Favored 'General case' 0 C--N 1.379 1.883 0 CA-C-N 113.983 -1.462 . . . . 0.0 107.927 179.102 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.986 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -61.02 -48.68 80.65 Favored 'General case' 0 C--N 1.385 2.139 0 O-C-N 120.484 -1.385 . . . . 0.0 110.226 172.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.507 ' O ' ' N ' ' P' ' 129' ' ' ARG . 26.0 mt-10 -53.17 -56.12 18.86 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 122.191 0.996 . . . . 0.0 108.598 175.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.685 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.53 -62.0 0.74 Allowed 'General case' 0 C--N 1.379 1.855 0 CA-C-N 112.172 -2.285 . . . . 0.0 108.705 179.113 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.661 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.4 OUTLIER -66.85 -30.51 70.71 Favored 'General case' 0 C--N 1.395 2.571 0 CA-C-N 112.233 -2.258 . . . . 0.0 108.282 -170.63 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.812 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.4 t80 -69.74 -50.82 39.77 Favored 'General case' 0 C--N 1.387 2.232 0 O-C-N 121.067 -1.021 . . . . 0.0 110.96 171.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.507 ' N ' ' O ' ' P' ' 125' ' ' GLU . 0.4 OUTLIER -62.26 -12.01 18.13 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-N 113.338 -1.755 . . . . 0.0 108.177 -167.218 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -102.66 -43.33 5.63 Favored 'General case' 0 C--N 1.381 1.945 0 CA-C-O 123.985 1.85 . . . . 0.0 107.258 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.476 ' HG2' ' CD2' ' P' ' 134' ' ' LEU . 2.8 tp-100 -151.69 128.74 11.08 Favored 'General case' 0 C--N 1.387 2.209 0 CA-C-N 111.608 -2.542 . . . . 0.0 110.822 -154.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -79.33 -27.94 42.08 Favored 'General case' 0 C--N 1.389 2.29 0 CA-C-N 112.003 -2.362 . . . . 0.0 111.46 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.572 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 9.2 m-85 -158.66 114.48 2.65 Favored 'General case' 0 C--N 1.377 1.79 0 CA-C-O 122.679 1.228 . . . . 0.0 109.009 -150.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.709 HD21 ' HG3' ' P' ' 138' ' ' GLU . 36.6 mt -122.92 136.08 54.73 Favored 'General case' 0 C--N 1.404 2.957 0 CA-C-N 114.393 -1.276 . . . . 0.0 108.267 -160.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.11 155.79 26.09 Favored 'General case' 0 C--N 1.383 2.025 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 166.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.558 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.34 -49.86 90.43 Favored Pre-proline 0 CA--C 1.584 2.269 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -161.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.558 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 84.1 Cg_exo -57.87 -28.89 84.38 Favored 'Trans proline' 0 C--N 1.4 3.277 0 C-N-CA 121.122 1.215 . . . . 0.0 114.932 -174.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.709 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -53.92 -71.36 0.08 Allowed 'General case' 0 C--N 1.38 1.9 0 CA-C-O 124.606 2.146 . . . . 0.0 106.44 160.782 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.894 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.96 -38.69 79.57 Favored 'General case' 0 C--N 1.39 2.334 0 CA-C-N 109.828 -3.351 . . . . 0.0 108.785 -155.33 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.643 ' O ' ' N ' ' P' ' 144' ' ' SER . 5.6 mt-10 -52.84 -39.58 62.63 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 122.849 1.309 . . . . 0.0 108.183 177.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . 0.411 ' HA ' ' HB3' ' P' ' 144' ' ' SER . 2.1 t-160 -64.83 -36.47 84.44 Favored 'General case' 0 C--N 1.379 1.879 0 CA-C-N 112.926 -1.943 . . . . 0.0 108.562 -170.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.63 ' O ' HG21 ' P' ' 146' ' ' ILE . 3.2 tp -64.84 -43.2 93.83 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-O 123.104 1.431 . . . . 0.0 109.116 167.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.598 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -57.31 -32.43 66.67 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 112.597 -2.092 . . . . 0.0 108.45 175.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.643 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.4 OUTLIER -73.71 -44.91 55.17 Favored 'General case' 0 C--N 1.386 2.158 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.552 -178.07 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 78.5 mt -67.26 -42.84 83.24 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-O 124.598 2.142 . . . . 0.0 108.349 -163.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.975 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -101.82 -13.01 8.55 Favored 'Isoleucine or valine' 0 C--N 1.389 2.292 0 CA-C-N 111.05 -2.796 . . . . 0.0 107.817 -167.081 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 82.13 34.7 0.08 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-O 125.597 2.618 . . . . 0.0 107.98 152.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.975 HD13 ' CD1' ' P' ' 146' ' ' ILE . 8.4 mt -96.28 170.04 9.52 Favored 'General case' 0 C--N 1.397 2.633 0 CA-C-N 111.556 -2.565 . . . . 0.0 109.468 170.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.651 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.4 p -91.21 139.71 25.61 Favored Pre-proline 0 CA--C 1.592 2.58 0 CA-C-O 122.729 1.252 . . . . 0.0 108.718 169.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.5 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 16.2 Cg_exo -56.03 -33.9 90.89 Favored 'Trans proline' 1 C--N 1.415 4.075 0 C-N-CA 122.727 2.284 . . . . 0.0 113.114 -159.829 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' P' P ' 151' ' ' THR . . . . . 0.463 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -57.29 -37.57 72.62 Favored 'General case' 0 C--N 1.383 2.045 0 C-N-CA 119.534 -0.866 . . . . 0.0 109.807 166.673 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.651 ' N ' ' O ' ' P' ' 149' ' ' THR . 49.0 mt-30 -68.51 -28.48 67.04 Favored 'General case' 0 C--N 1.387 2.225 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 -175.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.547 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.1 t -64.53 -70.31 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.193 0 CA-C-N 121.183 1.811 . . . . 0.0 109.517 165.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.894 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.95 -58.59 0.44 Allowed 'General case' 0 C--N 1.384 2.106 0 C-N-CA 125.013 1.325 . . . . 0.0 110.959 -178.143 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . 0.542 HD12 ' OE1' ' P' ' 158' ' ' GLN . 33.4 mm -60.19 -39.33 80.29 Favored 'Isoleucine or valine' 0 C--N 1.382 1.989 0 CA-C-N 113.106 -1.861 . . . . 0.0 109.114 -172.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.986 ' HB3' HD21 ' P' ' 124' ' ' LEU . 3.8 t90 -67.21 -32.08 72.9 Favored 'General case' 0 C--N 1.382 2.003 0 O-C-N 121.373 -0.829 . . . . 0.0 109.088 172.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.812 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 49.2 m-85 -74.66 -40.72 61.28 Favored 'General case' 0 C--O 1.273 2.337 0 O-C-N 120.927 -1.108 . . . . 0.0 111.972 173.495 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.542 ' OE1' HD12 ' P' ' 155' ' ' ILE . 77.8 mt-30 -52.37 -58.14 7.63 Favored 'General case' 0 C--N 1.377 1.778 0 O-C-N 119.771 -1.831 . . . . 0.0 106.765 170.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -55.84 -25.62 42.85 Favored 'General case' 0 C--N 1.388 2.27 0 CA-C-O 117.709 -1.138 . . . . 0.0 109.659 -168.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.555 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 2.1 t60 -79.75 -42.89 23.61 Favored 'General case' 0 C--O 1.286 2.992 0 CA-C-N 121.526 1.967 . . . . 0.0 111.878 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.572 ' HD2' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.003 0 CA-C-N 123.57 2.896 . . . . 0.0 110.785 -167.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.52 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.1 m-85 . . . . . 0 C--O 1.253 1.276 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.03 148.1 51.48 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -174.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -44.02 -37.19 2.84 Favored 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.084 -1.871 . . . . 0.0 109.187 -178.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.58 -62.15 1.84 Allowed 'General case' 0 C--N 1.382 2.011 0 CA-C-O 124.036 1.874 . . . . 0.0 109.394 175.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.539 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 81.6 mt-30 -52.96 -48.16 67.58 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-N 112.617 -2.083 . . . . 0.0 109.587 177.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.59 ' HA ' HD13 ' P' ' 124' ' ' LEU . 16.0 m -49.33 -55.81 11.61 Favored 'General case' 0 C--N 1.384 2.093 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 169.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.546 ' CE1' ' CZ ' ' P' ' 126' ' ' ARG . 2.9 t80 -53.11 -48.11 68.08 Favored 'General case' 0 C--N 1.382 2.018 0 CA-C-O 122.628 1.204 . . . . 0.0 109.949 -169.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 1.016 ' CD ' HG23 ' P' ' 146' ' ' ILE . 4.2 mt-10 -66.02 -38.11 87.6 Favored 'General case' 0 C--N 1.378 1.807 0 CA-C-N 113.979 -1.464 . . . . 0.0 107.604 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.798 HD21 ' HB3' ' P' ' 156' ' ' TRP . 3.1 mt -60.76 -50.3 74.03 Favored 'General case' 0 C--N 1.385 2.114 0 O-C-N 120.658 -1.276 . . . . 0.0 110.062 171.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.557 ' O ' ' N ' ' P' ' 129' ' ' ARG . 15.5 mt-10 -54.3 -53.65 50.89 Favored 'General case' 0 C--N 1.379 1.887 0 CA-C-O 122.477 1.132 . . . . 0.0 109.014 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.546 ' CZ ' ' CE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.94 -65.04 0.43 Allowed 'General case' 0 C--N 1.379 1.886 0 CA-C-N 111.96 -2.382 . . . . 0.0 108.76 177.46 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.895 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -63.78 -32.7 74.29 Favored 'General case' 0 C--N 1.394 2.519 0 CA-C-N 112.405 -2.18 . . . . 0.0 108.34 -170.794 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.762 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 7.3 t80 -68.76 -51.01 45.77 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-O 121.973 0.892 . . . . 0.0 110.373 173.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.557 ' N ' ' O ' ' P' ' 125' ' ' GLU . 8.9 mmm180 -62.36 -12.21 19.94 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.306 -1.77 . . . . 0.0 108.198 -165.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -107.75 -40.97 5.13 Favored 'General case' 0 C--N 1.379 1.878 0 C-N-CA 126.234 1.814 . . . . 0.0 107.626 -172.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.491 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.4 OUTLIER -156.11 97.89 1.83 Allowed 'General case' 0 C--N 1.387 2.22 0 CA-C-N 111.952 -2.385 . . . . 0.0 110.263 -153.164 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . 0.52 ' HD3' ' CD2' ' P' ' 133' ' ' TYR . 0.1 OUTLIER -76.98 -6.91 54.47 Favored 'General case' 0 C--N 1.394 2.501 0 CA-C-N 112.035 -2.348 . . . . 0.0 110.97 -163.968 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.563 ' CD1' ' CZ ' ' P' ' 161' ' ' ARG . 4.0 m-85 -161.6 112.42 1.68 Allowed 'General case' 0 C--N 1.381 1.946 0 CA-C-N 114.671 -1.15 . . . . 0.0 108.511 -154.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.702 HD12 ' HD3' ' P' ' 127' ' ' ARG . 30.3 mt -130.64 136.02 48.43 Favored 'General case' 0 C--N 1.396 2.599 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -156.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.52 156.11 25.43 Favored 'General case' 0 C--N 1.381 1.959 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 167.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.558 ' HB2' ' HD3' ' P' ' 137' ' ' PRO . . . -59.36 -50.2 88.65 Favored Pre-proline 0 CA--C 1.582 2.185 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -162.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.558 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 89.3 Cg_exo -57.23 -29.83 85.15 Favored 'Trans proline' 0 C--N 1.401 3.323 0 C-N-CA 120.836 1.024 . . . . 0.0 114.624 -174.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.642 ' HG3' HD21 ' P' ' 134' ' ' LEU . 1.6 mm-40 -54.29 -71.41 0.08 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-O 124.26 1.981 . . . . 0.0 106.48 161.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.922 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.56 -34.52 74.31 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 110.008 -3.269 . . . . 0.0 109.026 -155.35 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.607 ' O ' ' N ' ' P' ' 144' ' ' SER . 7.4 mt-10 -52.3 -43.77 64.67 Favored 'General case' 0 C--N 1.38 1.908 0 CA-C-O 123.356 1.551 . . . . 0.0 108.03 174.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -63.27 -36.3 83.2 Favored 'General case' 0 C--N 1.38 1.911 0 CA-C-N 112.406 -2.179 . . . . 0.0 108.738 -168.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.895 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.1 tp -66.24 -42.8 88.09 Favored 'General case' 0 C--N 1.383 2.063 0 CA-C-O 122.987 1.375 . . . . 0.0 109.167 170.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.604 ' HB1' ' HA ' ' P' ' 150' ' ' PRO . . . -56.52 -34.58 67.16 Favored 'General case' 0 C--N 1.387 2.224 0 CA-C-N 112.742 -2.026 . . . . 0.0 108.183 172.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.607 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -71.38 -42.61 68.2 Favored 'General case' 0 C--N 1.388 2.263 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.395 -178.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 80.9 mt -68.63 -46.54 68.94 Favored 'General case' 0 C--N 1.38 1.917 0 CA-C-O 124.682 2.182 . . . . 0.0 108.226 -163.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 1.016 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -96.53 -13.01 8.27 Favored 'Isoleucine or valine' 0 C--N 1.389 2.302 0 CA-C-N 110.926 -2.852 . . . . 0.0 107.967 -168.366 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 82.18 35.5 0.07 Allowed 'General case' 0 C--N 1.381 1.956 0 CA-C-O 125.721 2.677 . . . . 0.0 107.652 152.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.986 HD13 ' CD1' ' P' ' 146' ' ' ILE . 8.6 mt -95.61 172.72 7.88 Favored 'General case' 0 C--N 1.397 2.635 0 CA-C-N 111.45 -2.614 . . . . 0.0 109.133 168.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.588 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.0 p -90.61 141.47 27.15 Favored Pre-proline 0 CA--C 1.589 2.462 0 CA-C-O 122.797 1.284 . . . . 0.0 108.267 166.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.604 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 0.4 OUTLIER -48.29 -47.0 21.13 Favored 'Trans proline' 0 C--N 1.405 3.502 0 C-N-CA 124.954 3.769 . . . . 0.0 115.424 -167.533 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' P' P ' 151' ' ' THR . . . . . 0.487 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -52.86 -31.03 37.13 Favored 'General case' 0 C--N 1.384 2.073 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.07 169.327 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.588 ' N ' ' O ' ' P' ' 149' ' ' THR . 46.8 mt-30 -74.66 -27.94 60.64 Favored 'General case' 0 C--N 1.392 2.42 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.757 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -64.15 -70.94 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.024 0 CA-C-N 122.116 2.235 . . . . 0.0 109.513 162.76 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.922 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.77 -59.57 0.4 Allowed 'General case' 0 C--N 1.387 2.199 0 CA-C-O 122.728 1.251 . . . . 0.0 110.583 -176.497 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 13.4 mm -56.2 -43.03 75.19 Favored 'Isoleucine or valine' 0 C--N 1.383 2.029 0 CA-C-N 112.995 -1.911 . . . . 0.0 109.112 -174.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.798 ' HB3' HD21 ' P' ' 124' ' ' LEU . 4.6 t90 -67.23 -31.58 72.04 Favored 'General case' 0 C--N 1.383 2.033 0 O-C-N 120.876 -1.14 . . . . 0.0 109.324 174.107 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.762 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 44.6 m-85 -75.55 -41.98 53.5 Favored 'General case' 0 C--O 1.275 2.406 0 O-C-N 121.053 -1.029 . . . . 0.0 111.888 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' P' ' 154' ' ' LYS . 51.4 mt-30 -49.5 -59.67 3.54 Favored 'General case' 0 C--N 1.378 1.826 0 O-C-N 119.296 -2.127 . . . . 0.0 107.005 169.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -55.83 -25.0 39.74 Favored 'General case' 0 C--N 1.389 2.295 0 CA-C-O 117.713 -1.137 . . . . 0.0 109.386 -166.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.542 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.6 OUTLIER -76.5 -46.84 24.97 Favored 'General case' 0 C--O 1.282 2.801 0 CA-C-N 121.213 1.824 . . . . 0.0 111.286 175.359 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.563 ' CZ ' ' CD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.378 1.841 0 CA-C-N 122.985 2.629 . . . . 0.0 110.543 -161.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.571 ' HD1' HD23 ' P' ' 148' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.31 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -65.95 147.53 53.21 Favored 'General case' 0 C--N 1.382 2.011 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 -172.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -42.65 -35.94 1.26 Allowed 'General case' 0 C--N 1.382 1.99 0 CA-C-N 113.547 -1.66 . . . . 0.0 109.594 -176.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.08 -68.12 0.21 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 124.078 1.894 . . . . 0.0 109.146 173.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.537 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 78.1 mt-30 -46.45 -50.58 16.62 Favored 'General case' 0 C--N 1.382 1.999 0 C-N-CA 127.166 2.186 . . . . 0.0 109.966 175.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.598 ' HA ' HD13 ' P' ' 124' ' ' LEU . 20.2 m -50.78 -57.26 8.82 Favored 'General case' 0 C--N 1.384 2.068 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 170.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.563 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.18 -46.25 68.87 Favored 'General case' 0 C--N 1.383 2.047 0 CA-C-O 122.329 1.061 . . . . 0.0 109.818 -170.217 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 1.013 ' CD ' HG23 ' P' ' 146' ' ' ILE . 6.5 mt-10 -66.86 -37.11 83.81 Favored 'General case' 0 C--N 1.379 1.872 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.496 178.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.847 HD21 ' HB3' ' P' ' 156' ' ' TRP . 3.2 mt -60.4 -51.24 70.34 Favored 'General case' 0 C--N 1.382 2.009 0 O-C-N 119.89 -1.756 . . . . 0.0 110.401 169.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.543 ' O ' ' N ' ' P' ' 129' ' ' ARG . 16.2 mt-10 -54.63 -52.88 60.89 Favored 'General case' 0 C--N 1.379 1.859 0 CA-C-O 122.434 1.111 . . . . 0.0 109.267 177.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.563 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -38.96 -67.62 0.2 Allowed 'General case' 0 C--N 1.379 1.891 0 CA-C-N 111.823 -2.444 . . . . 0.0 108.717 176.04 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.745 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.3 OUTLIER -62.28 -32.64 73.39 Favored 'General case' 0 C--N 1.393 2.462 0 CA-C-N 112.484 -2.144 . . . . 0.0 108.289 -170.117 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.829 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 12.6 t80 -68.8 -50.48 49.82 Favored 'General case' 0 C--N 1.388 2.247 0 CA-C-O 122.073 0.939 . . . . 0.0 110.77 174.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.543 ' N ' ' O ' ' P' ' 125' ' ' GLU . 8.6 mmm180 -62.33 -11.81 17.48 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.083 -1.871 . . . . 0.0 108.128 -167.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . 0.423 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 33.6 mt-30 -107.99 -40.46 5.23 Favored 'General case' 0 C--N 1.379 1.886 0 C-N-CA 126.378 1.871 . . . . 0.0 107.772 -172.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.495 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -155.19 102.48 2.3 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 111.943 -2.39 . . . . 0.0 109.501 -153.442 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . 0.718 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -77.15 -15.79 59.39 Favored 'General case' 0 C--N 1.387 2.205 0 CA-C-N 112.323 -2.217 . . . . 0.0 110.335 -165.629 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.814 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 2.6 m-30 -154.84 115.69 3.95 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.999 -1.455 . . . . 0.0 108.544 -158.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.665 HD12 ' HD3' ' P' ' 127' ' ' ARG . 21.1 mt -130.08 134.18 47.19 Favored 'General case' 0 C--N 1.398 2.717 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -157.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.2 154.11 25.62 Favored 'General case' 0 C--N 1.381 1.959 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 171.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.496 ' HA ' ' HG3' ' P' ' 139' ' ' ARG . . . -58.86 -45.89 99.58 Favored Pre-proline 0 CA--C 1.584 2.251 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -158.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.492 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 0.1 OUTLIER -52.55 -41.1 70.34 Favored 'Trans proline' 0 C--N 1.396 3.05 0 C-N-CA 122.631 2.22 . . . . 0.0 117.647 179.337 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.503 ' HG3' HD21 ' P' ' 134' ' ' LEU . 1.6 mm-40 -50.2 -69.45 0.11 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-O 123.509 1.623 . . . . 0.0 107.135 166.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.543 ' HD3' HG13 ' P' ' 153' ' ' VAL . 1.0 OUTLIER -69.12 -35.56 76.55 Favored 'General case' 0 C--N 1.389 2.291 0 CA-C-N 110.072 -3.24 . . . . 0.0 108.494 -158.339 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.629 ' O ' ' N ' ' P' ' 144' ' ' SER . 4.2 mt-10 -53.29 -41.05 65.21 Favored 'General case' 0 C--N 1.38 1.926 0 CA-C-O 123.112 1.434 . . . . 0.0 108.539 176.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -64.67 -35.8 82.2 Favored 'General case' 0 C--N 1.38 1.921 0 CA-C-N 112.81 -1.996 . . . . 0.0 108.804 -169.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.745 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.3 tp -65.64 -42.99 90.84 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-O 123.211 1.482 . . . . 0.0 109.198 168.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.598 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.9 -33.89 67.38 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.429 -2.169 . . . . 0.0 108.227 174.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.629 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.7 m -73.28 -42.72 62.12 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 113.699 -1.591 . . . . 0.0 109.752 -178.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 78.7 mt -66.62 -48.02 70.79 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 124.659 2.171 . . . . 0.0 108.318 -165.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 1.013 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -96.56 -12.84 8.31 Favored 'Isoleucine or valine' 0 C--N 1.389 2.322 0 CA-C-N 110.821 -2.9 . . . . 0.0 107.933 -167.11 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 82.44 35.03 0.07 Allowed 'General case' 0 C--N 1.381 1.939 0 CA-C-O 125.755 2.693 . . . . 0.0 107.865 152.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.988 HD13 ' CD1' ' P' ' 146' ' ' ILE . 8.8 mt -96.17 170.81 9.0 Favored 'General case' 0 C--N 1.397 2.659 0 CA-C-N 111.571 -2.559 . . . . 0.0 109.382 169.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.643 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.2 p -92.46 140.15 24.04 Favored Pre-proline 0 CA--C 1.592 2.566 0 CA-C-O 122.738 1.256 . . . . 0.0 108.752 170.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.518 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 21.4 Cg_exo -55.08 -33.48 83.79 Favored 'Trans proline' 1 C--N 1.415 4.036 0 C-N-CA 122.902 2.401 . . . . 0.0 113.815 -160.234 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.21 -38.26 73.46 Favored 'General case' 0 C--N 1.382 2.003 0 C-N-CA 119.084 -1.046 . . . . 0.0 109.442 166.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.643 ' N ' ' O ' ' P' ' 149' ' ' THR . 49.1 mt-30 -69.36 -28.4 66.17 Favored 'General case' 0 C--N 1.387 2.214 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 -174.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.645 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.1 t -64.2 -71.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.186 0 CA-C-N 121.394 1.906 . . . . 0.0 109.259 164.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.491 ' N ' HG13 ' P' ' 153' ' ' VAL . 0.0 OUTLIER -34.69 -58.46 0.5 Allowed 'General case' 0 C--N 1.384 2.093 0 C-N-CA 125.012 1.325 . . . . 0.0 110.54 -176.175 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 28.8 mm -60.65 -38.85 79.69 Favored 'Isoleucine or valine' 0 C--N 1.381 1.969 0 CA-C-N 113.328 -1.76 . . . . 0.0 108.859 -172.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.847 ' HB3' HD21 ' P' ' 124' ' ' LEU . 4.1 t90 -67.66 -31.88 72.17 Favored 'General case' 0 C--N 1.384 2.07 0 O-C-N 121.168 -0.957 . . . . 0.0 109.451 172.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.829 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 62.9 m-85 -75.18 -40.14 59.63 Favored 'General case' 0 C--O 1.274 2.358 0 O-C-N 121.231 -0.918 . . . . 0.0 112.115 173.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.431 ' N ' ' O ' ' P' ' 154' ' ' LYS . 77.1 mt-30 -51.72 -61.76 2.05 Favored 'General case' 0 C--N 1.376 1.754 0 O-C-N 119.709 -1.869 . . . . 0.0 106.479 168.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -56.43 -24.19 43.62 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-O 117.446 -1.264 . . . . 0.0 109.448 -167.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.53 ' HB3' ' CD2' ' P' ' 128' ' ' PHE . 3.1 t60 -78.33 -39.66 38.91 Favored 'General case' 0 C--O 1.282 2.785 0 CA-C-N 121.606 2.003 . . . . 0.0 111.489 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.814 ' HD3' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.265 1.903 0 CA-C-N 122.668 2.485 . . . . 0.0 111.137 -177.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.636 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.8 m-85 . . . . . 0 C--O 1.258 1.515 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -65.88 147.64 53.05 Favored 'General case' 0 C--N 1.382 2.006 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -169.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -42.85 -36.56 1.53 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-N 113.843 -1.526 . . . . 0.0 109.286 -176.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.89 -65.54 0.55 Allowed 'General case' 0 C--N 1.382 2.014 0 CA-C-O 124.172 1.939 . . . . 0.0 109.261 174.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.537 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.0 mt-30 -50.96 -47.39 61.29 Favored 'General case' 0 C--N 1.381 1.967 0 CA-C-N 112.426 -2.17 . . . . 0.0 110.073 177.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.536 ' HA ' HD13 ' P' ' 124' ' ' LEU . 11.3 m -50.02 -57.83 6.76 Favored 'General case' 0 C--N 1.383 2.03 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 168.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.57 ' CE2' ' CZ ' ' P' ' 126' ' ' ARG . 0.9 OUTLIER -52.86 -47.79 67.55 Favored 'General case' 0 C--N 1.383 2.038 0 CA-C-O 122.377 1.084 . . . . 0.0 110.017 -169.097 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.987 ' CD ' HG23 ' P' ' 146' ' ' ILE . 7.1 mt-10 -66.94 -35.86 80.93 Favored 'General case' 0 C--N 1.379 1.862 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.973 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.8 mt -60.43 -52.4 65.37 Favored 'General case' 0 C--N 1.383 2.043 0 O-C-N 120.044 -1.66 . . . . 0.0 110.592 168.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.549 ' O ' ' N ' ' P' ' 129' ' ' ARG . 15.8 mt-10 -53.77 -53.65 49.35 Favored 'General case' 0 C--N 1.379 1.854 0 CA-C-O 122.248 1.023 . . . . 0.0 108.874 177.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.57 ' CZ ' ' CE2' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -38.05 -67.25 0.21 Allowed 'General case' 0 C--N 1.38 1.926 0 CA-C-N 111.683 -2.508 . . . . 0.0 108.679 176.403 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.746 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -64.14 -29.94 71.04 Favored 'General case' 0 C--N 1.394 2.501 0 CA-C-N 112.287 -2.233 . . . . 0.0 108.23 -169.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.839 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 12.3 t80 -69.44 -50.73 42.91 Favored 'General case' 0 C--N 1.389 2.29 0 O-C-N 121.134 -0.979 . . . . 0.0 110.956 172.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' P' ' 125' ' ' GLU . 10.1 mmm180 -62.28 -11.87 17.5 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.083 -1.872 . . . . 0.0 108.093 -166.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . 0.445 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 34.2 mt-30 -109.19 -39.74 5.16 Favored 'General case' 0 C--N 1.38 1.892 0 C-N-CA 126.355 1.862 . . . . 0.0 108.044 -171.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.505 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -153.15 109.36 3.35 Favored 'General case' 0 C--N 1.389 2.295 0 CA-C-N 112.24 -2.255 . . . . 0.0 109.217 -153.579 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -77.05 -19.77 56.73 Favored 'General case' 0 C--N 1.394 2.519 0 CA-C-N 112.171 -2.286 . . . . 0.0 110.806 -168.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.593 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 15.4 m-85 -159.82 114.34 2.31 Favored 'General case' 0 C--N 1.38 1.9 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.373 -153.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.69 HD12 ' HD3' ' P' ' 127' ' ' ARG . 27.1 mt -126.66 136.97 53.19 Favored 'General case' 0 C--N 1.399 2.754 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -158.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 155.16 25.93 Favored 'General case' 0 C--N 1.382 1.998 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 166.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.528 ' HB2' ' HD3' ' P' ' 137' ' ' PRO . . . -59.57 -49.62 91.2 Favored Pre-proline 0 CA--C 1.582 2.209 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.355 -161.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.528 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 81.3 Cg_exo -58.2 -28.69 84.99 Favored 'Trans proline' 0 C--N 1.401 3.297 0 C-N-CA 121.048 1.165 . . . . 0.0 114.894 -174.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.652 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.1 OUTLIER -54.03 -71.06 0.08 Allowed 'General case' 0 C--N 1.38 1.9 0 CA-C-O 124.704 2.192 . . . . 0.0 106.334 160.393 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.822 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.1 -40.14 82.66 Favored 'General case' 0 C--N 1.389 2.303 0 CA-C-N 109.965 -3.289 . . . . 0.0 108.885 -154.927 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.611 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 3.9 mt-10 -53.35 -39.17 63.93 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 123.163 1.459 . . . . 0.0 108.304 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -64.28 -35.46 80.91 Favored 'General case' 0 C--N 1.38 1.918 0 CA-C-N 112.945 -1.934 . . . . 0.0 108.732 -171.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.746 HD12 ' CG ' ' P' ' 127' ' ' ARG . 2.3 tp -65.47 -42.77 91.9 Favored 'General case' 0 C--N 1.383 2.023 0 CA-C-O 123.223 1.487 . . . . 0.0 109.038 168.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.611 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -57.04 -34.71 68.5 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-N 112.38 -2.191 . . . . 0.0 108.592 174.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.632 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 0.9 OUTLIER -73.51 -43.22 60.56 Favored 'General case' 0 C--N 1.387 2.225 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.19 -179.443 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . 0.736 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 75.0 mt -66.19 -48.06 71.9 Favored 'General case' 0 C--N 1.379 1.888 0 CA-C-O 124.743 2.211 . . . . 0.0 107.954 -164.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.987 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -94.68 -17.03 7.26 Favored 'Isoleucine or valine' 0 C--N 1.385 2.145 0 CA-C-N 110.544 -3.025 . . . . 0.0 107.84 -172.104 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . 0.736 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.0 OUTLIER 81.19 37.21 0.08 Allowed 'General case' 0 C--N 1.385 2.126 0 CA-C-N 111.494 -2.594 . . . . 0.0 108.112 152.777 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.979 HD13 ' CD1' ' P' ' 146' ' ' ILE . 6.1 mt -95.24 168.08 10.96 Favored 'General case' 0 C--N 1.39 2.35 0 CA-C-N 112.13 -2.305 . . . . 0.0 109.416 168.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.643 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.0 p -88.12 143.97 33.73 Favored Pre-proline 0 CA--C 1.587 2.392 0 CA-C-O 122.986 1.374 . . . . 0.0 108.273 172.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.433 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 1.3 Cg_endo -59.73 -38.44 80.85 Favored 'Trans proline' 1 C--N 1.415 4.031 0 C-N-CA 122.715 2.277 . . . . 0.0 112.073 -155.568 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' P' P ' 151' ' ' THR . . . . . 0.518 HG23 HG12 ' P' ' 155' ' ' ILE . 0.4 OUTLIER -57.81 -29.47 64.93 Favored 'General case' 0 C--N 1.385 2.129 0 CA-C-O 118.081 -0.961 . . . . 0.0 110.343 167.754 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.643 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -73.64 -28.04 61.58 Favored 'General case' 0 C--N 1.388 2.258 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.585 HG11 ' CD1' ' P' ' 157' ' ' PHE . 1.3 t -64.38 -72.53 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 122.019 2.19 . . . . 0.0 109.439 164.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.822 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.27 -57.44 0.49 Allowed 'General case' 0 C--N 1.385 2.148 0 C-N-CA 125.188 1.395 . . . . 0.0 111.017 -177.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . 0.518 HG12 HG23 ' P' ' 151' ' ' THR . 0.7 OUTLIER -53.04 -47.81 53.71 Favored 'Isoleucine or valine' 0 C--N 1.386 2.17 0 CA-C-N 112.86 -1.973 . . . . 0.0 108.967 -176.45 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.973 ' HB3' HD21 ' P' ' 124' ' ' LEU . 4.4 t90 -66.19 -31.06 71.67 Favored 'General case' 0 C--N 1.382 1.98 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.839 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 69.0 m-85 -74.82 -39.87 61.4 Favored 'General case' 0 C--O 1.274 2.373 0 O-C-N 121.257 -0.902 . . . . 0.0 112.057 174.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' P' ' 154' ' ' LYS . 24.7 mt-30 -49.71 -63.87 0.98 Allowed 'General case' 0 C--N 1.377 1.762 0 O-C-N 119.558 -1.964 . . . . 0.0 106.953 167.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -57.48 -13.55 3.79 Favored 'General case' 0 C--N 1.388 2.253 0 CA-C-O 118.129 -0.938 . . . . 0.0 111.024 -165.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.559 ' ND1' ' CE2' ' P' ' 128' ' ' PHE . 31.5 t-80 -78.44 -56.45 4.43 Favored 'General case' 0 C--O 1.279 2.655 0 CA-C-N 120.46 1.482 . . . . 0.0 110.92 167.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.593 ' HD2' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.016 0 O-C-N 118.639 -2.538 . . . . 0.0 110.587 -155.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.599 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 . . . . . 0 C--O 1.257 1.487 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.62 147.56 53.2 Favored 'General case' 0 C--N 1.382 1.98 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -166.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -42.62 -36.0 1.26 Allowed 'General case' 0 C--N 1.381 1.963 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.489 -176.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.04 -67.78 0.23 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 123.995 1.855 . . . . 0.0 109.207 173.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.55 ' O ' HD13 ' P' ' 124' ' ' LEU . 78.6 mt-30 -47.68 -50.56 24.49 Favored 'General case' 0 C--N 1.382 2.014 0 CA-C-N 112.47 -2.15 . . . . 0.0 110.217 176.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.477 ' HA ' HD13 ' P' ' 124' ' ' LEU . 16.1 m -49.44 -58.73 4.61 Favored 'General case' 0 C--N 1.383 2.026 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 169.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.575 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 1.2 t80 -52.97 -47.2 68.33 Favored 'General case' 0 C--N 1.384 2.071 0 CA-C-O 122.435 1.112 . . . . 0.0 109.825 -169.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 1.019 ' CD ' HG23 ' P' ' 146' ' ' ILE . 3.2 mt-10 -66.81 -36.7 82.99 Favored 'General case' 0 C--O 1.265 1.91 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.063 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.947 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.7 mt -60.56 -52.19 66.21 Favored 'General case' 0 C--N 1.382 1.984 0 O-C-N 119.521 -1.987 . . . . 0.0 109.88 169.033 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.571 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.2 mt-10 -53.77 -51.35 63.71 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-O 122.245 1.021 . . . . 0.0 109.213 178.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.575 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.6 -69.68 0.12 Allowed 'General case' 0 C--N 1.379 1.874 0 CA-C-N 111.767 -2.47 . . . . 0.0 108.69 175.045 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.833 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.4 OUTLIER -58.2 -38.09 76.07 Favored 'General case' 0 C--N 1.391 2.398 0 CA-C-N 112.999 -1.91 . . . . 0.0 108.288 -171.768 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.831 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 20.8 t80 -69.71 -45.5 68.1 Favored 'General case' 0 C--N 1.381 1.958 0 O-C-N 121.559 -0.713 . . . . 0.0 110.817 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.571 ' N ' ' O ' ' P' ' 125' ' ' GLU . 13.8 mmm180 -62.33 -15.98 51.41 Favored 'General case' 0 C--N 1.38 1.915 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 -170.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -104.41 -37.9 7.02 Favored 'General case' 0 C--N 1.38 1.908 0 C-N-CA 126.776 2.031 . . . . 0.0 107.503 -168.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.52 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -155.34 107.75 2.69 Favored 'General case' 0 C--N 1.387 2.232 0 CA-C-N 111.914 -2.403 . . . . 0.0 108.84 -153.86 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.86 -21.12 60.22 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 112.218 -2.265 . . . . 0.0 110.873 -167.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.553 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 33.8 m-85 -159.33 112.84 2.28 Favored 'General case' 0 C--N 1.38 1.901 0 CA-C-N 113.305 -1.77 . . . . 0.0 108.14 -153.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.833 HD12 ' HD3' ' P' ' 127' ' ' ARG . 18.6 mt -124.63 135.83 53.42 Favored 'General case' 0 C--N 1.396 2.611 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 -158.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.12 155.05 26.44 Favored 'General case' 0 C--N 1.381 1.973 0 O-C-N 120.612 -1.305 . . . . 0.0 107.498 167.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.535 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.42 -49.62 91.51 Favored Pre-proline 0 CA--C 1.583 2.22 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 -160.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.535 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 79.7 Cg_exo -58.15 -30.03 89.21 Favored 'Trans proline' 0 C--N 1.402 3.342 0 N-CA-C 114.87 1.065 . . . . 0.0 114.87 -175.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.601 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.3 OUTLIER -54.37 -69.46 0.13 Allowed 'General case' 0 C--N 1.38 1.912 0 CA-C-O 124.54 2.114 . . . . 0.0 106.378 161.164 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.919 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.08 -39.5 82.91 Favored 'General case' 0 C--N 1.392 2.428 0 CA-C-N 109.942 -3.299 . . . . 0.0 108.657 -154.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.633 ' O ' ' N ' ' P' ' 144' ' ' SER . 4.0 mt-10 -53.13 -38.03 62.31 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-O 122.498 1.142 . . . . 0.0 108.568 178.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -64.22 -37.03 86.03 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-N 113.142 -1.845 . . . . 0.0 109.347 -174.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.689 HD11 HD12 ' P' ' 146' ' ' ILE . 0.4 OUTLIER -57.86 -47.33 83.02 Favored 'General case' 0 C--N 1.385 2.151 0 CA-C-O 123.125 1.44 . . . . 0.0 108.719 164.804 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.555 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -62.73 -31.71 72.69 Favored 'General case' 0 C--N 1.387 2.208 0 CA-C-N 112.104 -2.316 . . . . 0.0 109.087 -179.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.633 ' N ' ' O ' ' P' ' 140' ' ' GLU . 5.9 t -74.45 -41.95 59.94 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-N 114.243 -1.344 . . . . 0.0 109.037 -178.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 39.5 mt -63.86 -46.62 84.18 Favored 'General case' 0 C--N 1.381 1.962 0 CA-C-O 124.52 2.105 . . . . 0.0 108.269 -167.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 1.019 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -101.41 -12.67 8.55 Favored 'Isoleucine or valine' 0 C--N 1.388 2.25 0 CA-C-N 110.739 -2.937 . . . . 0.0 108.155 -165.437 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 82.08 34.42 0.08 Allowed 'General case' 0 C--N 1.383 2.047 0 CA-C-O 125.547 2.594 . . . . 0.0 108.147 153.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.993 HD13 ' CD1' ' P' ' 146' ' ' ILE . 7.6 mt -96.49 169.47 9.88 Favored 'General case' 0 C--N 1.397 2.637 0 CA-C-N 111.652 -2.522 . . . . 0.0 109.475 169.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.613 ' O ' ' N ' ' P' ' 152' ' ' GLN . 21.5 p -91.31 145.29 31.17 Favored Pre-proline 0 CA--C 1.588 2.435 0 CA-C-O 122.91 1.338 . . . . 0.0 108.735 171.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.07 -37.43 64.1 Favored 'Trans proline' 1 C--N 1.414 4.021 0 C-N-CA 122.682 2.255 . . . . 0.0 113.128 -155.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 151' ' ' THR . . . . . 0.441 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.2 OUTLIER -53.92 -35.62 61.86 Favored 'General case' 0 C--N 1.384 2.066 0 C-N-CA 119.676 -0.81 . . . . 0.0 109.671 165.157 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.613 ' N ' ' O ' ' P' ' 149' ' ' THR . 44.3 mt-30 -70.48 -27.42 64.2 Favored 'General case' 0 C--N 1.389 2.296 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 -177.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.668 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.3 t -64.68 -71.84 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.105 0 CA-C-N 121.487 1.949 . . . . 0.0 109.666 163.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.919 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.8 -59.61 0.4 Allowed 'General case' 0 C--N 1.386 2.188 0 CA-C-O 122.668 1.223 . . . . 0.0 110.656 -178.163 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 10.2 mm -56.25 -41.89 71.85 Favored 'Isoleucine or valine' 0 C--N 1.381 1.948 0 CA-C-N 113.114 -1.857 . . . . 0.0 108.984 -174.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.947 ' HB3' HD21 ' P' ' 124' ' ' LEU . 7.4 t90 -68.24 -32.24 72.3 Favored 'General case' 0 C--N 1.382 1.98 0 O-C-N 120.962 -1.086 . . . . 0.0 109.637 173.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.831 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 59.6 m-85 -74.81 -40.48 61.07 Favored 'General case' 0 C--O 1.276 2.484 0 O-C-N 120.932 -1.105 . . . . 0.0 112.074 174.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' P' ' 154' ' ' LYS . 25.3 mt-30 -48.94 -64.19 0.88 Allowed 'General case' 0 C--N 1.377 1.795 0 O-C-N 119.543 -1.973 . . . . 0.0 106.674 167.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -55.94 -23.34 31.37 Favored 'General case' 0 C--N 1.389 2.285 0 CA-C-O 117.579 -1.2 . . . . 0.0 109.706 -163.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.537 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.7 OUTLIER -76.34 -47.64 22.78 Favored 'General case' 0 C--O 1.281 2.758 0 CA-C-N 121.239 1.836 . . . . 0.0 110.949 177.108 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.553 ' HD2' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.933 0 CA-C-N 122.815 2.552 . . . . 0.0 110.619 -161.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.589 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 1.1 m-85 . . . . . 0 C--O 1.255 1.388 0 N-CA-C 107.832 -1.174 . . . . 0.0 107.832 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.41 148.03 52.42 Favored 'General case' 0 C--N 1.382 1.99 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -168.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -42.15 -36.02 1.08 Allowed 'General case' 0 C--N 1.381 1.966 0 CA-C-N 114.037 -1.438 . . . . 0.0 109.29 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.93 -67.72 0.24 Allowed 'General case' 0 C--N 1.382 1.982 0 CA-C-O 124.217 1.961 . . . . 0.0 109.104 173.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.533 ' O ' HD13 ' P' ' 124' ' ' LEU . 78.7 mt-30 -48.56 -48.05 39.02 Favored 'General case' 0 C--N 1.382 2.008 0 CA-C-N 112.419 -2.173 . . . . 0.0 110.052 177.188 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.551 ' HA ' HD13 ' P' ' 124' ' ' LEU . 19.9 m -52.05 -56.37 14.78 Favored 'General case' 0 C--N 1.383 2.027 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 169.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.667 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.2 t80 -53.16 -46.68 68.99 Favored 'General case' 0 C--N 1.383 2.023 0 CA-C-O 122.325 1.059 . . . . 0.0 110.15 -170.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.813 ' CG ' HG23 ' P' ' 146' ' ' ILE . 0.1 OUTLIER -66.29 -39.17 89.19 Favored 'General case' 0 C--N 1.38 1.894 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.219 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.983 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -60.16 -49.74 76.42 Favored 'General case' 0 C--N 1.385 2.142 0 O-C-N 120.691 -1.255 . . . . 0.0 109.727 172.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.569 ' O ' ' N ' ' P' ' 129' ' ' ARG . 13.3 mt-10 -55.17 -53.3 57.78 Favored 'General case' 0 C--N 1.38 1.909 0 CA-C-O 122.509 1.147 . . . . 0.0 109.461 176.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.667 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.9 -69.23 0.14 Allowed 'General case' 0 C--N 1.378 1.825 0 CA-C-N 111.897 -2.41 . . . . 0.0 108.665 177.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.857 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -57.49 -37.25 72.62 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 112.686 -2.052 . . . . 0.0 108.342 -173.334 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.847 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 24.7 t80 -70.0 -45.98 66.13 Favored 'General case' 0 C--N 1.38 1.927 0 CA-C-O 121.58 0.705 . . . . 0.0 110.752 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.569 ' N ' ' O ' ' P' ' 125' ' ' GLU . 7.6 mmm180 -62.54 -14.45 42.16 Favored 'General case' 0 C--N 1.381 1.941 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -169.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -107.67 -37.84 6.04 Favored 'General case' 0 C--N 1.38 1.91 0 C-N-CA 126.607 1.963 . . . . 0.0 107.687 -167.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.498 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -154.2 105.78 2.73 Favored 'General case' 0 C--N 1.388 2.273 0 CA-C-N 112.018 -2.355 . . . . 0.0 108.83 -153.552 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . 0.752 ' C ' ' HD1' ' P' ' 133' ' ' TYR . 3.2 mtt85 -77.36 -18.31 57.48 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 111.841 -2.436 . . . . 0.0 110.474 -169.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.752 ' HD1' ' C ' ' P' ' 132' ' ' ARG . 4.1 m-30 -154.66 111.25 3.28 Favored 'General case' 0 C--N 1.38 1.921 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.3 -154.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.651 HD21 ' HG3' ' P' ' 138' ' ' GLU . 31.5 mt -126.13 136.66 53.15 Favored 'General case' 0 C--N 1.397 2.65 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -161.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.54 155.31 25.8 Favored 'General case' 0 C--N 1.382 1.989 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 166.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.53 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.59 -49.43 92.09 Favored Pre-proline 0 CA--C 1.583 2.228 0 C-N-CA 120.049 -0.661 . . . . 0.0 109.347 -161.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.53 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 82.9 Cg_exo -58.15 -28.64 84.62 Favored 'Trans proline' 0 C--N 1.401 3.31 0 C-N-CA 121.001 1.134 . . . . 0.0 114.969 -175.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.651 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -53.85 -71.06 0.08 Allowed 'General case' 0 C--N 1.38 1.933 0 CA-C-O 124.524 2.107 . . . . 0.0 106.44 160.201 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.899 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.33 -39.66 81.87 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 109.969 -3.287 . . . . 0.0 108.79 -154.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.62 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 4.5 mt-10 -53.28 -39.3 63.82 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-O 123.177 1.465 . . . . 0.0 108.42 177.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -63.67 -35.29 80.04 Favored 'General case' 0 C--N 1.379 1.885 0 CA-C-N 112.846 -1.979 . . . . 0.0 108.633 -171.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.857 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.4 tp -65.95 -42.7 89.65 Favored 'General case' 0 C--N 1.383 2.056 0 CA-C-O 123.333 1.54 . . . . 0.0 109.186 169.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.62 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.76 -34.33 67.47 Favored 'General case' 0 C--N 1.39 2.334 0 CA-C-N 112.287 -2.233 . . . . 0.0 108.378 174.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.561 ' N ' ' O ' ' P' ' 140' ' ' GLU . 2.6 t -73.35 -43.6 60.4 Favored 'General case' 0 C--N 1.387 2.237 0 CA-C-N 114.242 -1.344 . . . . 0.0 110.296 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.99 -47.72 73.59 Favored 'General case' 0 C--N 1.378 1.847 0 CA-C-O 124.895 2.283 . . . . 0.0 107.922 -163.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.968 HD13 ' CD1' ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.66 -16.83 7.17 Favored 'Isoleucine or valine' 0 C--N 1.385 2.125 0 CA-C-N 110.482 -3.054 . . . . 0.0 107.761 -171.767 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 6.4 mmt180 81.31 37.36 0.08 Allowed 'General case' 0 C--N 1.384 2.095 0 CA-C-N 111.566 -2.561 . . . . 0.0 108.111 152.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.968 ' CD1' HD13 ' P' ' 146' ' ' ILE . 6.4 mt -95.27 167.99 11.01 Favored 'General case' 0 C--N 1.391 2.391 0 CA-C-N 112.179 -2.282 . . . . 0.0 109.46 168.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.647 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -88.51 144.07 33.15 Favored Pre-proline 0 CA--C 1.588 2.404 0 CA-C-O 122.95 1.357 . . . . 0.0 108.299 173.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.42 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 1.8 Cg_endo -60.28 -38.38 75.93 Favored 'Trans proline' 1 C--N 1.414 4.02 0 C-N-CA 122.736 2.291 . . . . 0.0 112.416 -155.436 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' P' P ' 151' ' ' THR . . . . . 0.542 HG23 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -57.05 -29.37 63.35 Favored 'General case' 0 C--N 1.384 2.103 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.203 167.255 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.647 ' N ' ' O ' ' P' ' 149' ' ' THR . 43.9 mt-30 -74.08 -28.36 61.35 Favored 'General case' 0 C--N 1.388 2.28 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.662 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.1 t -64.29 -71.44 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.077 0 CA-C-N 122.074 2.215 . . . . 0.0 109.399 164.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.899 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.36 -59.35 0.45 Allowed 'General case' 0 C--N 1.386 2.154 0 CA-C-O 122.969 1.366 . . . . 0.0 110.853 -177.518 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . 0.542 HG12 HG23 ' P' ' 151' ' ' THR . 0.5 OUTLIER -52.43 -47.19 47.49 Favored 'Isoleucine or valine' 0 C--N 1.389 2.309 0 CA-C-N 112.653 -2.067 . . . . 0.0 108.7 -176.121 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.983 ' HB3' HD21 ' P' ' 124' ' ' LEU . 6.2 t90 -66.58 -32.13 73.28 Favored 'General case' 0 C--N 1.382 2.013 0 O-C-N 121.432 -0.792 . . . . 0.0 109.144 177.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.847 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 63.7 m-85 -75.57 -40.04 57.26 Favored 'General case' 0 C--O 1.275 2.419 0 O-C-N 120.962 -1.086 . . . . 0.0 112.275 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -46.91 -66.62 0.38 Allowed 'General case' 0 C--N 1.376 1.737 0 O-C-N 119.44 -2.038 . . . . 0.0 107.171 165.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -56.01 -23.81 35.26 Favored 'General case' 0 C--N 1.391 2.403 0 CA-C-N 113.994 -1.457 . . . . 0.0 109.324 -161.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.539 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.8 OUTLIER -78.87 -40.11 33.38 Favored 'General case' 0 C--O 1.288 3.116 0 CA-C-N 121.249 1.84 . . . . 0.0 111.78 174.377 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.705 ' HD2' ' HE1' ' P' ' 133' ' ' TYR 0.278 40.0 mtm180 . . . . . 0 C--O 1.271 2.213 0 CA-C-N 123.588 2.904 . . . . 0.0 110.531 -176.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.574 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.5 OUTLIER . . . . . 0 C--O 1.253 1.24 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.16 149.07 51.0 Favored 'General case' 0 C--N 1.383 2.06 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 -175.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -44.85 -36.35 3.23 Favored 'General case' 0 C--N 1.382 1.981 0 CA-C-N 113.165 -1.834 . . . . 0.0 109.219 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.0 -63.78 1.03 Allowed 'General case' 0 C--N 1.382 2.008 0 CA-C-O 124.266 1.984 . . . . 0.0 109.22 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.574 ' O ' HD13 ' P' ' 124' ' ' LEU . 80.0 mt-30 -52.33 -43.17 64.42 Favored 'General case' 0 C--N 1.382 1.989 0 CA-C-N 112.407 -2.179 . . . . 0.0 109.734 177.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.524 ' HA ' HD13 ' P' ' 124' ' ' LEU . 16.9 m -54.39 -55.49 28.09 Favored 'General case' 0 C--N 1.381 1.965 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 169.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.68 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.6 OUTLIER -53.04 -47.57 68.28 Favored 'General case' 0 C--N 1.383 2.045 0 CA-C-O 122.622 1.201 . . . . 0.0 110.003 -169.805 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.862 ' HB2' HD12 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -66.52 -38.38 87.08 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 113.864 -1.516 . . . . 0.0 108.004 179.936 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.954 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.1 mt -61.05 -50.56 72.82 Favored 'General case' 0 C--N 1.385 2.12 0 O-C-N 120.169 -1.582 . . . . 0.0 109.544 171.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.591 ' O ' ' N ' ' P' ' 129' ' ' ARG . 13.4 mt-10 -55.14 -44.65 75.29 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 122.756 1.265 . . . . 0.0 109.4 178.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.68 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -49.23 -66.77 0.34 Allowed 'General case' 0 C--N 1.377 1.795 0 CA-C-N 112.08 -2.327 . . . . 0.0 108.405 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.659 ' HB3' HD12 ' P' ' 134' ' ' LEU . 4.0 mmt85 -58.47 -36.01 73.07 Favored 'General case' 0 C--N 1.381 1.97 0 CA-C-N 113.29 -1.777 . . . . 0.0 109.61 -177.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.826 ' HD2' ' HD1' ' P' ' 157' ' ' PHE . 11.5 t80 -67.44 -51.81 47.12 Favored 'General case' 0 C--N 1.385 2.141 0 CA-C-N 119.627 1.103 . . . . 0.0 110.266 174.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.591 ' N ' ' O ' ' P' ' 125' ' ' GLU . 0.2 OUTLIER -62.79 -14.82 49.71 Favored 'General case' 0 C--N 1.379 1.889 0 CA-C-N 112.815 -1.993 . . . . 0.0 108.203 -164.466 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -104.61 -40.09 6.14 Favored 'General case' 0 C--N 1.378 1.846 0 C-N-CA 126.327 1.851 . . . . 0.0 106.966 -171.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.504 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.5 OUTLIER -155.74 98.73 1.95 Allowed 'General case' 0 C--N 1.385 2.145 0 CA-C-N 111.952 -2.385 . . . . 0.0 110.003 -153.2 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . 0.506 ' HG2' ' CD2' ' P' ' 133' ' ' TYR . 0.1 OUTLIER -76.53 -6.72 53.06 Favored 'General case' 0 C--N 1.394 2.523 0 CA-C-N 112.133 -2.303 . . . . 0.0 110.985 -162.164 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.538 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 6.0 m-85 -162.68 108.51 1.19 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.0 -156.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.659 HD12 ' HB3' ' P' ' 127' ' ' ARG . 15.0 mt -122.44 135.65 54.72 Favored 'General case' 0 C--N 1.4 2.764 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -154.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.23 154.52 25.37 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 169.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.551 ' HB2' ' HD3' ' P' ' 137' ' ' PRO . . . -58.92 -49.23 94.5 Favored Pre-proline 0 CA--C 1.583 2.249 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.438 -161.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.551 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 81.9 Cg_exo -58.7 -29.61 90.0 Favored 'Trans proline' 0 C--N 1.401 3.341 0 N-CA-C 115.016 1.122 . . . . 0.0 115.016 -173.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.588 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -54.89 -70.48 0.1 Allowed 'General case' 0 C--N 1.382 2.006 0 CA-C-O 124.754 2.216 . . . . 0.0 106.31 161.905 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 1.015 ' NH2' ' HG3' ' P' ' 154' ' ' LYS . 2.0 ptt85 -66.85 -40.63 87.98 Favored 'General case' 0 C--N 1.393 2.476 0 CA-C-N 109.97 -3.287 . . . . 0.0 108.684 -155.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.627 ' O ' ' N ' ' P' ' 144' ' ' SER . 3.5 mt-10 -53.57 -41.01 66.09 Favored 'General case' 0 C--N 1.38 1.931 0 O-C-N 120.68 -1.262 . . . . 0.0 108.486 176.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . 0.419 ' HA ' ' HB2' ' P' ' 144' ' ' SER . 5.6 t-160 -63.71 -37.89 89.05 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 112.933 -1.939 . . . . 0.0 109.15 -172.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.862 HD12 ' HB2' ' P' ' 123' ' ' GLU . 0.8 OUTLIER -58.1 -45.78 86.65 Favored 'General case' 0 C--N 1.386 2.172 0 CA-C-O 123.136 1.446 . . . . 0.0 109.056 167.278 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -62.87 -33.18 74.74 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 112.175 -2.284 . . . . 0.0 109.093 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.627 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.6 OUTLIER -73.66 -39.76 64.2 Favored 'General case' 0 C--N 1.384 2.101 0 CA-C-N 114.071 -1.422 . . . . 0.0 109.471 -177.52 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 40.1 mt -66.87 -47.41 71.97 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-O 124.57 2.128 . . . . 0.0 108.491 -166.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.994 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -98.41 -12.74 8.29 Favored 'Isoleucine or valine' 0 C--N 1.389 2.312 0 CA-C-N 110.87 -2.877 . . . . 0.0 107.954 -166.932 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 82.34 35.43 0.07 Allowed 'General case' 0 C--N 1.381 1.959 0 CA-C-O 125.774 2.702 . . . . 0.0 107.788 153.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.994 HD13 ' CD1' ' P' ' 146' ' ' ILE . 7.7 mt -96.17 170.28 9.37 Favored 'General case' 0 C--N 1.397 2.642 0 CA-C-N 111.54 -2.573 . . . . 0.0 109.42 168.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.618 ' O ' ' N ' ' P' ' 152' ' ' GLN . 19.2 p -92.93 144.65 28.79 Favored Pre-proline 0 CA--C 1.59 2.484 0 CA-C-O 123.168 1.461 . . . . 0.0 108.977 171.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.473 ' HB2' ' NH1' ' P' ' 139' ' ' ARG . 1.2 Cg_endo -58.76 -38.98 86.13 Favored 'Trans proline' 1 C--N 1.416 4.096 0 C-N-CA 122.616 2.211 . . . . 0.0 113.064 -156.093 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -34.89 62.75 Favored 'General case' 0 C--N 1.383 2.048 0 C-N-CA 119.945 -0.702 . . . . 0.0 109.755 167.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.618 ' N ' ' O ' ' P' ' 149' ' ' THR . 46.1 mt-30 -69.89 -27.92 65.2 Favored 'General case' 0 C--N 1.389 2.295 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 -176.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.64 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.4 t -64.39 -72.37 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.122 0 CA-C-N 121.273 1.852 . . . . 0.0 109.629 164.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 1.015 ' HG3' ' NH2' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.26 -55.3 0.51 Allowed 'General case' 0 C--N 1.383 2.065 0 C-N-CA 124.975 1.31 . . . . 0.0 110.536 -176.402 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 11.3 mm -61.49 -40.57 86.87 Favored 'Isoleucine or valine' 0 C--N 1.383 2.041 0 CA-C-N 113.999 -1.455 . . . . 0.0 109.481 -173.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.954 ' HB3' HD21 ' P' ' 124' ' ' LEU . 5.3 t90 -67.37 -31.53 71.83 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 121.168 -0.957 . . . . 0.0 109.195 172.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.826 ' HD1' ' HD2' ' P' ' 128' ' ' PHE . 30.1 m-85 -75.42 -42.85 52.59 Favored 'General case' 0 C--O 1.274 2.383 0 O-C-N 121.132 -0.98 . . . . 0.0 111.871 175.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -49.27 -60.37 2.87 Favored 'General case' 0 C--N 1.378 1.807 0 O-C-N 119.51 -1.994 . . . . 0.0 107.117 169.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -56.01 -24.99 42.44 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-O 117.677 -1.154 . . . . 0.0 109.494 -166.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.551 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.5 OUTLIER -77.15 -45.45 26.74 Favored 'General case' 0 C--O 1.284 2.88 0 CA-C-N 121.374 1.897 . . . . 0.0 111.479 178.344 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.538 ' HD2' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 1.988 0 CA-C-N 122.586 2.448 . . . . 0.0 109.513 -164.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.644 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.251 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.84 148.58 50.99 Favored 'General case' 0 C--N 1.384 2.105 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 -174.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 22.9 ttmt -44.9 -36.72 3.47 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-N 113.134 -1.848 . . . . 0.0 109.17 -177.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.35 -62.06 1.89 Allowed 'General case' 0 C--N 1.383 2.046 0 CA-C-O 124.242 1.973 . . . . 0.0 109.242 174.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.601 ' O ' HD13 ' P' ' 124' ' ' LEU . 82.0 mt-30 -54.48 -45.55 73.24 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 112.538 -2.119 . . . . 0.0 109.872 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.488 ' HA ' HD13 ' P' ' 124' ' ' LEU . 10.7 m -49.74 -56.68 9.35 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 168.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.76 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.4 OUTLIER -52.94 -48.27 67.47 Favored 'General case' 0 C--N 1.382 2.01 0 CA-C-O 122.609 1.195 . . . . 0.0 110.052 -168.985 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.875 ' CG ' HG23 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.75 -37.1 83.96 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.113 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.893 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.9 mt -60.52 -51.86 67.66 Favored 'General case' 0 C--N 1.384 2.086 0 O-C-N 120.281 -1.512 . . . . 0.0 109.493 170.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.571 ' O ' ' N ' ' P' ' 129' ' ' ARG . 10.2 mt-10 -55.35 -48.97 73.44 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-O 122.686 1.231 . . . . 0.0 109.598 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.76 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.92 -67.52 0.25 Allowed 'General case' 0 C--N 1.378 1.814 0 CA-C-N 112.191 -2.277 . . . . 0.0 109.14 174.954 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.824 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.5 OUTLIER -60.33 -37.87 81.98 Favored 'General case' 0 C--N 1.39 2.37 0 CA-C-N 112.388 -2.187 . . . . 0.0 108.191 -171.345 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.808 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 15.7 t80 -69.94 -47.59 61.74 Favored 'General case' 0 C--N 1.381 1.976 0 O-C-N 121.409 -0.807 . . . . 0.0 110.183 177.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.571 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.6 mmm180 -62.35 -20.04 63.98 Favored 'General case' 0 C--N 1.38 1.927 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -168.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -91.58 -42.55 10.16 Favored 'General case' 0 C--N 1.379 1.85 0 CA-C-O 124.126 1.917 . . . . 0.0 106.935 -174.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.484 ' HG2' ' CD2' ' P' ' 134' ' ' LEU . 2.6 tp-100 -152.81 123.87 7.5 Favored 'General case' 0 C--N 1.386 2.169 0 CA-C-N 111.422 -2.626 . . . . 0.0 110.313 -155.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . 0.53 ' HG2' ' CG ' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -79.29 -23.83 43.31 Favored 'General case' 0 C--N 1.386 2.166 0 CA-C-N 112.784 -2.007 . . . . 0.0 110.8 -173.172 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.691 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 1.0 OUTLIER -155.22 112.21 3.28 Favored 'General case' 0 C--N 1.377 1.798 0 CA-C-O 123.472 1.606 . . . . 0.0 108.986 -152.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.824 HD12 ' HD3' ' P' ' 127' ' ' ARG . 27.3 mt -123.22 134.79 54.1 Favored 'General case' 0 C--N 1.405 3.011 0 CA-C-N 112.598 -2.092 . . . . 0.0 108.042 -160.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.08 155.24 26.39 Favored 'General case' 0 C--N 1.382 1.988 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 167.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.558 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.46 -49.42 92.44 Favored Pre-proline 0 CA--C 1.583 2.244 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.233 -160.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.558 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 76.7 Cg_exo -58.63 -29.23 88.6 Favored 'Trans proline' 0 C--N 1.401 3.332 0 C-N-CA 121.057 1.171 . . . . 0.0 115.041 -175.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.655 ' HG3' HD21 ' P' ' 134' ' ' LEU . 2.4 mm-40 -54.02 -70.43 0.1 Allowed 'General case' 0 C--N 1.38 1.896 0 CA-C-O 124.624 2.154 . . . . 0.0 106.456 160.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.873 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.18 -39.15 82.6 Favored 'General case' 0 C--N 1.39 2.368 0 CA-C-N 109.907 -3.315 . . . . 0.0 108.75 -154.592 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.62 ' O ' ' N ' ' P' ' 144' ' ' SER . 5.1 mt-10 -53.36 -39.02 63.83 Favored 'General case' 0 C--N 1.38 1.91 0 CA-C-O 122.61 1.195 . . . . 0.0 108.505 177.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -63.54 -37.13 86.13 Favored 'General case' 0 C--N 1.379 1.879 0 CA-C-N 113.016 -1.902 . . . . 0.0 109.322 -173.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.785 HD12 ' HB2' ' P' ' 123' ' ' GLU . 0.7 OUTLIER -58.7 -46.12 87.98 Favored 'General case' 0 C--N 1.387 2.201 0 CA-C-O 122.974 1.368 . . . . 0.0 108.87 166.287 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.557 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -63.38 -31.71 72.93 Favored 'General case' 0 C--N 1.385 2.139 0 CA-C-N 112.339 -2.21 . . . . 0.0 109.217 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.62 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.9 OUTLIER -74.25 -41.56 61.08 Favored 'General case' 0 C--N 1.384 2.08 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.666 179.552 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . 0.567 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 43.5 mt -65.13 -48.44 73.57 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-O 124.906 2.289 . . . . 0.0 108.039 -165.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.979 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.51 -16.94 7.02 Favored 'Isoleucine or valine' 0 C--N 1.386 2.153 0 CA-C-N 110.316 -3.129 . . . . 0.0 107.739 -170.828 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . 0.612 ' HG3' ' O ' ' P' ' 144' ' ' SER . 0.1 OUTLIER 81.21 37.71 0.08 Allowed 'General case' 0 C--N 1.386 2.188 0 CA-C-N 111.375 -2.648 . . . . 0.0 108.055 153.008 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.979 HD13 ' CD1' ' P' ' 146' ' ' ILE . 5.7 mt -95.03 168.5 10.74 Favored 'General case' 0 C--N 1.39 2.354 0 CA-C-N 112.224 -2.262 . . . . 0.0 109.294 168.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.65 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.9 p -88.6 143.03 31.44 Favored Pre-proline 0 CA--C 1.588 2.415 0 CA-C-O 122.854 1.311 . . . . 0.0 108.01 173.128 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -60.19 -37.41 83.47 Favored 'Trans proline' 0 C--N 1.413 3.953 0 C-N-CA 122.652 2.235 . . . . 0.0 112.054 -155.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' P' P ' 151' ' ' THR . . . . . 0.431 HG23 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -58.35 -29.06 65.67 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.67 167.507 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.65 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.9 mt-30 -73.52 -28.33 61.83 Favored 'General case' 0 C--N 1.39 2.333 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.678 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.2 t -64.48 -71.14 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.077 0 CA-C-N 121.901 2.137 . . . . 0.0 109.597 165.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.873 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.95 -57.98 0.45 Allowed 'General case' 0 C--N 1.385 2.139 0 C-N-CA 124.762 1.225 . . . . 0.0 110.531 -176.916 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . 0.589 HD11 ' OE1' ' P' ' 158' ' ' GLN . 0.2 OUTLIER -58.59 -42.39 84.63 Favored 'Isoleucine or valine' 0 C--N 1.383 2.057 0 CA-C-N 113.389 -1.732 . . . . 0.0 108.994 -172.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.893 ' HB3' HD21 ' P' ' 124' ' ' LEU . 5.4 t90 -66.68 -32.23 73.42 Favored 'General case' 0 C--N 1.385 2.11 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.808 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 49.0 m-85 -74.35 -40.56 62.06 Favored 'General case' 0 C--O 1.272 2.261 0 O-C-N 121.072 -1.018 . . . . 0.0 111.998 173.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.589 ' OE1' HD11 ' P' ' 155' ' ' ILE . 73.2 mt-30 -50.97 -59.32 4.27 Favored 'General case' 0 C--N 1.378 1.813 0 O-C-N 119.664 -1.898 . . . . 0.0 106.77 169.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -56.04 -25.01 43.02 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.923 -166.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.557 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.4 OUTLIER -77.39 -47.58 19.47 Favored 'General case' 0 C--O 1.281 2.736 0 CA-C-N 121.714 2.052 . . . . 0.0 111.327 175.354 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.691 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.957 0 CA-C-N 122.985 2.63 . . . . 0.0 110.762 -160.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.593 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.258 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.45 149.48 50.17 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -175.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -44.94 -36.06 3.18 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.538 -1.665 . . . . 0.0 109.252 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -52.88 -62.73 1.46 Allowed 'General case' 0 C--N 1.383 2.033 0 CA-C-O 124.305 2.003 . . . . 0.0 109.128 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.581 ' O ' HD13 ' P' ' 124' ' ' LEU . 80.4 mt-30 -54.85 -43.99 73.57 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-N 112.42 -2.173 . . . . 0.0 109.709 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.458 ' HA ' HD13 ' P' ' 124' ' ' LEU . 9.8 m -51.18 -57.68 8.12 Favored 'General case' 0 C--N 1.385 2.129 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 166.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.714 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.7 OUTLIER -53.04 -48.15 67.86 Favored 'General case' 0 C--N 1.382 2.021 0 CA-C-O 122.487 1.136 . . . . 0.0 110.051 -168.5 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.9 ' CG ' HG23 ' P' ' 146' ' ' ILE . 0.5 OUTLIER -66.33 -37.85 86.31 Favored 'General case' 0 C--N 1.378 1.834 0 CA-C-N 114.562 -1.199 . . . . 0.0 107.878 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.941 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.6 mt -60.46 -50.82 72.07 Favored 'General case' 0 C--N 1.384 2.084 0 O-C-N 120.536 -1.352 . . . . 0.0 109.615 171.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.557 ' O ' ' N ' ' P' ' 129' ' ' ARG . 20.0 mt-10 -54.39 -52.76 60.66 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-O 122.384 1.088 . . . . 0.0 109.21 177.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.714 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.98 -67.78 0.22 Allowed 'General case' 0 C--N 1.378 1.818 0 CA-C-N 111.872 -2.422 . . . . 0.0 108.754 177.378 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.672 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.3 OUTLIER -59.21 -36.81 76.05 Favored 'General case' 0 C--N 1.397 2.634 0 CA-C-N 112.032 -2.349 . . . . 0.0 108.373 -172.478 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.873 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 12.6 t80 -69.21 -48.85 60.91 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-N 119.1 0.864 . . . . 0.0 109.679 178.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.557 ' N ' ' O ' ' P' ' 125' ' ' GLU . 27.3 mtm180 -62.96 -15.96 57.71 Favored 'General case' 0 C--N 1.38 1.931 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -166.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -101.66 -39.86 7.26 Favored 'General case' 0 C--N 1.379 1.862 0 C-N-CA 126.669 1.988 . . . . 0.0 107.374 -170.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.499 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.1 OUTLIER -153.2 104.49 2.8 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 111.723 -2.489 . . . . 0.0 108.64 -153.963 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . 0.486 ' HB3' ' CD2' ' P' ' 133' ' ' TYR . 3.2 mtt85 -74.48 -15.79 60.87 Favored 'General case' 0 C--N 1.391 2.41 0 CA-C-N 112.197 -2.274 . . . . 0.0 110.721 -166.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.486 ' CD2' ' HB3' ' P' ' 132' ' ' ARG . 66.8 m-85 -160.16 112.14 2.0 Favored 'General case' 0 C--N 1.378 1.835 0 CA-C-N 113.842 -1.526 . . . . 0.0 108.289 -153.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.672 HD12 ' HD3' ' P' ' 127' ' ' ARG . 19.1 mt -129.45 133.33 47.25 Favored 'General case' 0 C--N 1.396 2.595 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.028 -155.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . 0.338 1.3 t -92.6 166.57 12.43 Favored 'General case' 0 C--N 1.394 2.533 0 CA-C-N 122.103 2.229 . . . . 0.0 107.372 174.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.535 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.75 -46.47 98.45 Favored Pre-proline 0 CA--C 1.582 2.188 0 CA-C-N 113.573 -1.648 . . . . 0.0 108.684 -155.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.535 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 0.1 OUTLIER -53.64 -46.49 33.34 Favored 'Trans proline' 0 C--N 1.395 2.982 0 N-CA-C 116.73 1.781 . . . . 0.0 116.73 177.413 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.557 ' HB3' HD21 ' P' ' 134' ' ' LEU . 1.6 mm-40 -51.86 -65.68 0.52 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 123.726 1.727 . . . . 0.0 106.813 170.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.95 ' NH2' ' HG3' ' P' ' 154' ' ' LYS . 1.7 ptt180 -69.62 -32.18 70.74 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 109.942 -3.299 . . . . 0.0 108.718 -160.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.589 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 2.4 mt-10 -52.81 -47.02 67.93 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 122.987 1.375 . . . . 0.0 108.131 170.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -64.78 -37.85 89.01 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-N 112.416 -2.175 . . . . 0.0 109.608 -166.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.579 HD11 HD12 ' P' ' 146' ' ' ILE . 1.3 tm? -59.29 -44.5 92.51 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-O 123.169 1.461 . . . . 0.0 108.913 169.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.589 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -63.89 -34.27 77.58 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-N 112.037 -2.347 . . . . 0.0 109.095 177.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.581 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -72.5 -37.69 68.33 Favored 'General case' 0 C--N 1.388 2.243 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.451 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 45.7 mt -67.25 -52.48 40.35 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 124.777 2.227 . . . . 0.0 108.337 -167.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.987 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -91.61 -16.6 7.94 Favored 'Isoleucine or valine' 0 C--N 1.386 2.194 0 CA-C-N 110.498 -3.046 . . . . 0.0 107.959 -172.831 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . 0.527 ' HD3' ' O ' ' P' ' 144' ' ' SER . 3.2 mmt-85 81.3 38.54 0.07 Allowed 'General case' 0 C--N 1.385 2.144 0 CA-C-N 111.464 -2.607 . . . . 0.0 107.822 153.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.987 HD13 ' CD1' ' P' ' 146' ' ' ILE . 5.8 mt -94.19 171.79 8.62 Favored 'General case' 0 C--N 1.39 2.335 0 CA-C-N 112.023 -2.353 . . . . 0.0 109.055 166.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.64 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.4 p -89.99 139.86 27.49 Favored Pre-proline 0 CA--C 1.588 2.432 0 CA-C-O 123.148 1.451 . . . . 0.0 108.061 171.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.489 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 0.6 OUTLIER -46.34 -48.6 13.05 Favored 'Trans proline' 0 C--N 1.406 3.566 0 C-N-CA 124.935 3.757 . . . . 0.0 115.286 -165.436 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.41 -29.61 35.88 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 118.347 -0.835 . . . . 0.0 110.06 169.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.64 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -74.85 -27.67 60.36 Favored 'General case' 0 C--N 1.39 2.347 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.868 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.5 t -64.69 -72.86 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.382 2.007 0 CA-C-N 122.069 2.213 . . . . 0.0 109.883 162.322 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.95 ' HG3' ' NH2' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.47 -54.93 0.54 Allowed 'General case' 0 C--N 1.386 2.154 0 C-N-CA 124.896 1.278 . . . . 0.0 110.409 -175.504 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 16.5 mm -60.98 -41.7 90.12 Favored 'Isoleucine or valine' 0 C--N 1.387 2.199 0 CA-C-N 114.072 -1.422 . . . . 0.0 109.498 -174.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.941 ' HB3' HD21 ' P' ' 124' ' ' LEU . 7.7 t90 -66.81 -32.08 73.12 Favored 'General case' 0 C--N 1.382 2.0 0 O-C-N 121.228 -0.92 . . . . 0.0 109.076 172.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.873 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 52.2 m-85 -74.9 -42.2 58.24 Favored 'General case' 0 C--O 1.276 2.463 0 O-C-N 121.376 -0.827 . . . . 0.0 111.815 176.073 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.428 ' N ' ' O ' ' P' ' 154' ' ' LYS . 60.5 mt-30 -50.57 -60.25 3.22 Favored 'General case' 0 C--N 1.377 1.778 0 O-C-N 119.571 -1.956 . . . . 0.0 107.28 169.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -56.25 -23.42 36.0 Favored 'General case' 0 C--N 1.391 2.374 0 CA-C-O 117.358 -1.306 . . . . 0.0 109.629 -166.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.556 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 2.2 t60 -75.28 -50.64 15.43 Favored 'General case' 0 C--O 1.281 2.744 0 CA-C-N 121.307 1.867 . . . . 0.0 110.128 175.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.47 ' NH1' ' CD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.018 0 CA-C-N 122.538 2.427 . . . . 0.0 110.732 -158.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.594 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.6 m-85 . . . . . 0 C--O 1.257 1.459 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.19 147.82 52.75 Favored 'General case' 0 C--N 1.381 1.976 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -168.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -42.82 -36.22 1.41 Allowed 'General case' 0 C--N 1.381 1.963 0 CA-C-N 113.716 -1.584 . . . . 0.0 109.381 -177.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.77 -67.39 0.26 Allowed 'General case' 0 C--N 1.383 2.025 0 CA-C-O 123.981 1.848 . . . . 0.0 109.088 173.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.58 ' O ' HD13 ' P' ' 124' ' ' LEU . 79.1 mt-30 -48.32 -48.8 35.84 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 112.435 -2.166 . . . . 0.0 110.038 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.525 ' HA ' HD13 ' P' ' 124' ' ' LEU . 9.1 m -50.39 -58.38 5.84 Favored 'General case' 0 C--N 1.384 2.071 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.538 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 0.6 OUTLIER -52.94 -46.99 68.39 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.985 -170.246 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.858 ' CG ' HG23 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -67.06 -35.94 80.94 Favored 'General case' 0 C--O 1.265 1.898 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.137 177.416 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.89 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.7 mt -59.98 -53.97 51.51 Favored 'General case' 0 C--N 1.381 1.956 0 O-C-N 119.593 -1.942 . . . . 0.0 109.619 168.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.576 ' O ' ' N ' ' P' ' 129' ' ' ARG . 11.6 mt-10 -55.36 -42.37 73.81 Favored 'General case' 0 C--N 1.381 1.962 0 CA-C-O 122.564 1.173 . . . . 0.0 109.679 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.538 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -47.41 -71.6 0.07 Allowed 'General case' 0 C--N 1.38 1.912 0 CA-C-N 111.235 -2.712 . . . . 0.0 108.132 177.085 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.812 ' HD2' HD23 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -60.82 -33.3 72.81 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 113.933 -1.485 . . . . 0.0 108.405 -172.397 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.859 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 30.6 t80 -69.89 -48.9 56.9 Favored 'General case' 0 C--N 1.38 1.929 0 CA-C-N 119.623 1.102 . . . . 0.0 109.998 176.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.576 ' N ' ' O ' ' P' ' 125' ' ' GLU . 71.3 mtt180 -62.19 -19.08 62.75 Favored 'General case' 0 C--N 1.38 1.93 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -167.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -99.92 -40.02 7.88 Favored 'General case' 0 C--N 1.379 1.85 0 C-N-CA 126.279 1.832 . . . . 0.0 107.097 -169.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.498 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.8 OUTLIER -154.58 102.86 2.43 Favored 'General case' 0 C--N 1.384 2.102 0 CA-C-N 111.953 -2.385 . . . . 0.0 109.329 -152.61 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -13.89 60.76 Favored 'General case' 0 C--N 1.394 2.533 0 CA-C-N 112.244 -2.253 . . . . 0.0 111.212 -161.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.464 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 12.8 m-85 -159.23 111.09 2.12 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-N 113.36 -1.745 . . . . 0.0 108.089 -154.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.812 HD23 ' HD2' ' P' ' 127' ' ' ARG . 29.2 mt -123.4 132.36 53.93 Favored 'General case' 0 C--N 1.398 2.703 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -155.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.0 155.46 23.94 Favored 'General case' 0 C--N 1.38 1.934 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 171.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.557 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.17 -49.32 93.6 Favored Pre-proline 0 CA--C 1.584 2.276 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -160.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.557 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 75.5 Cg_exo -59.84 -28.8 88.02 Favored 'Trans proline' 0 C--N 1.401 3.312 0 N-CA-C 115.402 1.27 . . . . 0.0 115.402 -176.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.452 ' HB3' HD21 ' P' ' 134' ' ' LEU . 2.9 mm-40 -53.33 -72.4 0.06 Allowed 'General case' 0 C--N 1.379 1.872 0 CA-C-O 124.822 2.249 . . . . 0.0 106.795 158.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.896 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -66.45 -39.44 88.88 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 110.267 -3.152 . . . . 0.0 108.407 -154.318 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.635 ' O ' ' N ' ' P' ' 144' ' ' SER . 1.7 mt-10 -53.81 -43.2 69.15 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.576 1.179 . . . . 0.0 108.319 177.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -63.55 -36.81 85.03 Favored 'General case' 0 C--N 1.381 1.936 0 CA-C-N 112.693 -2.048 . . . . 0.0 109.277 -174.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.679 HD12 ' HB2' ' P' ' 123' ' ' GLU . 0.8 OUTLIER -60.02 -45.65 92.07 Favored 'General case' 0 C--N 1.386 2.172 0 CA-C-O 122.79 1.281 . . . . 0.0 108.857 165.675 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.556 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -63.75 -30.53 71.62 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 112.606 -2.088 . . . . 0.0 109.368 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.635 ' N ' ' O ' ' P' ' 140' ' ' GLU . 8.0 t -74.81 -43.46 54.56 Favored 'General case' 0 C--N 1.383 2.04 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.327 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . 0.549 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 39.4 mt -62.51 -44.06 97.28 Favored 'General case' 0 C--N 1.38 1.914 0 CA-C-O 124.727 2.203 . . . . 0.0 107.794 -164.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.983 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -102.87 -17.24 7.13 Favored 'Isoleucine or valine' 0 C--N 1.385 2.135 0 CA-C-N 110.283 -3.144 . . . . 0.0 107.792 -168.766 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . 0.549 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.0 OUTLIER 81.22 37.55 0.08 Allowed 'General case' 0 C--N 1.388 2.249 0 CA-C-N 111.249 -2.705 . . . . 0.0 108.292 153.496 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.983 HD13 ' CD1' ' P' ' 146' ' ' ILE . 5.7 mt -95.25 168.04 10.98 Favored 'General case' 0 C--N 1.39 2.332 0 CA-C-N 112.353 -2.203 . . . . 0.0 109.416 167.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.638 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -88.77 143.38 31.64 Favored Pre-proline 0 CA--C 1.587 2.378 0 CA-C-O 122.948 1.356 . . . . 0.0 108.25 173.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -60.74 -37.32 79.56 Favored 'Trans proline' 1 C--N 1.415 4.062 0 C-N-CA 122.621 2.214 . . . . 0.0 112.885 -155.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 151' ' ' THR . . . . . 0.401 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.2 OUTLIER -54.79 -34.9 63.26 Favored 'General case' 0 C--N 1.384 2.092 0 C-N-CA 119.593 -0.843 . . . . 0.0 109.774 165.727 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.638 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.7 mt-30 -70.91 -27.67 63.96 Favored 'General case' 0 C--N 1.388 2.272 0 N-CA-C 105.639 -1.986 . . . . 0.0 105.639 -177.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.752 HG12 ' HB2' ' P' ' 139' ' ' ARG . 1.3 t -64.55 -71.99 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.096 0 CA-C-N 121.537 1.971 . . . . 0.0 109.567 164.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.896 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.75 -58.93 0.42 Allowed 'General case' 0 C--N 1.385 2.144 0 C-N-CA 124.807 1.243 . . . . 0.0 110.784 -177.8 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . 0.481 HD12 ' OE1' ' P' ' 158' ' ' GLN . 22.7 mm -58.81 -40.86 81.03 Favored 'Isoleucine or valine' 0 C--N 1.381 1.969 0 CA-C-N 113.089 -1.869 . . . . 0.0 108.847 -172.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.89 ' HB3' HD21 ' P' ' 124' ' ' LEU . 5.9 t90 -67.71 -31.89 72.14 Favored 'General case' 0 C--N 1.382 2.011 0 O-C-N 121.419 -0.801 . . . . 0.0 109.311 173.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.859 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 72.5 m-85 -75.18 -38.76 60.69 Favored 'General case' 0 C--O 1.274 2.345 0 O-C-N 121.274 -0.891 . . . . 0.0 112.302 173.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.481 ' OE1' HD12 ' P' ' 155' ' ' ILE . 81.1 mt-30 -53.22 -62.93 1.33 Allowed 'General case' 0 C--N 1.376 1.754 0 O-C-N 119.879 -1.763 . . . . 0.0 106.465 167.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -56.53 -24.49 47.11 Favored 'General case' 0 C--N 1.39 2.331 0 CA-C-O 117.672 -1.156 . . . . 0.0 109.648 -166.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.527 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 5.4 t60 -79.26 -38.03 36.48 Favored 'General case' 0 C--O 1.282 2.787 0 CA-C-N 121.491 1.95 . . . . 0.0 111.895 178.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.464 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.96 0 CA-C-N 122.997 2.635 . . . . 0.0 111.225 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.596 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 . . . . . 0 C--O 1.258 1.531 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.29 148.13 52.3 Favored 'General case' 0 C--N 1.381 1.965 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -169.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -43.43 -36.15 1.86 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-N 113.384 -1.734 . . . . 0.0 109.226 -177.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.67 -66.86 0.32 Allowed 'General case' 0 C--N 1.382 2.019 0 CA-C-O 124.109 1.909 . . . . 0.0 109.138 173.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.527 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 79.7 mt-30 -48.71 -45.92 39.95 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-N 112.476 -2.147 . . . . 0.0 109.663 177.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.625 ' HA ' HD13 ' P' ' 124' ' ' LEU . 19.0 m -54.73 -54.75 37.83 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.59 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.6 t80 -53.18 -46.13 68.81 Favored 'General case' 0 C--N 1.382 2.014 0 CA-C-O 122.381 1.086 . . . . 0.0 110.161 -171.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.817 ' HG3' HG23 ' P' ' 146' ' ' ILE . 0.3 OUTLIER -66.35 -40.15 89.64 Favored 'General case' 0 C--N 1.38 1.893 0 CA-C-N 114.245 -1.343 . . . . 0.0 107.803 179.417 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.819 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.7 mt -60.98 -48.94 79.5 Favored 'General case' 0 C--N 1.386 2.174 0 O-C-N 120.528 -1.357 . . . . 0.0 109.607 173.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.532 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.6 mt-10 -55.18 -52.63 62.72 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.755 1.264 . . . . 0.0 109.398 176.266 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.59 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -42.28 -58.67 2.09 Favored 'General case' 0 C--N 1.379 1.848 0 CA-C-N 112.209 -2.269 . . . . 0.0 109.075 177.073 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.706 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -69.83 -32.72 71.3 Favored 'General case' 0 C--N 1.396 2.596 0 CA-C-N 112.481 -2.145 . . . . 0.0 108.467 -168.083 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.771 ' HD2' ' HD1' ' P' ' 157' ' ' PHE . 6.0 t80 -68.95 -52.09 32.87 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-O 121.81 0.814 . . . . 0.0 109.638 171.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.634 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 3.2 mmm180 -62.58 -14.07 38.4 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-N 113.545 -1.661 . . . . 0.0 108.302 -164.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -95.91 -47.33 6.17 Favored 'General case' 0 C--N 1.379 1.87 0 CA-C-O 123.93 1.824 . . . . 0.0 106.539 -176.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.676 ' CD ' HD22 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -159.36 123.1 3.78 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 111.919 -2.401 . . . . 0.0 110.256 -166.043 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . 0.5 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 1.1 ptt-85 -80.45 -7.65 59.23 Favored 'General case' 0 C--N 1.387 2.223 0 CA-C-N 112.36 -2.2 . . . . 0.0 111.243 -162.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.652 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 0.4 OUTLIER -152.84 90.6 1.48 Allowed 'General case' 0 C--N 1.378 1.837 0 CA-C-O 126.846 3.212 . . . . 0.0 109.183 -154.268 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.676 HD22 ' CD ' ' P' ' 131' ' ' GLN . 65.0 mt -97.3 137.88 35.62 Favored 'General case' 0 C--N 1.415 3.413 0 CA-C-N 111.863 -2.426 . . . . 0.0 108.528 -166.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.31 156.68 25.4 Favored 'General case' 0 C--N 1.381 1.971 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 161.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.562 ' HB2' ' HD3' ' P' ' 137' ' ' PRO . . . -59.11 -50.01 90.05 Favored Pre-proline 0 CA--C 1.583 2.221 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.458 -163.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.562 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 69.9 Cg_exo -57.05 -28.86 80.72 Favored 'Trans proline' 0 C--N 1.4 3.269 0 N-CA-C 115.011 1.12 . . . . 0.0 115.011 -172.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.607 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.1 OUTLIER -55.53 -70.88 0.1 Allowed 'General case' 0 C--N 1.384 2.093 0 CA-C-O 125.039 2.352 . . . . 0.0 105.734 164.421 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 1.015 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.59 -40.51 80.46 Favored 'General case' 0 C--N 1.391 2.388 0 CA-C-N 109.514 -3.494 . . . . 0.0 108.739 -156.047 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.613 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 4.8 mt-10 -53.17 -41.28 65.04 Favored 'General case' 0 C--N 1.38 1.901 0 CA-C-O 123.482 1.611 . . . . 0.0 108.368 178.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -64.03 -35.13 79.7 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.99 -172.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.706 HD12 ' CG ' ' P' ' 127' ' ' ARG . 2.5 tp -65.33 -43.04 92.21 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-O 123.282 1.515 . . . . 0.0 108.957 168.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.613 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.2 -34.98 66.77 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-N 112.32 -2.218 . . . . 0.0 108.37 174.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.572 ' N ' ' O ' ' P' ' 140' ' ' GLU . 3.1 t -73.49 -44.27 58.28 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.248 -179.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 81.2 mt -66.19 -47.01 75.31 Favored 'General case' 0 C--N 1.379 1.88 0 CA-C-O 124.897 2.284 . . . . 0.0 107.933 -163.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.983 HD13 HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.66 -17.07 7.1 Favored 'Isoleucine or valine' 0 C--N 1.385 2.124 0 CA-C-N 110.539 -3.028 . . . . 0.0 107.688 -171.565 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 81.26 37.11 0.08 Allowed 'General case' 0 C--N 1.385 2.148 0 CA-C-N 111.44 -2.618 . . . . 0.0 108.181 152.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.983 HD13 HD13 ' P' ' 146' ' ' ILE . 6.0 mt -95.32 168.25 10.84 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 112.084 -2.325 . . . . 0.0 109.395 168.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.65 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.9 p -89.28 143.8 31.45 Favored Pre-proline 0 CA--C 1.588 2.407 0 CA-C-O 122.794 1.283 . . . . 0.0 108.26 172.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -60.66 -37.82 76.52 Favored 'Trans proline' 0 C--N 1.414 3.993 0 C-N-CA 122.531 2.154 . . . . 0.0 112.409 -155.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' P' P ' 151' ' ' THR . . . . . 0.401 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -55.27 -32.65 62.55 Favored 'General case' 0 C--N 1.385 2.121 0 C-N-CA 119.512 -0.875 . . . . 0.0 109.806 166.717 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.65 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.8 mt-30 -72.4 -29.44 63.74 Favored 'General case' 0 C--N 1.389 2.283 0 N-CA-C 105.848 -1.908 . . . . 0.0 105.848 -178.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.774 HG12 ' HB2' ' P' ' 139' ' ' ARG . 1.2 t -64.71 -69.75 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.098 0 CA-C-N 121.9 2.137 . . . . 0.0 109.562 166.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 1.015 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.68 -59.18 0.41 Allowed 'General case' 0 C--N 1.387 2.234 0 C-N-CA 124.986 1.315 . . . . 0.0 110.801 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . 0.437 HD12 ' HA ' ' P' ' 155' ' ' ILE . 3.4 mm -55.22 -43.15 69.49 Favored 'Isoleucine or valine' 0 C--N 1.384 2.082 0 CA-C-N 112.825 -1.989 . . . . 0.0 110.089 -176.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.819 ' HB3' HD21 ' P' ' 124' ' ' LEU . 6.0 t90 -66.83 -30.56 70.77 Favored 'General case' 0 C--N 1.382 1.981 0 O-C-N 120.912 -1.118 . . . . 0.0 108.998 174.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.771 ' HD1' ' HD2' ' P' ' 128' ' ' PHE . 45.2 m-85 -76.11 -44.39 38.8 Favored 'General case' 0 C--O 1.276 2.493 0 O-C-N 121.235 -0.916 . . . . 0.0 111.939 174.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' P' ' 154' ' ' LYS . 23.5 mt-30 -42.71 -66.3 0.38 Allowed 'General case' 0 C--N 1.378 1.807 0 O-C-N 119.078 -2.264 . . . . 0.0 107.713 167.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -56.66 -21.93 30.97 Favored 'General case' 0 C--N 1.396 2.628 0 CA-C-N 112.759 -2.019 . . . . 0.0 109.695 -165.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.531 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.8 OUTLIER -76.12 -49.84 16.29 Favored 'General case' 0 C--O 1.284 2.876 0 CA-C-N 120.9 1.682 . . . . 0.0 110.809 172.253 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.652 ' HD3' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.269 2.083 0 CA-C-N 122.505 2.411 . . . . 0.0 109.578 -160.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.648 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.299 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.68 148.17 52.28 Favored 'General case' 0 C--N 1.382 1.984 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 -171.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -43.78 -36.51 2.32 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-N 113.279 -1.782 . . . . 0.0 109.157 -177.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.51 -65.16 0.61 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 124.203 1.954 . . . . 0.0 109.237 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.56 ' O ' HD13 ' P' ' 124' ' ' LEU . 78.2 mt-30 -49.32 -47.61 46.99 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 127.081 2.152 . . . . 0.0 109.722 176.189 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.54 ' HA ' HD13 ' P' ' 124' ' ' LEU . 16.5 m -51.16 -56.18 14.08 Favored 'General case' 0 C--N 1.384 2.072 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 169.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.543 ' CE1' ' CZ ' ' P' ' 126' ' ' ARG . 2.6 t80 -52.96 -48.62 67.24 Favored 'General case' 0 C--N 1.381 1.975 0 CA-C-O 122.593 1.187 . . . . 0.0 110.048 -169.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.996 ' CD ' HG23 ' P' ' 146' ' ' ILE . 6.9 mt-10 -66.23 -36.97 84.42 Favored 'General case' 0 C--N 1.377 1.798 0 CA-C-N 114.253 -1.34 . . . . 0.0 107.826 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.95 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -59.98 -51.85 67.92 Favored 'General case' 0 C--N 1.384 2.079 0 O-C-N 120.76 -1.212 . . . . 0.0 109.871 170.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' P' ' 129' ' ' ARG . 24.2 mt-10 -54.59 -51.47 65.22 Favored 'General case' 0 C--N 1.379 1.872 0 CA-C-O 122.629 1.205 . . . . 0.0 109.294 178.209 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.543 ' CZ ' ' CE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.46 -70.06 0.12 Allowed 'General case' 0 C--N 1.379 1.873 0 CA-C-N 111.683 -2.508 . . . . 0.0 108.681 177.076 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.808 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.7 OUTLIER -56.67 -38.73 72.63 Favored 'General case' 0 C--N 1.387 2.238 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.259 -173.181 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.867 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 27.5 t80 -69.47 -46.44 66.66 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-O 121.541 0.686 . . . . 0.0 110.144 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' P' ' 125' ' ' GLU . 13.2 mtp85 -62.63 -13.96 37.74 Favored 'General case' 0 C--N 1.381 1.936 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 -168.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -107.44 -37.19 6.28 Favored 'General case' 0 C--N 1.379 1.887 0 C-N-CA 126.938 2.095 . . . . 0.0 107.96 -168.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.495 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -153.43 108.37 3.17 Favored 'General case' 0 C--N 1.39 2.328 0 CA-C-N 111.971 -2.377 . . . . 0.0 108.615 -153.45 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -76.15 -19.37 58.53 Favored 'General case' 0 C--N 1.39 2.36 0 CA-C-N 112.021 -2.354 . . . . 0.0 110.508 -168.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.476 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 36.5 m-85 -162.27 112.54 1.53 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 113.875 -1.511 . . . . 0.0 108.313 -153.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.808 HD12 ' HD3' ' P' ' 127' ' ' ARG . 29.6 mt -120.84 142.69 49.4 Favored 'General case' 0 C--N 1.398 2.706 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -163.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.83 152.24 29.82 Favored 'General case' 0 C--N 1.382 2.02 0 O-C-N 121.14 -0.975 . . . . 0.0 108.408 158.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.487 ' HA ' ' CG ' ' P' ' 139' ' ' ARG . . . -58.58 -43.78 98.34 Favored Pre-proline 0 CA--C 1.583 2.216 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -161.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -49.82 -43.35 41.11 Favored 'Trans proline' 0 C--N 1.393 2.914 0 N-CA-C 116.954 1.867 . . . . 0.0 116.954 -179.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.649 ' HG3' HD21 ' P' ' 134' ' ' LEU . 7.6 mm-40 -52.79 -62.61 1.54 Allowed 'General case' 0 C--N 1.39 2.353 0 CA-C-O 124.13 1.919 . . . . 0.0 105.984 169.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 1.019 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -68.01 -46.79 70.28 Favored 'General case' 0 C--N 1.388 2.273 0 CA-C-N 109.492 -3.504 . . . . 0.0 108.331 -158.506 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.627 ' O ' ' N ' ' P' ' 144' ' ' SER . 3.3 mt-10 -53.87 -35.71 61.85 Favored 'General case' 0 C--N 1.38 1.893 0 CA-C-O 122.744 1.259 . . . . 0.0 108.003 -177.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -65.96 -36.4 83.24 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.563 -1.653 . . . . 0.0 108.859 -173.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.623 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.0 OUTLIER -65.72 -42.28 91.24 Favored 'General case' 0 C--N 1.382 1.992 0 CA-C-O 123.172 1.463 . . . . 0.0 109.072 168.163 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.624 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.18 -32.66 64.54 Favored 'General case' 0 C--N 1.389 2.308 0 CA-C-N 112.62 -2.082 . . . . 0.0 108.346 172.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.627 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -73.15 -43.63 61.26 Favored 'General case' 0 C--N 1.389 2.302 0 CA-C-N 113.468 -1.696 . . . . 0.0 109.571 -177.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . 0.421 HD11 ' OE1' ' P' ' 123' ' ' GLU . 86.4 mt -69.2 -45.68 69.32 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-O 124.812 2.244 . . . . 0.0 108.262 -164.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.996 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -97.14 -13.28 8.14 Favored 'Isoleucine or valine' 0 C--N 1.39 2.36 0 CA-C-N 110.934 -2.848 . . . . 0.0 108.11 -169.245 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 83.05 34.87 0.06 Allowed 'General case' 0 C--N 1.382 1.995 0 CA-C-O 125.67 2.652 . . . . 0.0 108.249 152.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.991 HD13 ' CD1' ' P' ' 146' ' ' ILE . 9.2 mt -96.89 171.41 8.52 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 111.65 -2.523 . . . . 0.0 109.736 169.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.617 ' O ' ' N ' ' P' ' 152' ' ' GLN . 20.7 p -95.2 143.19 25.68 Favored Pre-proline 0 CA--C 1.588 2.442 0 CA-C-O 122.361 1.077 . . . . 0.0 108.773 168.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.452 ' HG3' ' HA ' ' P' ' 140' ' ' GLU . 77.5 Cg_exo -55.37 -36.45 93.85 Favored 'Trans proline' 0 C--N 1.41 3.787 0 C-N-CA 122.059 1.84 . . . . 0.0 114.475 -165.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.73 -9.26 13.35 Favored 'General case' 0 C--N 1.38 1.93 0 CA-C-N 119.992 1.269 . . . . 0.0 111.687 167.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.617 ' N ' ' O ' ' P' ' 149' ' ' THR . 42.5 mt-30 -88.56 -34.22 17.43 Favored 'General case' 0 C--O 1.285 2.952 0 CA-C-O 117.169 -1.396 . . . . 0.0 108.471 168.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.961 HG11 ' CE2' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -65.0 -70.5 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.941 0 CA-C-N 124.65 3.386 . . . . 0.0 109.731 165.806 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 1.019 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.4 -54.2 0.52 Allowed 'General case' 0 C--N 1.386 2.17 0 C-N-CA 125.796 1.638 . . . . 0.0 108.865 -178.315 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . 0.635 HD12 ' OE1' ' P' ' 158' ' ' GLN . 7.4 mm -56.89 -61.74 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.956 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.95 ' HB3' HD21 ' P' ' 124' ' ' LEU . 3.4 t90 -49.82 -30.19 9.33 Favored 'General case' 0 C--N 1.382 2.019 0 O-C-N 120.2 -1.562 . . . . 0.0 109.187 -178.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.961 ' CE2' HG11 ' P' ' 153' ' ' VAL . 74.1 m-85 -75.51 -43.88 46.65 Favored 'General case' 0 C--O 1.282 2.779 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 170.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.635 ' OE1' HD12 ' P' ' 155' ' ' ILE . 13.6 mt-30 -41.95 -70.94 0.09 Allowed 'General case' 0 C--N 1.378 1.808 0 O-C-N 118.517 -2.614 . . . . 0.0 106.533 161.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -18.92 22.82 Favored 'General case' 0 C--N 1.385 2.15 0 CA-C-O 117.684 -1.151 . . . . 0.0 111.187 -165.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.54 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.1 t60 -74.95 -48.87 22.21 Favored 'General case' 0 C--O 1.281 2.72 0 CA-C-N 120.964 1.711 . . . . 0.0 110.186 177.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.476 ' HD2' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.269 2.079 0 CA-C-N 122.443 2.383 . . . . 0.0 110.59 -159.035 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.433 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.5 m-85 . . . . . 0 C--O 1.256 1.416 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.1 p -67.37 148.08 52.09 Favored 'General case' 0 C--N 1.381 1.967 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -171.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -43.17 -36.17 1.63 Allowed 'General case' 0 C--N 1.382 2.012 0 CA-C-N 113.271 -1.786 . . . . 0.0 109.258 -178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.56 -66.67 0.35 Allowed 'General case' 0 C--N 1.383 2.032 0 CA-C-O 124.172 1.939 . . . . 0.0 109.078 173.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.602 ' O ' HD13 ' P' ' 124' ' ' LEU . 80.9 mt-30 -49.12 -48.24 44.71 Favored 'General case' 0 C--N 1.382 2.005 0 CA-C-N 112.421 -2.172 . . . . 0.0 109.491 177.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.586 ' HA ' HD13 ' P' ' 124' ' ' LEU . 19.9 m -52.38 -55.07 24.15 Favored 'General case' 0 C--N 1.385 2.143 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 170.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.484 ' CE1' ' CZ ' ' P' ' 126' ' ' ARG . 2.3 t80 -53.05 -45.69 68.19 Favored 'General case' 0 C--N 1.383 2.057 0 CA-C-O 122.237 1.018 . . . . 0.0 109.985 -171.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.819 ' HG3' HG23 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.8 -39.64 87.84 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-N 114.321 -1.309 . . . . 0.0 107.834 179.664 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.893 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.3 mt -60.55 -49.49 77.33 Favored 'General case' 0 C--N 1.385 2.111 0 O-C-N 120.532 -1.355 . . . . 0.0 109.599 172.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.565 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.5 mt-10 -55.68 -51.79 66.06 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-O 122.575 1.179 . . . . 0.0 109.639 177.058 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.484 ' CZ ' ' CE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.65 -70.24 0.11 Allowed 'General case' 0 C--N 1.378 1.822 0 CA-C-N 111.851 -2.431 . . . . 0.0 109.022 177.245 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.724 ' HD2' HD23 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -62.82 -31.44 72.43 Favored 'General case' 0 C--N 1.379 1.866 0 CA-C-N 113.702 -1.59 . . . . 0.0 108.244 -171.185 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.815 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 19.9 t80 -70.13 -49.02 54.93 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-N 119.786 1.176 . . . . 0.0 109.971 175.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.565 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.5 mmm180 -62.65 -16.12 55.41 Favored 'General case' 0 C--N 1.38 1.909 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -166.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -105.29 -41.29 5.57 Favored 'General case' 0 C--N 1.378 1.84 0 CA-C-O 124.07 1.891 . . . . 0.0 107.217 -168.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.471 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.7 OUTLIER -152.94 96.67 2.12 Favored 'General case' 0 C--N 1.386 2.175 0 CA-C-N 111.752 -2.477 . . . . 0.0 109.54 -152.012 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . 0.487 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -77.48 -5.85 51.44 Favored 'General case' 0 C--N 1.394 2.52 0 CA-C-N 111.59 -2.55 . . . . 0.0 110.779 -158.406 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.776 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 2.5 m-30 -163.85 113.04 1.23 Allowed 'General case' 0 C--N 1.38 1.923 0 CA-C-N 114.516 -1.22 . . . . 0.0 108.356 -154.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.724 HD23 ' HD2' ' P' ' 127' ' ' ARG . 43.3 mt -120.67 139.6 52.79 Favored 'General case' 0 C--N 1.397 2.664 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -161.064 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.85 157.63 25.63 Favored 'General case' 0 C--N 1.382 2.022 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 160.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.556 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.22 -49.81 90.9 Favored Pre-proline 0 CA--C 1.583 2.222 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.465 -164.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.556 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 50.9 Cg_exo -55.99 -29.73 75.03 Favored 'Trans proline' 0 C--N 1.399 3.187 0 C-N-CA 121.002 1.135 . . . . 0.0 114.649 -173.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.529 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -55.87 -69.45 0.14 Allowed 'General case' 0 C--N 1.385 2.121 0 CA-C-O 124.176 1.941 . . . . 0.0 106.09 165.535 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.664 ' CZ ' ' HG3' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.67 -35.79 75.44 Favored 'General case' 0 C--N 1.391 2.408 0 CA-C-N 109.858 -3.337 . . . . 0.0 108.85 -156.275 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.639 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 4.0 mt-10 -52.25 -44.8 65.08 Favored 'General case' 0 C--N 1.381 1.944 0 CA-C-O 123.628 1.68 . . . . 0.0 107.786 174.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -67.12 -36.3 81.6 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 112.396 -2.184 . . . . 0.0 109.121 -166.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.557 ' O ' HG21 ' P' ' 146' ' ' ILE . 1.0 OUTLIER -65.95 -42.1 90.42 Favored 'General case' 0 C--N 1.382 1.995 0 CA-C-O 123.158 1.456 . . . . 0.0 109.049 169.401 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.639 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.3 -35.69 67.81 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.54 -2.118 . . . . 0.0 108.094 172.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.592 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.5 t -70.9 -43.14 68.92 Favored 'General case' 0 C--N 1.389 2.305 0 CA-C-N 113.231 -1.804 . . . . 0.0 110.592 -178.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.73 -46.96 67.55 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-O 124.863 2.268 . . . . 0.0 108.09 -164.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.97 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.37 -13.16 8.23 Favored 'Isoleucine or valine' 0 C--N 1.39 2.351 0 CA-C-N 110.815 -2.902 . . . . 0.0 108.042 -168.291 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . 0.573 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 7.4 tpt180 82.32 35.28 0.07 Allowed 'General case' 0 C--N 1.382 1.998 0 CA-C-O 125.635 2.636 . . . . 0.0 107.837 153.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.97 HD13 ' CD1' ' P' ' 146' ' ' ILE . 9.8 mt -95.89 172.32 8.09 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 111.473 -2.603 . . . . 0.0 109.145 168.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.477 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.3 p -88.98 146.43 36.54 Favored Pre-proline 0 CA--C 1.587 2.371 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 165.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.601 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 85.0 Cg_exo -50.45 -49.39 16.68 Favored 'Trans proline' 0 C--N 1.408 3.71 0 C-N-CA 123.78 2.986 . . . . 0.0 114.127 -167.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 151' ' ' THR . . . . . 0.425 HG23 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -58.26 -20.66 44.04 Favored 'General case' 0 C--N 1.386 2.194 0 CA-C-N 112.759 -2.019 . . . . 0.0 110.79 173.847 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.4 mt-30 -78.07 -32.48 50.8 Favored 'General case' 0 C--O 1.277 2.522 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 171.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.757 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.7 t -64.27 -75.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.381 1.972 0 CA-C-N 122.967 2.621 . . . . 0.0 109.718 162.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.664 ' HG3' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -40.65 -42.84 1.8 Allowed 'General case' 0 C--N 1.387 2.212 0 C-N-CA 124.881 1.273 . . . . 0.0 109.971 -171.108 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . 0.425 HG12 HG23 ' P' ' 151' ' ' THR . 0.7 OUTLIER -60.3 -63.05 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.956 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 -179.381 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.893 ' HB3' HD21 ' P' ' 124' ' ' LEU . 2.7 t90 -49.5 -29.03 6.08 Favored 'General case' 0 C--N 1.384 2.078 0 O-C-N 121.415 -0.803 . . . . 0.0 109.311 -177.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.815 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 52.1 m-85 -75.19 -43.06 54.17 Favored 'General case' 0 C--O 1.275 2.437 0 O-C-N 121.629 -0.669 . . . . 0.0 112.37 173.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -46.58 -65.32 0.58 Allowed 'General case' 0 C--N 1.376 1.759 0 O-C-N 119.131 -2.231 . . . . 0.0 107.028 165.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -56.0 -19.77 13.93 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-O 117.868 -1.063 . . . . 0.0 111.073 -164.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.551 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.6 OUTLIER -79.19 -46.59 17.59 Favored 'General case' 0 C--O 1.286 3.019 0 CA-C-N 121.055 1.752 . . . . 0.0 111.752 173.499 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.776 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.939 0 CA-C-N 123.603 2.91 . . . . 0.0 110.192 -163.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.617 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.2 m-85 . . . . . 0 C--O 1.258 1.515 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.55 147.41 53.46 Favored 'General case' 0 C--N 1.381 1.964 0 N-CA-C 107.543 -1.281 . . . . 0.0 107.543 -166.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 33.7 ttmt -41.72 -36.24 0.95 Allowed 'General case' 0 C--N 1.381 1.957 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.283 -176.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.1 -68.75 0.16 Allowed 'General case' 0 C--N 1.382 2.013 0 CA-C-O 124.329 2.014 . . . . 0.0 109.14 173.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.531 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 78.8 mt-30 -46.79 -50.11 18.81 Favored 'General case' 0 C--N 1.383 2.056 0 CA-C-N 112.356 -2.202 . . . . 0.0 109.855 176.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.527 ' HA ' HD13 ' P' ' 124' ' ' LEU . 18.7 m -51.18 -55.92 15.44 Favored 'General case' 0 C--N 1.383 2.05 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 170.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.609 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.8 t80 -52.99 -46.38 68.29 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-O 122.34 1.067 . . . . 0.0 110.194 -171.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.807 ' HG3' HG23 ' P' ' 146' ' ' ILE . 0.3 OUTLIER -66.42 -39.5 88.99 Favored 'General case' 0 C--N 1.379 1.88 0 CA-C-N 114.455 -1.248 . . . . 0.0 107.759 179.494 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 1.009 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.7 mt -60.84 -49.11 78.8 Favored 'General case' 0 C--N 1.385 2.136 0 O-C-N 120.592 -1.317 . . . . 0.0 109.953 173.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.555 ' O ' ' N ' ' P' ' 129' ' ' ARG . 17.8 mt-10 -53.74 -55.37 26.87 Favored 'General case' 0 C--N 1.38 1.895 0 CA-C-O 122.354 1.073 . . . . 0.0 108.841 175.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.609 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.82 -66.56 0.29 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 111.918 -2.401 . . . . 0.0 108.677 178.785 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.752 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.7 OUTLIER -61.09 -33.31 73.14 Favored 'General case' 0 C--N 1.394 2.503 0 CA-C-N 112.427 -2.17 . . . . 0.0 108.384 -173.416 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.714 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 13.8 t80 -67.5 -50.99 56.34 Favored 'General case' 0 C--N 1.387 2.23 0 O-C-N 121.195 -0.941 . . . . 0.0 110.29 174.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.555 ' N ' ' O ' ' P' ' 125' ' ' GLU . 0.1 OUTLIER -62.58 -12.56 23.59 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-N 112.916 -1.947 . . . . 0.0 108.158 -165.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -108.62 -39.67 5.32 Favored 'General case' 0 C--N 1.38 1.909 0 C-N-CA 126.383 1.873 . . . . 0.0 108.251 -170.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.496 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -151.79 110.24 3.77 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 112.051 -2.34 . . . . 0.0 108.861 -153.237 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -76.78 -20.28 56.63 Favored 'General case' 0 C--N 1.392 2.441 0 CA-C-N 112.23 -2.259 . . . . 0.0 110.738 -168.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.411 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 33.0 m-85 -161.02 114.18 1.97 Allowed 'General case' 0 C--N 1.379 1.887 0 CA-C-N 113.812 -1.54 . . . . 0.0 108.298 -153.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.752 HD12 ' HD3' ' P' ' 127' ' ' ARG . 26.4 mt -124.91 137.04 54.29 Favored 'General case' 0 C--N 1.399 2.753 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -159.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.35 154.84 26.27 Favored 'General case' 0 C--N 1.381 1.95 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 166.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.532 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.68 -49.36 92.28 Favored Pre-proline 0 CA--C 1.583 2.242 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.248 -161.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.532 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 82.7 Cg_exo -58.05 -28.89 85.09 Favored 'Trans proline' 0 C--N 1.4 3.286 0 C-N-CA 121.183 1.255 . . . . 0.0 114.956 -174.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.646 ' HG3' HD21 ' P' ' 134' ' ' LEU . 1.4 mm-40 -54.04 -70.78 0.09 Allowed 'General case' 0 C--N 1.379 1.883 0 CA-C-O 124.786 2.231 . . . . 0.0 106.308 160.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.898 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.25 -40.47 81.93 Favored 'General case' 0 C--N 1.39 2.328 0 CA-C-N 109.88 -3.327 . . . . 0.0 108.794 -155.14 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.616 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 5.0 mt-10 -53.24 -38.24 62.8 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-O 123.125 1.441 . . . . 0.0 108.294 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -65.18 -35.6 81.6 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 112.955 -1.93 . . . . 0.0 108.728 -172.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.579 HD12 ' CG ' ' P' ' 127' ' ' ARG . 2.9 tp -64.37 -43.14 95.44 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-O 123.277 1.513 . . . . 0.0 108.976 167.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.616 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.86 -34.61 67.99 Favored 'General case' 0 C--N 1.39 2.351 0 CA-C-N 112.29 -2.232 . . . . 0.0 108.613 176.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.59 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.9 OUTLIER -73.83 -44.04 56.89 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.142 -179.587 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 74.7 mt -65.54 -46.75 78.33 Favored 'General case' 0 C--N 1.379 1.859 0 CA-C-O 124.866 2.27 . . . . 0.0 107.88 -163.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.961 HD13 HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.99 -17.65 6.85 Favored 'Isoleucine or valine' 0 C--N 1.384 2.108 0 CA-C-N 110.435 -3.075 . . . . 0.0 107.664 -171.101 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 80.93 37.44 0.09 Allowed 'General case' 0 C--N 1.385 2.141 0 CA-C-N 111.397 -2.638 . . . . 0.0 108.158 152.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.961 HD13 HD13 ' P' ' 146' ' ' ILE . 6.0 mt -95.05 168.71 10.6 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-N 112.121 -2.308 . . . . 0.0 109.308 168.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.648 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.4 p -88.29 143.48 32.69 Favored Pre-proline 0 CA--C 1.587 2.375 0 CA-C-O 122.862 1.315 . . . . 0.0 108.137 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.426 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 1.0 OUTLIER -59.84 -37.35 86.91 Favored 'Trans proline' 1 C--N 1.414 4.001 0 C-N-CA 122.634 2.223 . . . . 0.0 111.926 -155.743 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' P' P ' 151' ' ' THR . . . . . 0.508 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.2 OUTLIER -56.69 -33.1 66.09 Favored 'General case' 0 C--N 1.386 2.174 0 C-N-CA 119.657 -0.817 . . . . 0.0 110.059 167.644 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.648 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.8 mt-30 -72.8 -26.97 61.7 Favored 'General case' 0 C--N 1.388 2.269 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.516 HG11 ' CD2' ' P' ' 157' ' ' PHE . 0.9 OUTLIER -64.29 -69.78 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.084 0 CA-C-N 121.789 2.086 . . . . 0.0 109.229 164.39 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.898 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -35.55 -60.13 0.52 Allowed 'General case' 0 C--N 1.386 2.153 0 C-N-CA 125.194 1.398 . . . . 0.0 110.462 -176.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . 0.471 HD12 ' HA ' ' P' ' 155' ' ' ILE . 4.3 mm -58.95 -37.38 66.99 Favored 'Isoleucine or valine' 0 C--N 1.384 2.106 0 CA-C-N 112.889 -1.96 . . . . 0.0 110.841 -174.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 1.009 ' HB3' HD21 ' P' ' 124' ' ' LEU . 5.5 t90 -67.38 -32.17 72.91 Favored 'General case' 0 C--N 1.381 1.959 0 O-C-N 120.369 -1.457 . . . . 0.0 109.21 169.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.714 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 44.0 m-85 -75.51 -43.79 47.18 Favored 'General case' 0 C--O 1.276 2.497 0 O-C-N 120.713 -1.242 . . . . 0.0 111.823 175.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' P' ' 154' ' ' LYS . 46.3 mt-30 -50.68 -58.25 6.33 Favored 'General case' 0 C--N 1.377 1.784 0 O-C-N 118.994 -2.316 . . . . 0.0 107.292 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -54.93 -29.92 57.38 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-O 117.957 -1.02 . . . . 0.0 108.917 -169.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.532 ' HB3' ' CE1' ' P' ' 128' ' ' PHE . 3.4 t60 -77.58 -41.12 39.91 Favored 'General case' 0 C--O 1.285 2.972 0 CA-C-N 121.562 1.983 . . . . 0.0 111.667 -174.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.411 ' CD ' ' CE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.963 0 CA-C-N 122.995 2.634 . . . . 0.0 108.482 -170.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.632 ' HD1' HD23 ' P' ' 148' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.255 1.393 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.93 148.97 50.53 Favored 'General case' 0 C--N 1.383 2.024 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 -171.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' P' ' 122' ' ' TYR . 19.8 ttmt -33.21 -50.07 0.28 Allowed 'General case' 0 C--N 1.383 2.063 0 O-C-N 126.883 2.614 . . . . 0.0 108.268 174.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.66 -58.11 5.92 Favored 'General case' 0 C--N 1.385 2.109 0 CA-C-N 111.424 -2.625 . . . . 0.0 109.165 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.573 ' O ' HD13 ' P' ' 124' ' ' LEU . 81.7 mt-30 -59.83 -46.57 88.83 Favored 'General case' 0 C--N 1.381 1.969 0 CA-C-N 112.434 -2.166 . . . . 0.0 109.464 -178.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.467 ' HA ' HD13 ' P' ' 124' ' ' LEU . 3.3 m -47.64 -57.6 5.29 Favored 'General case' 0 C--N 1.386 2.155 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 166.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.669 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.34 -48.52 68.44 Favored 'General case' 0 C--N 1.382 1.997 0 CA-C-O 122.587 1.184 . . . . 0.0 109.904 -167.573 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.885 ' CG ' HG23 ' P' ' 146' ' ' ILE . 0.6 OUTLIER -66.2 -37.95 86.79 Favored 'General case' 0 C--N 1.378 1.83 0 CA-C-N 114.032 -1.44 . . . . 0.0 107.856 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.974 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.0 mt -60.7 -50.88 71.69 Favored 'General case' 0 C--N 1.384 2.105 0 O-C-N 120.52 -1.362 . . . . 0.0 109.604 171.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.573 ' O ' ' N ' ' P' ' 129' ' ' ARG . 9.3 mt-10 -55.47 -50.18 70.57 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-O 122.418 1.104 . . . . 0.0 109.48 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.669 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.65 -69.79 0.12 Allowed 'General case' 0 C--N 1.378 1.845 0 CA-C-N 111.872 -2.422 . . . . 0.0 108.719 176.211 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.871 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.5 OUTLIER -59.31 -36.0 74.83 Favored 'General case' 0 C--N 1.391 2.373 0 CA-C-N 112.778 -2.01 . . . . 0.0 108.343 -171.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.835 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 25.7 t80 -70.31 -46.92 63.27 Favored 'General case' 0 C--N 1.381 1.966 0 CA-C-N 119.148 0.886 . . . . 0.0 110.338 178.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.573 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.5 mmp_? -62.51 -15.95 53.15 Favored 'General case' 0 C--N 1.381 1.937 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -168.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -104.51 -39.44 6.41 Favored 'General case' 0 C--N 1.379 1.878 0 C-N-CA 126.592 1.957 . . . . 0.0 107.383 -169.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.494 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -156.21 98.71 1.88 Allowed 'General case' 0 C--N 1.388 2.24 0 CA-C-N 111.759 -2.473 . . . . 0.0 109.223 -153.5 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . 0.519 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 0.4 OUTLIER -77.32 -11.79 59.88 Favored 'General case' 0 C--N 1.388 2.257 0 CA-C-N 111.784 -2.462 . . . . 0.0 110.466 -164.845 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.732 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 3.4 m-30 -154.12 110.81 3.34 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.362 -162.161 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.871 HD12 ' HD3' ' P' ' 127' ' ' ARG . 19.5 mt -121.33 140.01 52.66 Favored 'General case' 0 C--N 1.396 2.63 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -162.413 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.46 160.56 23.95 Favored 'General case' 0 C--N 1.382 1.983 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 164.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.576 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -58.35 -51.63 80.42 Favored Pre-proline 0 CA--C 1.585 2.312 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -166.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.576 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 71.4 Cg_exo -58.16 -29.99 89.1 Favored 'Trans proline' 0 C--N 1.399 3.229 0 N-CA-C 115.387 1.264 . . . . 0.0 115.387 -172.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.682 ' CG ' HD21 ' P' ' 134' ' ' LEU . 15.7 mp0 -58.72 -66.18 0.54 Allowed 'General case' 0 C--N 1.381 1.942 0 CA-C-O 124.866 2.27 . . . . 0.0 105.468 163.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.748 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -67.64 -41.66 83.53 Favored 'General case' 0 C--N 1.391 2.382 0 CA-C-N 109.659 -3.428 . . . . 0.0 108.71 -153.797 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.579 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 0.7 OUTLIER -53.19 -38.05 62.49 Favored 'General case' 0 C--N 1.381 1.94 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.915 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -65.39 -39.08 91.78 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.226 -1.807 . . . . 0.0 109.051 -172.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.621 HD12 ' HB2' ' P' ' 123' ' ' GLU . 0.5 OUTLIER -55.57 -46.21 77.23 Favored 'General case' 0 C--N 1.387 2.212 0 CA-C-O 123.256 1.503 . . . . 0.0 108.515 167.447 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.652 ' HB1' ' HA ' ' P' ' 150' ' ' PRO . . . -63.44 -35.69 81.27 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 111.738 -2.483 . . . . 0.0 108.967 -178.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.579 ' N ' ' O ' ' P' ' 140' ' ' GLU . 4.0 m -73.37 -37.6 65.98 Favored 'General case' 0 C--N 1.387 2.217 0 CA-C-N 114.087 -1.415 . . . . 0.0 109.651 -176.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 37.7 mt -67.3 -49.05 65.77 Favored 'General case' 0 C--N 1.382 1.995 0 CA-C-O 124.492 2.092 . . . . 0.0 108.694 -167.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 1.009 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.43 -13.54 8.21 Favored 'Isoleucine or valine' 0 C--N 1.389 2.308 0 CA-C-N 110.943 -2.844 . . . . 0.0 108.031 -167.649 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' P' ' 147' ' ' ARG . 0.0 OUTLIER 82.41 35.62 0.07 Allowed 'General case' 0 C--N 1.382 2.019 0 CA-C-O 125.853 2.74 . . . . 0.0 107.668 153.549 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 1.009 HD13 ' CD1' ' P' ' 146' ' ' ILE . 7.6 mt -95.95 172.44 8.01 Favored 'General case' 0 C--N 1.396 2.63 0 CA-C-N 111.472 -2.604 . . . . 0.0 109.352 166.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.565 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -89.09 143.59 31.4 Favored Pre-proline 0 CA--C 1.586 2.333 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 167.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.652 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 72.4 Cg_exo -51.4 -46.05 33.76 Favored 'Trans proline' 0 C--N 1.408 3.689 0 C-N-CA 124.252 3.301 . . . . 0.0 114.673 -165.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 151' ' ' THR . . . . . 0.404 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.2 OUTLIER -52.71 -33.69 48.92 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-N 112.163 -2.29 . . . . 0.0 109.507 170.247 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.565 ' N ' ' O ' ' P' ' 149' ' ' THR . 48.1 mt-30 -72.5 -28.27 62.77 Favored 'General case' 0 C--N 1.392 2.43 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.766 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.2 t -64.61 -71.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.026 0 CA-C-N 121.798 2.09 . . . . 0.0 109.814 163.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.748 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.23 -57.78 0.4 Allowed 'General case' 0 C--N 1.388 2.254 0 C-N-CA 124.466 1.106 . . . . 0.0 110.364 -177.581 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . 0.462 HD12 ' OE1' ' P' ' 158' ' ' GLN . 9.9 mm -59.89 -40.22 82.21 Favored 'Isoleucine or valine' 0 C--N 1.382 1.995 0 CA-C-N 113.311 -1.768 . . . . 0.0 109.47 -173.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.974 ' HB3' HD21 ' P' ' 124' ' ' LEU . 6.3 t90 -67.45 -31.33 71.43 Favored 'General case' 0 C--N 1.381 1.965 0 O-C-N 121.182 -0.949 . . . . 0.0 109.231 172.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.835 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 66.3 m-85 -74.65 -40.19 61.61 Favored 'General case' 0 C--O 1.273 2.34 0 O-C-N 121.526 -0.734 . . . . 0.0 111.956 173.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.462 ' OE1' HD12 ' P' ' 155' ' ' ILE . 23.8 mt-30 -49.86 -63.62 1.06 Allowed 'General case' 0 C--N 1.378 1.823 0 O-C-N 119.47 -2.018 . . . . 0.0 106.821 167.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -56.7 -19.29 15.84 Favored 'General case' 0 C--N 1.388 2.28 0 CA-C-O 117.907 -1.044 . . . . 0.0 110.446 -164.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.528 ' ND1' ' CZ ' ' P' ' 128' ' ' PHE . 14.7 t-80 -76.48 -52.51 9.67 Favored 'General case' 0 C--O 1.279 2.639 0 CA-C-N 120.743 1.61 . . . . 0.0 111.084 171.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.732 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.921 0 CA-C-N 122.535 2.425 . . . . 0.0 111.06 -158.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.638 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 3.2 m-85 . . . . . 0 C--O 1.257 1.455 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.24 148.11 52.32 Favored 'General case' 0 C--N 1.383 2.035 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 -171.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -42.71 -36.09 1.33 Allowed 'General case' 0 C--N 1.382 2.003 0 CA-C-N 113.923 -1.489 . . . . 0.0 109.446 -177.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.87 -67.8 0.23 Allowed 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.148 -1.842 . . . . 0.0 109.161 173.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.538 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 80.2 mt-30 -49.9 -50.77 44.83 Favored 'General case' 0 C--N 1.382 1.986 0 CA-C-N 112.437 -2.165 . . . . 0.0 109.399 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.666 ' HA ' HD13 ' P' ' 124' ' ' LEU . 21.5 m -49.75 -56.86 8.68 Favored 'General case' 0 C--N 1.382 1.994 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 170.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.544 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 1.0 OUTLIER -53.23 -45.51 68.74 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 122.29 1.043 . . . . 0.0 109.74 -170.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 1.034 ' CD ' HG23 ' P' ' 146' ' ' ILE . 6.9 mt-10 -66.9 -38.56 86.48 Favored 'General case' 0 C--N 1.379 1.853 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.607 178.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.948 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.4 mt -60.71 -50.01 75.22 Favored 'General case' 0 C--N 1.382 2.005 0 O-C-N 119.62 -1.925 . . . . 0.0 109.9 171.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' P' ' 129' ' ' ARG . 20.1 mt-10 -55.75 -52.18 64.8 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-O 122.613 1.197 . . . . 0.0 109.55 177.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.544 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.38 -60.18 1.15 Allowed 'General case' 0 C--N 1.38 1.898 0 CA-C-N 112.128 -2.305 . . . . 0.0 109.362 176.032 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.835 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -70.5 -32.04 69.38 Favored 'General case' 0 C--N 1.397 2.638 0 CA-C-N 112.274 -2.239 . . . . 0.0 108.343 -167.097 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.764 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.3 t80 -67.94 -53.04 29.36 Favored 'General case' 0 C--N 1.384 2.072 0 CA-C-O 121.832 0.825 . . . . 0.0 109.397 170.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' P' ' 125' ' ' GLU . 19.6 mmm180 -62.72 -17.77 61.35 Favored 'General case' 0 C--N 1.379 1.888 0 CA-C-N 113.213 -1.812 . . . . 0.0 108.239 -163.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -88.22 -51.68 5.63 Favored 'General case' 0 C--N 1.379 1.882 0 CA-C-O 123.811 1.767 . . . . 0.0 106.482 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.31 125.5 4.43 Favored 'General case' 0 C--N 1.394 2.522 0 CA-C-N 112.19 -2.277 . . . . 0.0 110.843 -168.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . 0.691 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 3.7 ptt-85 -80.02 -6.52 57.74 Favored 'General case' 0 C--N 1.393 2.47 0 CA-C-N 111.774 -2.467 . . . . 0.0 111.318 -160.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.818 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 3.0 m-30 -148.27 115.01 6.03 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 125.297 2.475 . . . . 0.0 109.768 -161.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.587 HD21 ' HG3' ' P' ' 138' ' ' GLU . 67.2 mt -125.3 133.91 52.45 Favored 'General case' 0 C--N 1.415 3.425 0 O-C-N 119.851 -1.781 . . . . 0.0 108.826 -162.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.33 158.2 21.24 Favored 'General case' 0 C--N 1.381 1.978 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 168.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.596 ' HB2' ' HD3' ' P' ' 137' ' ' PRO . . . -59.15 -50.36 88.17 Favored Pre-proline 0 CA--C 1.584 2.285 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -161.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 77.7 Cg_exo -58.66 -28.86 87.61 Favored 'Trans proline' 0 C--N 1.401 3.338 0 N-CA-C 115.185 1.186 . . . . 0.0 115.185 -175.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.587 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -53.45 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.379 1.864 0 CA-C-O 124.295 1.997 . . . . 0.0 106.483 159.895 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 1.023 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.51 -34.87 74.93 Favored 'General case' 0 C--N 1.387 2.226 0 CA-C-N 109.919 -3.31 . . . . 0.0 109.159 -155.124 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.624 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 2.7 mt-10 -52.42 -42.94 64.52 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-O 123.493 1.616 . . . . 0.0 108.137 175.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -64.76 -35.67 81.82 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 112.501 -2.136 . . . . 0.0 108.97 -169.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.835 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.1 tp -65.91 -43.03 89.36 Favored 'General case' 0 C--N 1.382 1.998 0 CA-C-O 123.201 1.477 . . . . 0.0 109.163 168.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.624 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -55.34 -35.82 65.62 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.036 174.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.581 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.7 OUTLIER -72.43 -43.17 64.2 Favored 'General case' 0 C--N 1.389 2.29 0 CA-C-N 113.762 -1.563 . . . . 0.0 110.407 -178.113 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 81.3 mt -66.11 -44.87 83.05 Favored 'General case' 0 C--N 1.379 1.89 0 CA-C-O 124.838 2.256 . . . . 0.0 108.301 -164.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 1.034 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -98.83 -13.42 8.09 Favored 'Isoleucine or valine' 0 C--N 1.39 2.344 0 CA-C-N 110.905 -2.861 . . . . 0.0 108.064 -166.249 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 81.8 34.98 0.08 Allowed 'General case' 0 C--N 1.381 1.975 0 CA-C-O 125.586 2.612 . . . . 0.0 107.946 153.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.977 HD13 ' CD1' ' P' ' 146' ' ' ILE . 8.6 mt -95.63 172.36 8.1 Favored 'General case' 0 C--N 1.396 2.593 0 CA-C-N 111.47 -2.605 . . . . 0.0 109.078 167.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.586 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.1 p -91.27 141.53 26.29 Favored Pre-proline 0 CA--C 1.589 2.454 0 CA-C-O 122.795 1.283 . . . . 0.0 108.264 166.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.602 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 0.3 OUTLIER -48.21 -46.99 20.94 Favored 'Trans proline' 0 C--N 1.403 3.429 0 C-N-CA 124.934 3.756 . . . . 0.0 115.404 -167.289 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' P' P ' 151' ' ' THR . . . . . 0.541 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -52.85 -30.55 34.39 Favored 'General case' 0 C--N 1.383 2.065 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.112 169.278 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.586 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.3 mt-30 -73.87 -30.58 62.72 Favored 'General case' 0 C--N 1.391 2.401 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 179.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.739 HG11 ' CD2' ' P' ' 157' ' ' PHE . 0.9 OUTLIER -64.07 -67.05 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.382 2.018 0 CA-C-N 122.011 2.187 . . . . 0.0 109.743 165.803 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 1.023 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -32.93 -60.08 0.33 Allowed 'General case' 0 C--N 1.387 2.201 0 C-N-CA 124.615 1.166 . . . . 0.0 110.845 -177.254 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . 0.457 HD12 ' OE1' ' P' ' 158' ' ' GLN . 37.5 mm -64.78 -34.94 73.5 Favored 'Isoleucine or valine' 0 C--N 1.382 2.01 0 CA-C-N 112.794 -2.003 . . . . 0.0 108.756 -169.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.948 ' HB3' HD21 ' P' ' 124' ' ' LEU . 6.1 t90 -67.47 -33.07 74.37 Favored 'General case' 0 C--N 1.384 2.109 0 O-C-N 121.691 -0.631 . . . . 0.0 109.353 168.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.764 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 39.2 m-85 -74.89 -41.71 59.24 Favored 'General case' 0 C--O 1.272 2.272 0 O-C-N 120.966 -1.084 . . . . 0.0 111.94 174.599 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' P' ' 154' ' ' LYS . 77.3 mt-30 -50.98 -59.8 3.77 Favored 'General case' 0 C--N 1.377 1.77 0 O-C-N 119.785 -1.822 . . . . 0.0 106.703 170.016 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -56.5 -20.28 19.57 Favored 'General case' 0 C--N 1.389 2.314 0 CA-C-O 117.409 -1.281 . . . . 0.0 110.333 -168.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.554 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.5 OUTLIER -76.39 -50.35 14.42 Favored 'General case' 0 C--O 1.282 2.816 0 CA-C-N 121.2 1.818 . . . . 0.0 110.313 174.666 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.818 ' HD3' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.019 0 CA-C-N 122.784 2.538 . . . . 0.0 111.166 -158.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.663 ' CD1' HD21 ' P' ' 148' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.272 2.268 0 CA-C-O 118.215 -0.898 . . . . 0.0 109.71 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -69.81 155.48 40.49 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 122.831 2.56 . . . . 0.0 110.006 -172.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . 0.513 ' HB2' ' HE3' ' P' ' 118' ' ' LYS . 0.2 OUTLIER -43.92 -37.12 2.71 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 122.329 1.062 . . . . 0.0 111.223 176.515 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.21 -58.31 9.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 122.953 1.359 . . . . 0.0 110.206 172.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.547 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 78.6 mt-30 -55.51 -47.9 75.5 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.775 177.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.575 ' HA ' HD11 ' P' ' 124' ' ' LEU . 3.2 m -53.03 -44.93 67.72 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.348 -0.845 . . . . 0.0 110.242 170.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.508 ' CE2' ' NH1' ' P' ' 126' ' ' ARG . 11.1 t80 -65.43 -40.24 93.07 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 121.714 -0.616 . . . . 0.0 111.088 -171.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.714 ' HB2' HG23 ' P' ' 146' ' ' ILE . 0.0 OUTLIER -71.46 -26.71 62.83 Favored 'General case' 0 C--O 1.265 1.878 0 O-C-N 120.83 -1.169 . . . . 0.0 111.303 169.606 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.697 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.4 mt -73.67 -40.65 63.53 Favored 'General case' 0 C--O 1.247 0.931 0 O-C-N 119.026 -2.296 . . . . 0.0 110.739 172.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -61.5 -45.68 93.2 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 123.152 1.453 . . . . 0.0 111.442 171.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.508 ' NH1' ' CE2' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -45.92 -65.1 0.59 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.941 172.451 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.844 ' HG3' HD12 ' P' ' 142' ' ' LEU . 0.7 OUTLIER -65.22 -31.32 72.43 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 118.652 -0.69 . . . . 0.0 109.911 -172.463 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.64 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 26.1 t80 -75.78 -44.69 40.17 Favored 'General case' 0 C--O 1.264 1.831 0 CA-C-N 120.685 1.584 . . . . 0.0 112.974 171.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . . . . . . . . . 5.8 mtp180 -67.23 -13.58 62.11 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 119.12 -2.237 . . . . 0.0 110.502 -173.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -106.0 -33.62 7.85 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 126.369 1.867 . . . . 0.0 111.559 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.524 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -151.8 108.58 3.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 123.862 1.791 . . . . 0.0 112.665 -167.762 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . 0.444 ' HB3' ' CE2' ' P' ' 133' ' ' TYR . 4.2 mtt85 -77.79 -9.14 58.87 Favored 'General case' 0 C--O 1.244 0.779 0 O-C-N 120.444 -1.41 . . . . 0.0 113.649 -171.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.444 ' CE2' ' HB3' ' P' ' 132' ' ' ARG . 98.2 m-85 -152.74 116.78 4.86 Favored 'General case' 0 C--O 1.26 1.647 0 C-N-CA 123.712 0.805 . . . . 0.0 109.765 -168.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.731 HD13 ' HD3' ' P' ' 127' ' ' ARG . 23.7 mt -123.11 143.34 50.05 Favored 'General case' 0 C--O 1.276 2.483 0 O-C-N 119.362 -2.086 . . . . 0.0 111.336 -166.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.58 162.7 19.71 Favored 'General case' 0 C--O 1.26 1.647 0 CA-C-N 124.492 3.315 . . . . 0.0 110.137 168.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.876 ' HB2' ' HD3' ' P' ' 137' ' ' PRO . . . -50.77 -60.49 5.38 Favored Pre-proline 0 C--O 1.253 1.274 0 O-C-N 119.974 -1.704 . . . . 0.0 111.585 -170.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.876 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 85.3 Cg_exo -50.67 -31.23 31.52 Favored 'Trans proline' 1 N--CA 1.538 4.128 1 C-N-CA 125.321 4.014 . . . . 0.0 115.57 -177.392 . . . . . . . . 4 3 . 1 . 017 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.673 ' HB3' HD21 ' P' ' 134' ' ' LEU . 2.3 mm-40 -65.54 -61.15 2.26 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 126.101 2.857 . . . . 0.0 108.638 167.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.665 ' NE ' ' HG3' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -74.99 -22.82 58.3 Favored 'General case' 0 C--O 1.276 2.464 0 CA-C-N 112.273 -2.24 . . . . 0.0 113.102 -166.582 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.651 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 3.5 mt-10 -68.78 -39.4 80.2 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 123.844 3.02 . . . . 0.0 111.297 169.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -59.99 -33.72 72.34 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.633 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.844 HD12 ' HG3' ' P' ' 127' ' ' ARG . 0.9 OUTLIER -68.85 -37.14 78.91 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.058 0.932 . . . . 0.0 109.552 169.954 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.651 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.68 -36.68 69.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.219 172.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 1.6 t -72.09 -42.54 66.04 Favored 'General case' 0 C--O 1.266 1.952 0 N-CA-C 113.971 1.101 . . . . 0.0 113.971 176.118 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . 0.6 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 87.1 mt -66.99 -46.0 75.91 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 125.586 2.612 . . . . 0.0 108.674 -168.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 1.08 HD13 HD11 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -94.13 -15.36 7.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-N 112.311 -2.222 . . . . 0.0 110.381 -175.499 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . 0.6 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.1 OUTLIER 76.75 43.65 0.13 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 123.844 1.783 . . . . 0.0 112.122 165.399 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 1.08 HD11 HD13 ' P' ' 146' ' ' ILE . 5.6 mt -103.7 164.91 11.37 Favored 'General case' 0 C--O 1.253 1.273 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.212 168.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.427 ' HB ' ' HD2' ' P' ' 150' ' ' PRO . 7.1 p -77.42 153.95 81.71 Favored Pre-proline 0 C--N 1.321 -0.662 0 O-C-N 120.452 -1.405 . . . . 0.0 109.263 169.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.437 ' HB2' ' NH1' ' P' ' 139' ' ' ARG . 9.0 Cg_endo -60.0 -45.14 25.48 Favored 'Trans proline' 0 N--CA 1.533 3.825 0 C-N-CA 124.418 3.412 . . . . 0.0 114.184 -171.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 1.1 m -60.48 -20.08 58.87 Favored 'General case' 0 C--O 1.27 2.18 0 CA-C-N 122.274 2.306 . . . . 0.0 112.61 166.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.526 ' HB3' ' CE1' ' P' ' 116' ' ' PHE . 40.2 mt-30 -74.35 -28.4 61.12 Favored 'General case' 0 C--O 1.276 2.452 0 CA-C-N 123.853 3.024 . . . . 0.0 108.442 169.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.561 ' O ' ' HD1' ' P' ' 157' ' ' PHE . 1.2 t -72.41 -63.17 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 CA-C-N 124.585 3.357 . . . . 0.0 111.465 168.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.665 ' HG3' ' NE ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -42.47 -50.04 5.24 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.13 0.972 . . . . 0.0 111.934 -179.51 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -56.67 -52.91 48.12 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 O-C-N 121.539 -0.726 . . . . 0.0 110.9 177.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.697 ' HB3' HD21 ' P' ' 124' ' ' LEU . 4.1 t90 -57.56 -29.98 64.86 Favored 'General case' 0 C--O 1.245 0.865 0 O-C-N 121.265 -0.897 . . . . 0.0 110.0 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.64 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 10.3 m-85 -76.71 -41.38 45.46 Favored 'General case' 0 C--O 1.288 3.113 0 O-C-N 120.227 -1.545 . . . . 0.0 112.999 171.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -51.5 -65.97 0.47 Allowed 'General case' 0 C--N 1.314 -0.957 0 O-C-N 116.624 -3.798 . . . . 0.0 110.863 165.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -58.38 -21.24 49.54 Favored 'General case' 0 C--O 1.276 2.463 0 CA-C-O 115.698 -2.096 . . . . 0.0 111.405 -171.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.676 ' CE1' ' CZ2' ' P' ' 156' ' ' TRP . 0.2 OUTLIER -73.25 -56.87 4.51 Favored 'General case' 0 C--O 1.28 2.696 0 CA-C-N 124.924 3.511 . . . . 0.0 112.93 169.929 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.27 2.182 0 O-C-N 117.962 -2.961 . . . . 0.0 113.651 -170.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.607 ' HD1' HD23 ' P' ' 148' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.256 1.416 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 117' ' ' THR . . . . . 0.404 ' O ' ' N ' ' P' ' 120' ' ' GLN . 1.3 p -65.25 150.03 48.93 Favored 'General case' 0 C--N 1.382 2.02 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 -168.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -45.06 -35.92 3.28 Favored 'General case' 0 C--N 1.382 1.98 0 CA-C-N 114.5 -1.227 . . . . 0.0 109.212 -178.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.2 -59.7 4.23 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-O 124.361 2.029 . . . . 0.0 109.49 174.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.545 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 79.6 mt-30 -60.24 -48.09 83.2 Favored 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.332 2.253 . . . . 0.0 109.949 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.523 ' HA ' HD13 ' P' ' 124' ' ' LEU . 4.2 m -47.47 -55.94 8.03 Favored 'General case' 0 C--N 1.385 2.139 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 167.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.568 ' HE2' ' CZ ' ' P' ' 126' ' ' ARG . 0.0 OUTLIER -52.85 -51.37 61.29 Favored 'General case' 0 C--N 1.38 1.912 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.023 -168.498 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.975 ' CD ' HG23 ' P' ' 146' ' ' ILE . 7.8 mt-10 -65.34 -36.37 83.81 Favored 'General case' 0 C--N 1.379 1.869 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.764 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.788 HD21 ' HB3' ' P' ' 156' ' ' TRP . 3.3 mt -60.01 -51.87 67.83 Favored 'General case' 0 C--N 1.383 2.062 0 O-C-N 120.885 -1.135 . . . . 0.0 109.735 170.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.574 ' O ' ' N ' ' P' ' 129' ' ' ARG . 19.1 mt-10 -55.89 -49.49 73.25 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-O 122.638 1.208 . . . . 0.0 109.738 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.568 ' CZ ' ' HE2' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -42.39 -70.41 0.11 Allowed 'General case' 0 C--N 1.378 1.826 0 CA-C-N 111.896 -2.411 . . . . 0.0 108.717 176.464 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.661 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.3 OUTLIER -58.7 -36.59 74.49 Favored 'General case' 0 C--N 1.393 2.484 0 CA-C-N 112.641 -2.072 . . . . 0.0 108.393 -171.179 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.821 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 25.9 t80 -70.42 -47.23 61.73 Favored 'General case' 0 C--N 1.38 1.924 0 CA-C-O 121.638 0.732 . . . . 0.0 110.346 179.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.574 ' N ' ' O ' ' P' ' 125' ' ' GLU . 0.0 OUTLIER -62.52 -20.62 64.82 Favored 'General case' 0 C--N 1.381 1.949 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -168.585 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -94.06 -44.15 8.17 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-O 123.886 1.803 . . . . 0.0 106.576 -169.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.31 127.34 5.62 Favored 'General case' 0 C--N 1.394 2.51 0 CA-C-N 112.005 -2.361 . . . . 0.0 109.957 -163.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.03 -20.14 49.7 Favored 'General case' 0 C--N 1.397 2.673 0 CA-C-N 111.366 -2.652 . . . . 0.0 110.616 -158.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.693 ' HD1' ' CZ ' ' P' ' 161' ' ' ARG . 18.0 m-85 -153.0 115.57 4.48 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-O 124.946 2.307 . . . . 0.0 109.094 -154.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.552 HD21 ' HG3' ' P' ' 138' ' ' GLU . 35.8 mt -113.27 139.41 48.84 Favored 'General case' 0 C--N 1.417 3.534 0 O-C-N 119.65 -1.906 . . . . 0.0 108.724 -166.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.25 154.52 29.12 Favored 'General case' 0 C--N 1.384 2.106 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 158.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.465 ' HA ' ' HG3' ' P' ' 139' ' ' ARG . . . -58.29 -42.94 97.46 Favored Pre-proline 0 CA--C 1.583 2.224 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.455 -162.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -48.28 -48.48 16.76 Favored 'Trans proline' 0 C--N 1.394 2.942 0 C-N-CA 121.706 1.604 . . . . 0.0 115.903 -178.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.552 ' HG3' HD21 ' P' ' 134' ' ' LEU . 5.0 mm-40 -52.85 -60.79 2.83 Favored 'General case' 0 C--N 1.394 2.506 0 CA-C-O 123.89 1.805 . . . . 0.0 106.183 175.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.62 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -70.03 -33.58 72.16 Favored 'General case' 0 C--O 1.27 2.171 0 CA-C-N 109.662 -3.426 . . . . 0.0 109.494 -161.726 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.648 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 6.8 mt-10 -52.76 -47.84 67.18 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-N 121.434 1.925 . . . . 0.0 107.783 169.12 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -68.08 -36.67 80.2 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-N 112.241 -2.254 . . . . 0.0 109.033 -164.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.661 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.0 OUTLIER -65.96 -42.07 90.39 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-O 123.177 1.465 . . . . 0.0 109.073 168.768 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.648 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -55.71 -36.69 67.46 Favored 'General case' 0 C--N 1.389 2.319 0 CA-C-N 112.646 -2.07 . . . . 0.0 108.413 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.599 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.6 t -72.8 -41.18 65.22 Favored 'General case' 0 C--N 1.388 2.261 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.545 -178.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 77.8 mt -66.76 -50.9 61.24 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-O 124.882 2.277 . . . . 0.0 108.048 -165.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.988 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -90.7 -17.94 7.69 Favored 'Isoleucine or valine' 0 C--N 1.387 2.229 0 CA-C-N 110.406 -3.088 . . . . 0.0 107.949 -172.883 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 81.84 38.35 0.06 Allowed 'General case' 0 C--N 1.386 2.161 0 CA-C-N 111.414 -2.63 . . . . 0.0 107.981 153.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.988 HD13 ' CD1' ' P' ' 146' ' ' ILE . 6.0 mt -94.92 172.84 7.91 Favored 'General case' 0 C--N 1.39 2.356 0 CA-C-N 112.018 -2.356 . . . . 0.0 109.165 166.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.528 ' O ' ' N ' ' P' ' 152' ' ' GLN . 16.8 p -87.84 145.29 36.4 Favored Pre-proline 0 CA--C 1.585 2.304 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 168.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.585 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 65.9 Cg_exo -49.56 -48.28 19.58 Favored 'Trans proline' 0 C--N 1.408 3.701 0 C-N-CA 124.078 3.185 . . . . 0.0 113.909 -167.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 151' ' ' THR . . . . . 0.452 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -56.52 -26.27 54.12 Favored 'General case' 0 C--N 1.388 2.255 0 CA-C-N 112.174 -2.285 . . . . 0.0 110.339 173.188 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' P' ' 149' ' ' THR . 47.3 mt-30 -77.58 -28.44 51.67 Favored 'General case' 0 C--N 1.392 2.42 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 174.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.642 HG11 ' CD1' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -64.19 -70.5 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.954 0 CA-C-N 122.326 2.33 . . . . 0.0 109.545 163.395 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.62 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.0 -59.21 0.43 Allowed 'General case' 0 C--N 1.385 2.149 0 C-N-CA 124.869 1.267 . . . . 0.0 110.338 -176.818 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' P' ' 155' ' ' ILE . 9.4 mm -64.03 -34.5 68.98 Favored 'Isoleucine or valine' 0 C--N 1.385 2.12 0 CA-C-N 112.898 -1.955 . . . . 0.0 110.163 -171.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.788 ' HB3' HD21 ' P' ' 124' ' ' LEU . 5.7 t90 -67.45 -31.55 71.79 Favored 'General case' 0 C--N 1.381 1.95 0 O-C-N 121.305 -0.872 . . . . 0.0 109.472 168.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.821 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 65.0 m-85 -74.62 -40.24 61.64 Favored 'General case' 0 C--O 1.273 2.338 0 O-C-N 121.436 -0.79 . . . . 0.0 111.975 172.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.519 ' N ' ' O ' ' P' ' 154' ' ' LYS . 39.3 mt-30 -54.25 -59.67 4.36 Favored 'General case' 0 C--N 1.378 1.823 0 O-C-N 119.592 -1.943 . . . . 0.0 106.244 170.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -57.11 -24.74 56.27 Favored 'General case' 0 C--N 1.389 2.32 0 CA-C-O 117.509 -1.234 . . . . 0.0 109.935 -169.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.535 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 3.1 t60 -79.08 -41.84 27.79 Favored 'General case' 0 C--O 1.284 2.92 0 CA-C-N 121.779 2.082 . . . . 0.0 111.323 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.693 ' CZ ' ' HD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.264 1.818 0 CA-C-N 122.946 2.612 . . . . 0.0 109.955 -176.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.561 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.0 m-85 . . . . . 0 C--O 1.257 1.452 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.82 148.05 52.44 Favored 'General case' 0 C--N 1.382 1.994 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 -170.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -43.24 -36.37 1.76 Allowed 'General case' 0 C--N 1.382 1.979 0 CA-C-N 113.425 -1.716 . . . . 0.0 109.218 -177.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.68 -66.78 0.33 Allowed 'General case' 0 C--N 1.382 1.978 0 CA-C-O 124.178 1.942 . . . . 0.0 109.14 174.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.597 ' O ' HD13 ' P' ' 124' ' ' LEU . 81.0 mt-30 -48.52 -49.35 36.44 Favored 'General case' 0 C--N 1.382 2.001 0 CA-C-N 112.448 -2.16 . . . . 0.0 109.527 177.298 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.596 ' HA ' HD13 ' P' ' 124' ' ' LEU . 19.5 m -51.6 -54.27 29.51 Favored 'General case' 0 C--N 1.384 2.101 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 171.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.668 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.9 OUTLIER -52.96 -46.5 68.23 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 122.428 1.109 . . . . 0.0 110.095 -172.085 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.814 ' HG3' HG23 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.89 -38.74 86.83 Favored 'General case' 0 C--N 1.379 1.871 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.87 179.84 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.879 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.3 mt -60.56 -50.23 74.36 Favored 'General case' 0 C--N 1.385 2.112 0 O-C-N 120.305 -1.497 . . . . 0.0 109.525 172.404 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.562 ' O ' ' N ' ' P' ' 129' ' ' ARG . 23.4 mt-10 -55.81 -50.35 70.77 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-O 122.626 1.203 . . . . 0.0 109.653 177.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.668 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.46 -68.38 0.19 Allowed 'General case' 0 C--N 1.378 1.808 0 CA-C-N 112.09 -2.323 . . . . 0.0 108.844 175.184 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.846 ' HD3' HD12 ' P' ' 134' ' ' LEU . 1.1 mmt85 -60.56 -36.19 77.89 Favored 'General case' 0 C--N 1.386 2.165 0 CA-C-N 113.06 -1.882 . . . . 0.0 108.418 -170.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.751 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 13.7 t80 -70.2 -48.09 58.67 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-N 119.066 0.848 . . . . 0.0 110.123 176.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.562 ' N ' ' O ' ' P' ' 125' ' ' GLU . 14.7 mtm180 -62.5 -18.88 62.88 Favored 'General case' 0 C--N 1.381 1.945 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 -168.132 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -95.35 -41.04 9.21 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 123.975 1.845 . . . . 0.0 107.059 -173.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -156.46 123.59 5.3 Favored 'General case' 0 C--N 1.393 2.487 0 CA-C-N 111.888 -2.414 . . . . 0.0 108.982 -156.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . 0.447 ' NH1' ' HG3' ' P' ' 132' ' ' ARG . 0.0 OUTLIER -77.73 -16.54 58.37 Favored 'General case' 0 C--N 1.384 2.08 0 CA-C-N 111.805 -2.452 . . . . 0.0 110.249 -172.021 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.418 ' HD1' ' HA ' ' P' ' 133' ' ' TYR . 0.2 OUTLIER -155.27 123.84 6.02 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-O 124.886 2.279 . . . . 0.0 109.308 -154.255 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.846 HD12 ' HD3' ' P' ' 127' ' ' ARG . 30.9 mt -136.05 136.93 40.63 Favored 'General case' 0 C--N 1.404 2.954 0 O-C-N 119.884 -1.76 . . . . 0.0 109.359 -164.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.45 151.71 26.44 Favored 'General case' 0 C--N 1.383 2.05 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 172.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.441 ' HA ' ' HG3' ' P' ' 139' ' ' ARG . . . -57.68 -39.49 76.98 Favored Pre-proline 0 CA--C 1.588 2.406 0 O-C-N 121.405 -0.81 . . . . 0.0 109.259 -165.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -42.56 66.24 Favored 'Trans proline' 0 C--N 1.396 3.033 0 N-CA-C 119.2 2.731 . . . . 0.0 119.2 175.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -49.32 -71.28 0.07 Allowed 'General case' 0 C--N 1.379 1.855 0 CA-C-O 124.626 2.155 . . . . 0.0 107.548 162.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.819 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.26 -37.07 77.75 Favored 'General case' 0 C--N 1.391 2.376 0 CA-C-N 109.563 -3.471 . . . . 0.0 108.492 -157.37 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.636 ' O ' ' N ' ' P' ' 144' ' ' SER . 2.4 mt-10 -53.29 -40.3 64.63 Favored 'General case' 0 C--N 1.381 1.952 0 CA-C-O 123.103 1.43 . . . . 0.0 108.023 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -63.3 -36.0 82.23 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-N 112.937 -1.938 . . . . 0.0 108.445 -171.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.8 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.7 tp -66.02 -43.19 88.39 Favored 'General case' 0 C--N 1.383 2.024 0 CA-C-O 123.037 1.399 . . . . 0.0 109.16 168.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.592 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.07 -33.17 64.78 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 112.75 -2.023 . . . . 0.0 108.28 173.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.636 ' N ' ' O ' ' P' ' 140' ' ' GLU . 7.4 t -73.5 -44.26 58.2 Favored 'General case' 0 C--N 1.387 2.228 0 CA-C-N 113.631 -1.622 . . . . 0.0 109.698 -177.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 83.0 mt -68.04 -44.22 76.9 Favored 'General case' 0 C--N 1.38 1.933 0 CA-C-O 124.793 2.235 . . . . 0.0 108.255 -163.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.972 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -100.2 -13.08 8.31 Favored 'Isoleucine or valine' 0 C--N 1.39 2.34 0 CA-C-N 110.931 -2.85 . . . . 0.0 107.916 -167.696 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 82.37 34.74 0.07 Allowed 'General case' 0 C--N 1.382 1.993 0 CA-C-O 125.508 2.575 . . . . 0.0 107.942 152.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.972 HD13 ' CD1' ' P' ' 146' ' ' ILE . 9.3 mt -96.26 169.59 9.83 Favored 'General case' 0 C--N 1.397 2.637 0 CA-C-N 111.573 -2.558 . . . . 0.0 109.516 170.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.648 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.5 p -91.56 139.81 25.17 Favored Pre-proline 0 CA--C 1.593 2.597 0 CA-C-O 122.661 1.22 . . . . 0.0 108.543 170.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.486 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 15.0 Cg_exo -56.07 -35.31 94.67 Favored 'Trans proline' 1 C--N 1.415 4.047 0 C-N-CA 122.688 2.259 . . . . 0.0 112.92 -159.674 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 1.3 m -59.65 -28.5 67.3 Favored 'General case' 0 C--N 1.384 2.071 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.866 167.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.648 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -72.8 -30.83 64.39 Favored 'General case' 0 C--O 1.271 2.197 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.632 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.4 t -64.35 -74.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 122.094 2.224 . . . . 0.0 109.326 164.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.819 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -38.22 -45.71 0.99 Allowed 'General case' 0 C--N 1.385 2.128 0 C-N-CA 125.452 1.501 . . . . 0.0 110.873 -173.069 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . 0.458 HD12 ' HA ' ' P' ' 155' ' ' ILE . 0.7 OUTLIER -59.28 -64.72 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.382 2.015 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 -179.445 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.879 ' HB3' HD21 ' P' ' 124' ' ' LEU . 2.1 t90 -49.6 -30.9 9.53 Favored 'General case' 0 C--N 1.385 2.126 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -176.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.751 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 45.9 m-85 -74.57 -44.93 48.54 Favored 'General case' 0 C--O 1.278 2.598 0 O-C-N 121.252 -0.905 . . . . 0.0 112.228 171.215 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.419 ' OE1' HD12 ' P' ' 155' ' ' ILE . 46.8 mt-30 -46.05 -64.31 0.78 Allowed 'General case' 0 C--N 1.378 1.815 0 O-C-N 119.0 -2.312 . . . . 0.0 107.005 167.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -55.97 -21.54 21.62 Favored 'General case' 0 C--N 1.386 2.193 0 CA-C-O 117.431 -1.271 . . . . 0.0 110.551 -164.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.544 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 1.0 OUTLIER -80.69 -41.58 23.44 Favored 'General case' 0 C--O 1.292 3.31 0 CA-C-N 121.621 2.01 . . . . 0.0 112.436 176.73 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.421 ' NH2' ' HB3' ' P' ' 157' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.267 1.984 0 CA-C-N 123.825 3.011 . . . . 0.0 109.116 -167.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 116' ' ' PHE . . . . . 0.497 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 . . . . . 0 C--O 1.257 1.496 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.1 p -66.01 149.48 50.17 Favored 'General case' 0 C--N 1.383 2.026 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 -171.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -45.06 -36.9 3.81 Favored 'General case' 0 C--N 1.381 1.973 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.067 -177.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.5 -57.91 9.02 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 113.136 -1.847 . . . . 0.0 109.655 175.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' P' P ' 120' ' ' GLN . . . . . 0.543 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.7 mt-30 -60.9 -48.66 80.77 Favored 'General case' 0 C--N 1.382 2.01 0 C-N-CA 126.728 2.011 . . . . 0.0 109.694 179.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 121' ' ' THR . . . . . 0.589 ' HA ' HD13 ' P' ' 124' ' ' LEU . 5.7 m -47.6 -54.68 11.15 Favored 'General case' 0 C--N 1.383 2.062 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 169.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 122' ' ' TYR . . . . . 0.524 ' CZ ' ' HG3' ' P' ' 126' ' ' ARG . 0.0 OUTLIER -52.3 -51.17 60.1 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.09 -170.361 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' P' P ' 123' ' ' GLU . . . . . 0.985 ' CD ' HG23 ' P' ' 146' ' ' ILE . 7.8 mt-10 -64.89 -37.38 87.45 Favored 'General case' 0 C--N 1.379 1.89 0 CA-C-N 113.964 -1.471 . . . . 0.0 107.601 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 124' ' ' LEU . . . . . 0.782 HD21 ' HB3' ' P' ' 156' ' ' TRP . 3.3 mt -60.82 -49.67 76.56 Favored 'General case' 0 C--N 1.384 2.097 0 O-C-N 120.967 -1.083 . . . . 0.0 110.28 171.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 125' ' ' GLU . . . . . 0.578 ' O ' ' N ' ' P' ' 129' ' ' ARG . 27.2 mt-10 -53.97 -55.39 27.53 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-O 122.347 1.07 . . . . 0.0 108.394 176.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 126' ' ' ARG . . . . . 0.524 ' HG3' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.08 -68.38 0.17 Allowed 'General case' 0 C--N 1.379 1.861 0 CA-C-N 111.935 -2.393 . . . . 0.0 108.882 179.697 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' P' P ' 127' ' ' ARG . . . . . 0.931 ' HG2' HD12 ' P' ' 142' ' ' LEU . 0.0 OUTLIER -58.54 -34.47 71.05 Favored 'General case' 0 C--N 1.394 2.536 0 CA-C-N 112.673 -2.058 . . . . 0.0 108.469 -174.831 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' P' P ' 128' ' ' PHE . . . . . 0.724 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 9.0 t80 -67.73 -50.94 54.72 Favored 'General case' 0 C--N 1.388 2.264 0 O-C-N 121.213 -0.93 . . . . 0.0 110.382 176.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 129' ' ' ARG . . . . . 0.578 ' N ' ' O ' ' P' ' 125' ' ' GLU . 3.2 mmm180 -62.56 -13.15 27.79 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 112.894 -1.957 . . . . 0.0 108.073 -165.353 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -107.88 -39.74 5.46 Favored 'General case' 0 C--N 1.379 1.886 0 C-N-CA 126.319 1.848 . . . . 0.0 107.444 -169.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' P' P ' 131' ' ' GLN . . . . . 0.523 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.4 OUTLIER -153.99 109.08 3.13 Favored 'General case' 0 C--N 1.386 2.164 0 CA-C-N 112.003 -2.362 . . . . 0.0 109.34 -152.914 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -77.04 -18.09 58.33 Favored 'General case' 0 C--N 1.393 2.479 0 CA-C-N 112.45 -2.159 . . . . 0.0 110.556 -167.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' P' P ' 133' ' ' TYR . . . . . 0.44 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 20.0 m-85 -156.81 112.51 2.92 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-N 114.212 -1.358 . . . . 0.0 108.065 -154.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 134' ' ' LEU . . . . . 0.603 HD12 ' HB3' ' P' ' 127' ' ' ARG . 20.4 mt -127.88 130.63 48.85 Favored 'General case' 0 C--N 1.398 2.701 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 -154.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.19 156.79 20.17 Favored 'General case' 0 C--N 1.382 1.987 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 136' ' ' ALA . . . . . 0.473 ' HA ' ' HG3' ' P' ' 139' ' ' ARG . . . -58.36 -43.3 98.03 Favored Pre-proline 0 CA--C 1.585 2.319 0 O-C-N 121.452 -0.78 . . . . 0.0 109.377 -158.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 137' ' ' PRO . . . . . 0.462 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 0.2 OUTLIER -56.5 -40.17 86.35 Favored 'Trans proline' 0 C--N 1.395 3.001 0 N-CA-C 119.056 2.675 . . . . 0.0 119.056 176.694 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' P' P ' 138' ' ' GLU . . . . . 0.457 ' HB3' HD21 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -49.79 -73.7 0.04 OUTLIER 'General case' 0 C--N 1.38 1.902 0 CA-C-O 124.049 1.88 . . . . 0.0 107.497 161.721 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' P' P ' 139' ' ' ARG . . . . . 0.927 ' CZ ' ' HG3' ' P' ' 154' ' ' LYS . 2.1 ptt180 -69.79 -33.53 72.51 Favored 'General case' 0 C--N 1.391 2.386 0 CA-C-N 109.722 -3.399 . . . . 0.0 108.774 -156.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 140' ' ' GLU . . . . . 0.652 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 1.7 mt-10 -53.1 -45.99 68.49 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-O 123.578 1.656 . . . . 0.0 108.127 174.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -66.99 -35.49 80.07 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 112.439 -2.164 . . . . 0.0 109.417 -164.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' P' P ' 142' ' ' LEU . . . . . 0.931 HD12 ' HG2' ' P' ' 127' ' ' ARG . 1.1 tp -65.31 -41.79 93.67 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-O 123.369 1.557 . . . . 0.0 108.981 169.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 143' ' ' ALA . . . . . 0.652 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -57.04 -36.41 70.46 Favored 'General case' 0 C--N 1.39 2.36 0 CA-C-N 112.224 -2.262 . . . . 0.0 107.971 173.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 144' ' ' SER . . . . . 0.502 ' N ' ' O ' ' P' ' 140' ' ' GLU . 2.1 t -69.76 -43.07 72.98 Favored 'General case' 0 C--N 1.388 2.275 0 CA-C-N 113.22 -1.809 . . . . 0.0 111.083 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 145' ' ' LEU . . . . . 0.42 HD11 ' OE1' ' P' ' 123' ' ' GLU . 82.5 mt -69.04 -48.14 63.63 Favored 'General case' 0 C--N 1.38 1.891 0 CA-C-O 124.851 2.263 . . . . 0.0 108.205 -163.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 146' ' ' ILE . . . . . 0.985 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -92.02 -13.89 8.69 Favored 'Isoleucine or valine' 0 C--N 1.389 2.325 0 CA-C-N 110.675 -2.966 . . . . 0.0 107.958 -169.407 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 82.27 36.13 0.07 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 125.761 2.696 . . . . 0.0 107.66 152.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' P' P ' 148' ' ' LEU . . . . . 0.98 HD13 ' CD1' ' P' ' 146' ' ' ILE . 8.3 mt -95.18 173.82 7.37 Favored 'General case' 0 C--N 1.396 2.594 0 CA-C-N 111.353 -2.658 . . . . 0.0 109.083 166.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 149' ' ' THR . . . . . 0.472 ' O ' ' N ' ' P' ' 152' ' ' GLN . 16.6 p -89.16 148.22 40.32 Favored Pre-proline 0 CA--C 1.586 2.349 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 164.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 150' ' ' PRO . . . . . 0.599 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 86.6 Cg_exo -50.36 -51.99 9.89 Favored 'Trans proline' 0 C--N 1.408 3.69 0 C-N-CA 123.48 2.787 . . . . 0.0 113.543 -169.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -11.59 3.6 Favored 'General case' 0 C--N 1.388 2.252 0 CA-C-N 113.341 -1.754 . . . . 0.0 110.782 175.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 152' ' ' GLN . . . . . 0.495 ' HB2' ' HB3' ' P' ' 148' ' ' LEU . 43.6 mt-30 -86.31 -30.55 22.17 Favored 'General case' 0 C--O 1.279 2.656 0 CA-C-N 120.0 1.273 . . . . 0.0 108.443 167.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 153' ' ' VAL . . . . . 0.752 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.4 t -63.52 -72.93 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.38 1.919 0 CA-C-N 123.534 2.879 . . . . 0.0 109.779 163.159 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 154' ' ' LYS . . . . . 0.927 ' HG3' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -32.43 -56.11 0.34 Allowed 'General case' 0 C--N 1.385 2.117 0 C-N-CA 124.358 1.063 . . . . 0.0 110.822 -176.68 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.81 -45.13 95.12 Favored 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 113.549 -1.66 . . . . 0.0 108.937 -171.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 156' ' ' TRP . . . . . 0.782 ' HB3' HD21 ' P' ' 124' ' ' LEU . 2.7 t90 -62.97 -31.54 72.67 Favored 'General case' 0 C--N 1.381 1.947 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.06 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 157' ' ' PHE . . . . . 0.752 ' CD2' HG11 ' P' ' 153' ' ' VAL . 66.0 m-85 -74.87 -35.57 62.32 Favored 'General case' 0 C--O 1.279 2.623 0 O-C-N 121.275 -0.89 . . . . 0.0 111.819 170.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 158' ' ' GLN . . . . . 0.549 ' N ' ' O ' ' P' ' 154' ' ' LYS . 33.0 mt-30 -56.96 -62.76 1.52 Allowed 'General case' 0 C--N 1.378 1.817 0 O-C-N 119.047 -2.283 . . . . 0.0 106.802 169.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -56.65 -24.91 51.71 Favored 'General case' 0 C--N 1.393 2.46 0 CA-C-O 117.062 -1.447 . . . . 0.0 109.525 -166.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' P' P ' 160' ' ' HIS . . . . . 0.545 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.1 t60 -74.38 -49.19 23.67 Favored 'General case' 0 C--O 1.283 2.835 0 CA-C-N 121.463 1.938 . . . . 0.0 109.914 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' P' P ' 161' ' ' ARG . . . . . 0.44 ' HD2' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.003 0 CA-C-N 122.19 2.268 . . . . 0.0 109.527 -160.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.556 3.755 0 N19-C1'-C2' 119.613 3.383 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.593 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.561 3.299 1 P-O3'-C3' 124.761 4.218 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.593 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.861 0 C2'-C3'-O3' 116.949 2.352 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.634 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.337 0 P-O3'-C3' 122.852 2.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.534 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.88 1 P-O3'-C3' 125.527 4.856 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.517 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.977 0 N19-C1'-C2' 118.986 2.992 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.957 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.627 1 P-O3'-C3' 125.268 4.64 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.957 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.449 0 P-O3'-C3' 123.177 2.897 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.639 " H5'" ' HE2' ' P' ' 111' ' ' LYS . . . . . . . . 0 C5'--C4' 1.538 3.378 0 O4'-C4'-C3' 108.452 2.852 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.591 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.858 0 P-O3'-C3' 123.228 2.94 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.573 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.46 0 O4'-C4'-C3' 108.412 2.812 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . 0.413 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.437 1 P-O3'-C3' 125.018 4.432 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.497 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.578 0 O4'-C4'-C3' 108.387 2.787 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.833 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.691 0 C2'-C3'-O3' 116.666 2.247 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.904 ' N9 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.832 1 O4'-C1'-N19 111.396 4.494 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.904 ' H72' ' N9 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.452 0 C3'-C2'-C1' 106.442 2.673 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.752 0 O5'-C5'-C4' 115.063 3.473 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.5 ' C4 ' ' N6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.617 1 P-O3'-C3' 125.071 4.476 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.5 ' N6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.358 0 O4'-C4'-C3' 108.201 2.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.418 " H1'" ' N3 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.454 0 O4'-C4'-C3' 108.208 2.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.558 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.571 4.291 0 O4'-C1'-N19 105.244 -3.195 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.558 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.481 1 P-O3'-C3' 127.073 6.144 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.573 ' C2 ' ' C2 ' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.635 0 O4'-C4'-C3' 107.991 2.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.535 ' C2 ' ' N3 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.74 0 P-O3'-C3' 123.929 3.524 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.448 " C5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.728 0 P-O3'-C3' 124.109 3.674 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.52 " C2'" ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.182 0 N19-C1'-C2' 119.066 3.041 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.615 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.683 0 P-O3'-C3' 123.472 3.143 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.615 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.562 0 C4'-C3'-C2' 100.642 -2.558 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.634 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.633 0 P-O3'-C3' 124.11 3.675 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.594 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.346 0 O4'-C4'-C3' 108.09 2.49 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.594 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.646 0 O4'-C4'-C3' 108.348 2.748 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . 0.476 ' C2 ' ' N2 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.891 0 O4'-C1'-N19 109.315 1.894 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.528 3.462 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.6 m -178.25 136.93 0.17 Allowed 'General case' 0 C--N 1.382 2.008 0 CA-C-N 113.674 -1.603 . . . . 0.0 108.654 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 170.01 -38.31 0.0 OUTLIER 'General case' 0 C--N 1.388 2.268 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.023 -171.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . 116.86 -90.29 0.51 Allowed Glycine 0 C--N 1.381 3.065 0 N-CA-C 108.92 -1.672 . . . . 0.0 108.92 -162.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.791 HD12 ' HD2' ' P' ' 106' ' ' PRO . 0.6 OUTLIER 170.89 149.44 0.17 Allowed Pre-proline 0 CA--C 1.581 2.159 0 CA-C-N 113.663 -1.268 . . . . 0.0 108.689 -166.167 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.791 ' HD2' HD12 ' P' ' 105' ' ' LEU . 73.3 Cg_exo -50.28 92.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.396 3.069 0 C-N-CA 122.777 2.318 . . . . 0.0 110.315 155.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -141.59 146.46 36.3 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-O 122.392 1.091 . . . . 0.0 109.183 162.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.861 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -157.56 54.86 0.49 Allowed 'General case' 0 C--N 1.381 1.976 0 CA-C-N 113.701 -1.591 . . . . 0.0 108.091 -169.304 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.497 ' HB3' ' HE3' ' P' ' 109' ' ' LYS . 0.0 OUTLIER -84.92 168.39 15.06 Favored 'General case' 0 C--N 1.38 1.923 0 CA-C-N 113.623 -1.626 . . . . 0.0 108.829 -155.215 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.861 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.7 OUTLIER -144.18 100.97 3.64 Favored 'General case' 0 C--N 1.381 1.966 0 CA-C-N 113.98 -1.463 . . . . 0.0 108.873 -155.185 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.639 ' HE2' " H5'" ' A' ' 9' ' ' ' DG' . 0.3 OUTLIER -104.97 95.93 6.19 Favored 'General case' 0 C--N 1.381 1.94 0 CA-C-N 113.654 -1.612 . . . . 0.0 107.452 170.491 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . 0.4 ' HA ' " H4'" ' B' ' 28' ' ' ' DA' . 0.0 OUTLIER -81.21 146.63 30.38 Favored 'General case' 0 C--N 1.378 1.817 0 CA-C-N 113.149 -1.841 . . . . 0.0 106.827 160.696 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 1.02 ' CD ' HD23 ' P' ' 115' ' ' LEU . 1.3 ttm180 -59.68 117.88 5.47 Favored 'General case' 0 C--N 1.388 2.277 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 -166.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.455 HG12 ' O ' ' P' ' 114' ' ' VAL . 11.7 p -107.12 58.85 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.023 0 CA-C-O 124.948 2.309 . . . . 0.0 108.018 -154.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 1.02 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.07 136.06 38.64 Favored 'General case' 0 C--N 1.39 2.366 0 CA-C-N 111.232 -2.713 . . . . 0.0 109.963 -155.328 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.668 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.0 OUTLIER -90.28 145.76 24.74 Favored 'General case' 0 C--N 1.381 1.966 0 CA-C-N 113.499 -1.682 . . . . 0.0 108.461 178.382 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -68.14 147.53 52.17 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -174.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -43.96 -37.16 2.77 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 112.824 -1.989 . . . . 0.0 109.165 -177.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.5 -65.26 0.6 Allowed 'General case' 0 C--N 1.383 2.024 0 CA-C-O 124.071 1.891 . . . . 0.0 109.279 174.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.531 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.6 mt-30 -48.24 -49.58 32.7 Favored 'General case' 0 C--N 1.382 1.991 0 CA-C-N 112.56 -2.109 . . . . 0.0 109.394 175.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.528 ' HA ' HD13 ' P' ' 124' ' ' LEU . 22.6 m -49.07 -55.76 11.14 Favored 'General case' 0 C--N 1.382 1.987 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 170.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.685 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.19 -46.1 68.85 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-O 122.504 1.145 . . . . 0.0 110.224 -169.47 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.837 ' HG3' HG23 ' P' ' 146' ' ' ILE . 0.1 OUTLIER -66.16 -40.05 90.23 Favored 'General case' 0 C--N 1.379 1.883 0 CA-C-N 113.983 -1.462 . . . . 0.0 107.927 179.102 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.986 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -61.02 -48.68 80.65 Favored 'General case' 0 C--N 1.385 2.139 0 O-C-N 120.484 -1.385 . . . . 0.0 110.226 172.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.507 ' O ' ' N ' ' P' ' 129' ' ' ARG . 26.0 mt-10 -53.17 -56.12 18.86 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 122.191 0.996 . . . . 0.0 108.598 175.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.685 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.53 -62.0 0.74 Allowed 'General case' 0 C--N 1.379 1.855 0 CA-C-N 112.172 -2.285 . . . . 0.0 108.705 179.113 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.661 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.4 OUTLIER -66.85 -30.51 70.71 Favored 'General case' 0 C--N 1.395 2.571 0 CA-C-N 112.233 -2.258 . . . . 0.0 108.282 -170.63 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.812 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.4 t80 -69.74 -50.82 39.77 Favored 'General case' 0 C--N 1.387 2.232 0 O-C-N 121.067 -1.021 . . . . 0.0 110.96 171.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.507 ' N ' ' O ' ' P' ' 125' ' ' GLU . 0.4 OUTLIER -62.26 -12.01 18.13 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-N 113.338 -1.755 . . . . 0.0 108.177 -167.218 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -102.66 -43.33 5.63 Favored 'General case' 0 C--N 1.381 1.945 0 CA-C-O 123.985 1.85 . . . . 0.0 107.258 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.476 ' HG2' ' CD2' ' P' ' 134' ' ' LEU . 2.8 tp-100 -151.69 128.74 11.08 Favored 'General case' 0 C--N 1.387 2.209 0 CA-C-N 111.608 -2.542 . . . . 0.0 110.822 -154.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -79.33 -27.94 42.08 Favored 'General case' 0 C--N 1.389 2.29 0 CA-C-N 112.003 -2.362 . . . . 0.0 111.46 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.572 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 9.2 m-85 -158.66 114.48 2.65 Favored 'General case' 0 C--N 1.377 1.79 0 CA-C-O 122.679 1.228 . . . . 0.0 109.009 -150.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.709 HD21 ' HG3' ' P' ' 138' ' ' GLU . 36.6 mt -122.92 136.08 54.73 Favored 'General case' 0 C--N 1.404 2.957 0 CA-C-N 114.393 -1.276 . . . . 0.0 108.267 -160.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.11 155.79 26.09 Favored 'General case' 0 C--N 1.383 2.025 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 166.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.558 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.34 -49.86 90.43 Favored Pre-proline 0 CA--C 1.584 2.269 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -161.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.558 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 84.1 Cg_exo -57.87 -28.89 84.38 Favored 'Trans proline' 0 C--N 1.4 3.277 0 C-N-CA 121.122 1.215 . . . . 0.0 114.932 -174.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.709 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -53.92 -71.36 0.08 Allowed 'General case' 0 C--N 1.38 1.9 0 CA-C-O 124.606 2.146 . . . . 0.0 106.44 160.782 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.894 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.96 -38.69 79.57 Favored 'General case' 0 C--N 1.39 2.334 0 CA-C-N 109.828 -3.351 . . . . 0.0 108.785 -155.33 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.643 ' O ' ' N ' ' P' ' 144' ' ' SER . 5.6 mt-10 -52.84 -39.58 62.63 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 122.849 1.309 . . . . 0.0 108.183 177.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . 0.411 ' HA ' ' HB3' ' P' ' 144' ' ' SER . 2.1 t-160 -64.83 -36.47 84.44 Favored 'General case' 0 C--N 1.379 1.879 0 CA-C-N 112.926 -1.943 . . . . 0.0 108.562 -170.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.63 ' O ' HG21 ' P' ' 146' ' ' ILE . 3.2 tp -64.84 -43.2 93.83 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-O 123.104 1.431 . . . . 0.0 109.116 167.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.598 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -57.31 -32.43 66.67 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 112.597 -2.092 . . . . 0.0 108.45 175.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.643 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.4 OUTLIER -73.71 -44.91 55.17 Favored 'General case' 0 C--N 1.386 2.158 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.552 -178.07 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 78.5 mt -67.26 -42.84 83.24 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-O 124.598 2.142 . . . . 0.0 108.349 -163.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.975 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -101.82 -13.01 8.55 Favored 'Isoleucine or valine' 0 C--N 1.389 2.292 0 CA-C-N 111.05 -2.796 . . . . 0.0 107.817 -167.081 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 82.13 34.7 0.08 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-O 125.597 2.618 . . . . 0.0 107.98 152.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.975 HD13 ' CD1' ' P' ' 146' ' ' ILE . 8.4 mt -96.28 170.04 9.52 Favored 'General case' 0 C--N 1.397 2.633 0 CA-C-N 111.556 -2.565 . . . . 0.0 109.468 170.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.651 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.4 p -91.21 139.71 25.61 Favored Pre-proline 0 CA--C 1.592 2.58 0 CA-C-O 122.729 1.252 . . . . 0.0 108.718 169.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.5 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 16.2 Cg_exo -56.03 -33.9 90.89 Favored 'Trans proline' 1 C--N 1.415 4.075 0 C-N-CA 122.727 2.284 . . . . 0.0 113.114 -159.829 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 151' ' ' THR . . . . . 0.463 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -57.29 -37.57 72.62 Favored 'General case' 0 C--N 1.383 2.045 0 C-N-CA 119.534 -0.866 . . . . 0.0 109.807 166.673 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.651 ' N ' ' O ' ' P' ' 149' ' ' THR . 49.0 mt-30 -68.51 -28.48 67.04 Favored 'General case' 0 C--N 1.387 2.225 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 -175.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.547 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.1 t -64.53 -70.31 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.193 0 CA-C-N 121.183 1.811 . . . . 0.0 109.517 165.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.894 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.95 -58.59 0.44 Allowed 'General case' 0 C--N 1.384 2.106 0 C-N-CA 125.013 1.325 . . . . 0.0 110.959 -178.143 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.542 HD12 ' OE1' ' P' ' 158' ' ' GLN . 33.4 mm -60.19 -39.33 80.29 Favored 'Isoleucine or valine' 0 C--N 1.382 1.989 0 CA-C-N 113.106 -1.861 . . . . 0.0 109.114 -172.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.986 ' HB3' HD21 ' P' ' 124' ' ' LEU . 3.8 t90 -67.21 -32.08 72.9 Favored 'General case' 0 C--N 1.382 2.003 0 O-C-N 121.373 -0.829 . . . . 0.0 109.088 172.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.812 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 49.2 m-85 -74.66 -40.72 61.28 Favored 'General case' 0 C--O 1.273 2.337 0 O-C-N 120.927 -1.108 . . . . 0.0 111.972 173.495 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.542 ' OE1' HD12 ' P' ' 155' ' ' ILE . 77.8 mt-30 -52.37 -58.14 7.63 Favored 'General case' 0 C--N 1.377 1.778 0 O-C-N 119.771 -1.831 . . . . 0.0 106.765 170.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -55.84 -25.62 42.85 Favored 'General case' 0 C--N 1.388 2.27 0 CA-C-O 117.709 -1.138 . . . . 0.0 109.659 -168.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.555 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 2.1 t60 -79.75 -42.89 23.61 Favored 'General case' 0 C--O 1.286 2.992 0 CA-C-N 121.526 1.967 . . . . 0.0 111.878 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.71 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -67.53 -35.4 79.02 Favored 'General case' 0 C--O 1.267 2.003 0 CA-C-N 123.57 2.896 . . . . 0.0 110.785 -167.35 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.568 ' HE2' ' CZ ' ' P' ' 166' ' ' ARG . 12.6 t80 -69.09 -37.96 78.71 Favored 'General case' 0 C--N 1.38 1.925 0 O-C-N 119.939 -1.726 . . . . 0.0 109.802 168.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.08 -36.81 84.82 Favored 'General case' 0 C--N 1.381 1.945 0 O-C-N 121.287 -0.883 . . . . 0.0 109.636 -167.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.71 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.6 OUTLIER -52.8 -59.84 4.0 Favored 'General case' 0 C--N 1.379 1.857 0 CA-C-O 125.179 2.419 . . . . 0.0 106.601 -175.37 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.45 ' HA ' ' HG3' ' P' ' 168' ' ' GLN . 8.2 mmmt -58.74 -44.76 90.57 Favored 'General case' 0 C--N 1.387 2.221 1 CA-C-N 108.203 -4.089 . . . . 0.0 107.866 -159.583 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . 0.568 ' CZ ' ' HE2' ' P' ' 162' ' ' TYR . 5.7 mtt180 -55.36 -47.46 75.72 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-N 112.348 -2.205 . . . . 0.0 110.641 177.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . 0.421 ' HB1' ' O ' ' P' ' 164' ' ' THR . . . -49.86 -37.66 31.98 Favored 'General case' 0 C--N 1.387 2.203 0 CA-C-O 123.347 1.546 . . . . 0.0 108.356 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . 0.45 ' HG3' ' HA ' ' P' ' 165' ' ' LYS . 0.8 OUTLIER -80.56 -23.2 40.1 Favored 'General case' 0 C--N 1.39 2.356 0 CA-C-N 111.884 -2.416 . . . . 0.0 109.447 -168.828 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -60.61 -33.2 72.4 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-O 122.55 1.167 . . . . 0.0 109.398 170.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.55 -39.21 90.26 Favored 'General case' 0 C--N 1.384 2.097 0 CA-C-N 113.772 -1.558 . . . . 0.0 108.117 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -89.89 88.96 7.53 Favored 'General case' 0 C--N 1.381 1.949 0 CA-C-N 113.819 -1.537 . . . . 0.0 109.182 -159.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 126.31 -79.47 0.37 Allowed Glycine 0 C--N 1.382 3.086 0 N-CA-C 108.947 -1.661 . . . . 0.0 108.947 -156.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 159.01 173.57 0.01 OUTLIER 'General case' 0 C--N 1.382 1.998 0 CA-C-N 113.517 -1.341 . . . . 0.0 109.969 156.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -81.33 51.29 1.6 Allowed 'General case' 0 C--N 1.381 1.949 0 CA-C-N 112.101 -2.318 . . . . 0.0 110.286 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -78.16 99.94 1.6 Allowed Glycine 0 C--N 1.383 3.166 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 -158.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -146.4 121.22 5.39 Favored Pre-proline 0 CA--C 1.58 2.101 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 -174.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 CA--C 1.594 3.483 0 C-N-CA 121.493 1.462 . . . . 0.0 111.641 169.992 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.64 0 N19-C1'-C2' 119.646 3.404 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.97 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.385 0 O4'-C4'-C3' 108.158 2.558 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.97 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.858 0 C2'-C3'-O3' 117.056 2.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.609 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.697 0 P-O3'-C3' 123.473 3.145 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.555 ' H71' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.95 0 N19-C1'-C2' 118.132 2.458 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.556 " C2'" ' C8 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.566 3.804 1 P-O3'-C3' 129.012 7.76 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.74 ' OP1' HD11 ' P' ' 115' ' ' LEU . . . . . . . . 0 C5'--C4' 1.539 3.538 2 P-O3'-C3' 130.556 9.047 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.604 H2'' " O5'" ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.719 0 C3'-C2'-C1' 107.312 3.294 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.604 " O5'" H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.375 0 O4'-C4'-C3' 108.183 2.583 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.603 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.791 0 C2'-C3'-O3' 116.717 2.265 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.516 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.345 0 P-O3'-C3' 122.672 2.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . 0.466 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.352 0 O4'-C4'-C3' 107.96 2.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.5 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.568 0 O4'-C4'-C3' 108.211 2.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.5 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.551 0 P-O3'-C3' 124.437 3.947 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.959 ' C4 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.541 3.749 1 O4'-C1'-N19 111.35 4.438 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.959 ' H72' ' C4 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.636 0 O4'-C1'-N19 109.728 2.41 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . 0.436 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.634 0 O5'-C5'-C4' 115.071 3.479 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.436 " H5'" H2'' ' B' ' 17' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.951 0 O4'-C4'-C3' 108.207 2.607 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.458 0 O4'-C4'-C3' 108.234 2.634 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.512 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.298 0 O4'-C4'-C3' 108.017 2.417 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.695 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.572 4.375 0 N19-C1'-C2' 119.049 3.031 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.695 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.53 0 P-O3'-C3' 123.069 2.808 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.658 ' OP2' ' HD1' ' P' ' 162' ' ' TYR . . . . . . . . 0 C5'--C4' 1.538 3.352 0 C3'-C2'-C1' 107.035 3.096 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.749 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 P-O3'-C3' 123.666 3.305 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.749 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.176 0 C2'-C3'-O3' 117.179 2.437 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.531 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.225 0 P-O3'-C3' 123.967 3.556 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.531 ' C8 ' H2'' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.554 3.568 0 P-O3'-C3' 123.603 3.253 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.526 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.348 0 C3'-C2'-C1' 105.732 2.166 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.609 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.592 0 O4'-C4'-C3' 108.313 2.713 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.441 0 O4'-C4'-C3' 108.149 2.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.537 0 P-O3'-C3' 123.627 3.272 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . 0.472 ' C2 ' ' N2 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.829 0 O4'-C1'-N19 109.356 1.944 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.478 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.73 -59.4 1.75 Allowed 'General case' 0 C--N 1.381 1.977 0 CA-C-N 113.705 -1.589 . . . . 0.0 108.641 -176.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 169.96 23.32 0.0 OUTLIER 'General case' 0 C--N 1.395 2.559 0 CA-C-N 113.403 -1.726 . . . . 0.0 109.432 -169.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . 145.7 -118.6 1.1 Allowed Glycine 0 C--N 1.38 2.994 0 N-CA-C 108.815 -1.714 . . . . 0.0 108.815 -161.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.928 HD12 ' HD2' ' P' ' 106' ' ' PRO . 0.1 OUTLIER -172.17 154.88 3.43 Favored Pre-proline 0 CA--C 1.581 2.16 0 CA-C-N 113.717 -1.242 . . . . 0.0 108.573 177.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.928 ' HD2' HD12 ' P' ' 105' ' ' LEU . 66.8 Cg_exo -48.93 92.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.111 0 C-N-CA 122.854 2.37 . . . . 0.0 110.399 155.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -147.13 126.8 13.36 Favored 'General case' 0 C--N 1.38 1.92 0 CA-C-O 122.422 1.106 . . . . 0.0 109.178 159.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 22.5 mtmm -98.2 43.9 1.05 Allowed 'General case' 0 C--N 1.381 1.964 0 CA-C-N 113.705 -1.589 . . . . 0.0 107.853 175.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.456 ' HG3' ' N ' ' P' ' 110' ' ' ARG . 0.6 OUTLIER -94.45 162.49 13.8 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 113.35 -1.75 . . . . 0.0 109.821 175.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.456 ' N ' ' HG3' ' P' ' 109' ' ' LYS . 34.9 mmt-85 -118.75 -155.97 0.63 Allowed 'General case' 0 C--N 1.378 1.835 0 CA-C-N 113.723 -1.58 . . . . 0.0 107.231 -164.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.578 ' HG2' ' O ' ' P' ' 111' ' ' LYS . 0.1 OUTLIER -140.18 116.89 10.9 Favored 'General case' 0 C--N 1.383 2.055 0 CA-C-N 112.06 -2.337 . . . . 0.0 108.026 176.326 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . 0.425 ' HA ' " H4'" ' B' ' 28' ' ' ' DA' . 3.3 mtp85 -76.5 150.48 36.63 Favored 'General case' 0 C--N 1.382 1.996 0 CA-C-N 113.656 -1.611 . . . . 0.0 108.037 154.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.982 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.3 OUTLIER -73.27 115.52 12.72 Favored 'General case' 0 C--N 1.387 2.201 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 -165.663 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.531 HG12 ' OP1' ' A' ' 8' ' ' ' DA' . 13.9 p -107.82 59.09 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.048 0 CA-C-O 124.961 2.315 . . . . 0.0 108.012 -154.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.982 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.24 141.8 39.84 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 111.093 -2.776 . . . . 0.0 109.941 -155.433 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.52 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.1 m-85 -92.25 145.57 24.39 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 113.703 -1.59 . . . . 0.0 108.51 -178.167 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.03 148.1 51.48 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -174.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -44.02 -37.19 2.84 Favored 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.084 -1.871 . . . . 0.0 109.187 -178.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.58 -62.15 1.84 Allowed 'General case' 0 C--N 1.382 2.011 0 CA-C-O 124.036 1.874 . . . . 0.0 109.394 175.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.539 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 81.6 mt-30 -52.96 -48.16 67.58 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-N 112.617 -2.083 . . . . 0.0 109.587 177.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.59 ' HA ' HD13 ' P' ' 124' ' ' LEU . 16.0 m -49.33 -55.81 11.61 Favored 'General case' 0 C--N 1.384 2.093 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 169.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.546 ' CE1' ' CZ ' ' P' ' 126' ' ' ARG . 2.9 t80 -53.11 -48.11 68.08 Favored 'General case' 0 C--N 1.382 2.018 0 CA-C-O 122.628 1.204 . . . . 0.0 109.949 -169.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 1.016 ' CD ' HG23 ' P' ' 146' ' ' ILE . 4.2 mt-10 -66.02 -38.11 87.6 Favored 'General case' 0 C--N 1.378 1.807 0 CA-C-N 113.979 -1.464 . . . . 0.0 107.604 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.798 HD21 ' HB3' ' P' ' 156' ' ' TRP . 3.1 mt -60.76 -50.3 74.03 Favored 'General case' 0 C--N 1.385 2.114 0 O-C-N 120.658 -1.276 . . . . 0.0 110.062 171.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.557 ' O ' ' N ' ' P' ' 129' ' ' ARG . 15.5 mt-10 -54.3 -53.65 50.89 Favored 'General case' 0 C--N 1.379 1.887 0 CA-C-O 122.477 1.132 . . . . 0.0 109.014 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.546 ' CZ ' ' CE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.94 -65.04 0.43 Allowed 'General case' 0 C--N 1.379 1.886 0 CA-C-N 111.96 -2.382 . . . . 0.0 108.76 177.46 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.895 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -63.78 -32.7 74.29 Favored 'General case' 0 C--N 1.394 2.519 0 CA-C-N 112.405 -2.18 . . . . 0.0 108.34 -170.794 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.762 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 7.3 t80 -68.76 -51.01 45.77 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-O 121.973 0.892 . . . . 0.0 110.373 173.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.557 ' N ' ' O ' ' P' ' 125' ' ' GLU . 8.9 mmm180 -62.36 -12.21 19.94 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.306 -1.77 . . . . 0.0 108.198 -165.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -107.75 -40.97 5.13 Favored 'General case' 0 C--N 1.379 1.878 0 C-N-CA 126.234 1.814 . . . . 0.0 107.626 -172.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.491 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.4 OUTLIER -156.11 97.89 1.83 Allowed 'General case' 0 C--N 1.387 2.22 0 CA-C-N 111.952 -2.385 . . . . 0.0 110.263 -153.164 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . 0.52 ' HD3' ' CD2' ' P' ' 133' ' ' TYR . 0.1 OUTLIER -76.98 -6.91 54.47 Favored 'General case' 0 C--N 1.394 2.501 0 CA-C-N 112.035 -2.348 . . . . 0.0 110.97 -163.968 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.563 ' CD1' ' CZ ' ' P' ' 161' ' ' ARG . 4.0 m-85 -161.6 112.42 1.68 Allowed 'General case' 0 C--N 1.381 1.946 0 CA-C-N 114.671 -1.15 . . . . 0.0 108.511 -154.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.702 HD12 ' HD3' ' P' ' 127' ' ' ARG . 30.3 mt -130.64 136.02 48.43 Favored 'General case' 0 C--N 1.396 2.599 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -156.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.52 156.11 25.43 Favored 'General case' 0 C--N 1.381 1.959 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 167.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.558 ' HB2' ' HD3' ' P' ' 137' ' ' PRO . . . -59.36 -50.2 88.65 Favored Pre-proline 0 CA--C 1.582 2.185 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -162.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.558 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 89.3 Cg_exo -57.23 -29.83 85.15 Favored 'Trans proline' 0 C--N 1.401 3.323 0 C-N-CA 120.836 1.024 . . . . 0.0 114.624 -174.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.642 ' HG3' HD21 ' P' ' 134' ' ' LEU . 1.6 mm-40 -54.29 -71.41 0.08 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-O 124.26 1.981 . . . . 0.0 106.48 161.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.922 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.56 -34.52 74.31 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 110.008 -3.269 . . . . 0.0 109.026 -155.35 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.607 ' O ' ' N ' ' P' ' 144' ' ' SER . 7.4 mt-10 -52.3 -43.77 64.67 Favored 'General case' 0 C--N 1.38 1.908 0 CA-C-O 123.356 1.551 . . . . 0.0 108.03 174.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -63.27 -36.3 83.2 Favored 'General case' 0 C--N 1.38 1.911 0 CA-C-N 112.406 -2.179 . . . . 0.0 108.738 -168.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.895 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.1 tp -66.24 -42.8 88.09 Favored 'General case' 0 C--N 1.383 2.063 0 CA-C-O 122.987 1.375 . . . . 0.0 109.167 170.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.604 ' HB1' ' HA ' ' P' ' 150' ' ' PRO . . . -56.52 -34.58 67.16 Favored 'General case' 0 C--N 1.387 2.224 0 CA-C-N 112.742 -2.026 . . . . 0.0 108.183 172.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.607 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -71.38 -42.61 68.2 Favored 'General case' 0 C--N 1.388 2.263 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.395 -178.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 80.9 mt -68.63 -46.54 68.94 Favored 'General case' 0 C--N 1.38 1.917 0 CA-C-O 124.682 2.182 . . . . 0.0 108.226 -163.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 1.016 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -96.53 -13.01 8.27 Favored 'Isoleucine or valine' 0 C--N 1.389 2.302 0 CA-C-N 110.926 -2.852 . . . . 0.0 107.967 -168.366 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 82.18 35.5 0.07 Allowed 'General case' 0 C--N 1.381 1.956 0 CA-C-O 125.721 2.677 . . . . 0.0 107.652 152.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.986 HD13 ' CD1' ' P' ' 146' ' ' ILE . 8.6 mt -95.61 172.72 7.88 Favored 'General case' 0 C--N 1.397 2.635 0 CA-C-N 111.45 -2.614 . . . . 0.0 109.133 168.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.588 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.0 p -90.61 141.47 27.15 Favored Pre-proline 0 CA--C 1.589 2.462 0 CA-C-O 122.797 1.284 . . . . 0.0 108.267 166.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.604 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 0.4 OUTLIER -48.29 -47.0 21.13 Favored 'Trans proline' 0 C--N 1.405 3.502 0 C-N-CA 124.954 3.769 . . . . 0.0 115.424 -167.533 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 151' ' ' THR . . . . . 0.487 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -52.86 -31.03 37.13 Favored 'General case' 0 C--N 1.384 2.073 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.07 169.327 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.588 ' N ' ' O ' ' P' ' 149' ' ' THR . 46.8 mt-30 -74.66 -27.94 60.64 Favored 'General case' 0 C--N 1.392 2.42 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.757 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -64.15 -70.94 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.024 0 CA-C-N 122.116 2.235 . . . . 0.0 109.513 162.76 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.922 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.77 -59.57 0.4 Allowed 'General case' 0 C--N 1.387 2.199 0 CA-C-O 122.728 1.251 . . . . 0.0 110.583 -176.497 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.415 HG22 " H5'" ' A' ' 8' ' ' ' DA' . 13.4 mm -56.2 -43.03 75.19 Favored 'Isoleucine or valine' 0 C--N 1.383 2.029 0 CA-C-N 112.995 -1.911 . . . . 0.0 109.112 -174.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.798 ' HB3' HD21 ' P' ' 124' ' ' LEU . 4.6 t90 -67.23 -31.58 72.04 Favored 'General case' 0 C--N 1.383 2.033 0 O-C-N 120.876 -1.14 . . . . 0.0 109.324 174.107 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.762 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 44.6 m-85 -75.55 -41.98 53.5 Favored 'General case' 0 C--O 1.275 2.406 0 O-C-N 121.053 -1.029 . . . . 0.0 111.888 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' P' ' 154' ' ' LYS . 51.4 mt-30 -49.5 -59.67 3.54 Favored 'General case' 0 C--N 1.378 1.826 0 O-C-N 119.296 -2.127 . . . . 0.0 107.005 169.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -55.83 -25.0 39.74 Favored 'General case' 0 C--N 1.389 2.295 0 CA-C-O 117.713 -1.137 . . . . 0.0 109.386 -166.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.542 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.6 OUTLIER -76.5 -46.84 24.97 Favored 'General case' 0 C--O 1.282 2.801 0 CA-C-N 121.213 1.824 . . . . 0.0 111.286 175.359 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.703 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -66.66 -35.35 79.94 Favored 'General case' 0 C--N 1.378 1.841 0 CA-C-N 122.985 2.629 . . . . 0.0 110.543 -161.654 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.658 ' HD1' ' OP2' ' B' ' 23' ' ' ' DA' . 82.0 t80 -68.86 -36.2 77.84 Favored 'General case' 0 C--N 1.38 1.929 0 O-C-N 120.135 -1.603 . . . . 0.0 109.652 171.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -65.05 -40.33 94.59 Favored 'General case' 0 C--N 1.381 1.965 0 O-C-N 121.668 -0.645 . . . . 0.0 109.293 -169.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.703 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.6 OUTLIER -53.71 -60.3 3.5 Favored 'General case' 0 C--N 1.379 1.873 0 CA-C-O 125.199 2.428 . . . . 0.0 106.484 -172.492 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.424 ' HA ' ' HG3' ' P' ' 168' ' ' GLN . 9.9 mmmt -58.91 -46.61 87.48 Favored 'General case' 0 C--N 1.388 2.247 1 CA-C-N 108.208 -4.087 . . . . 0.0 108.285 -163.668 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . 0.534 ' HG3' ' CZ ' ' P' ' 162' ' ' TYR . 2.0 ttt180 -45.2 -49.52 12.15 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-N 112.798 -2.001 . . . . 0.0 111.505 173.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.4 -33.41 72.44 Favored 'General case' 0 C--N 1.381 1.95 0 CA-C-N 113.59 -1.641 . . . . 0.0 108.595 -174.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . 0.424 ' HG3' ' HA ' ' P' ' 165' ' ' LYS . 0.0 OUTLIER -81.34 -21.56 39.07 Favored 'General case' 0 C--N 1.387 2.206 0 CA-C-N 111.908 -2.405 . . . . 0.0 109.603 -174.073 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -54.73 -32.97 60.46 Favored 'General case' 0 C--N 1.383 2.04 0 CA-C-O 123.189 1.471 . . . . 0.0 109.559 167.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.07 -27.99 64.03 Favored 'General case' 0 C--N 1.386 2.179 0 CA-C-N 112.838 -1.983 . . . . 0.0 109.257 -163.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 4.7 mttt -87.13 105.31 17.1 Favored 'General case' 0 C--N 1.379 1.862 0 CA-C-N 113.55 -1.659 . . . . 0.0 107.985 -167.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 46.06 76.3 0.14 Allowed Glycine 0 CA--C 1.563 3.047 0 N-CA-C 108.558 -1.817 . . . . 0.0 108.558 -153.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . 0.251 37.5 m-85 -29.72 144.66 0.01 OUTLIER 'General case' 0 C--N 1.389 2.295 0 CA-C-O 123.966 1.841 . . . . 0.0 109.431 168.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.46 55.3 3.44 Favored 'General case' 0 C--N 1.392 2.415 0 CA-C-N 111.042 -2.799 . . . . 0.0 109.218 176.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -63.93 100.97 0.43 Allowed Glycine 0 C--N 1.38 2.999 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 -166.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . 0.512 ' CG ' ' HD2' ' P' ' 177' ' ' PRO . 1.6 t-80 -137.74 164.69 39.42 Favored Pre-proline 0 CA--C 1.58 2.104 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 -161.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . 0.512 ' HD2' ' CG ' ' P' ' 176' ' ' HIS . 65.9 Cg_exo . . . . . 0 CA--C 1.594 3.51 0 C-N-CA 121.503 1.469 . . . . 0.0 111.568 161.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.792 0 O5'-C5'-C4' 114.37 2.978 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.785 " C2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.366 1 P-O3'-C3' 127.271 6.309 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.785 ' H72' " C2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.901 0 C2'-C3'-O3' 117.014 2.376 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.637 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.561 0 P-O3'-C3' 123.556 3.213 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.529 ' C2 ' ' C2 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.841 0 N19-C1'-C2' 118.473 2.671 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.549 ' C5 ' ' N6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.035 0 C3'-C2'-C1' 106.804 2.931 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.97 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.67 1 P-O3'-C3' 126.862 5.968 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.97 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.2 0 P-O3'-C3' 123.76 3.383 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.882 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.554 0 P-O3'-C3' 123.805 3.421 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.607 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.834 0 P-O3'-C3' 123.608 3.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.48 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.556 0 O4'-C4'-C3' 108.521 2.921 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . 0.456 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.315 1 P-O3'-C3' 125.049 4.457 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.503 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.624 0 O4'-C4'-C3' 108.375 2.775 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.503 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.638 0 P-O3'-C3' 122.638 2.448 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.526 ' C8 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.543 3.955 1 O4'-C1'-N19 111.58 4.725 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.526 ' H72' ' C8 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.546 0 P-O3'-C3' 122.199 2.083 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.785 0 O5'-C5'-C4' 115.079 3.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.599 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.666 1 P-O3'-C3' 126.96 6.05 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.599 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.482 0 P-O3'-C3' 123.182 2.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.506 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.464 0 P-O3'-C3' 123.185 2.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.692 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.571 4.311 0 N19-C1'-C2' 118.987 2.992 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.692 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.56 0 P-O3'-C3' 123.231 2.942 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.532 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.562 3.395 0 O4'-C4'-C3' 108.393 2.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.835 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.632 0 O4'-C4'-C3' 108.848 3.248 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.835 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.177 1 P-O3'-C3' 126.345 5.538 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.519 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C3'--C2' 1.559 4.135 0 N19-C1'-C2' 119.18 3.112 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.606 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.706 1 P-O3'-C3' 124.696 4.164 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.606 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.58 0 C4'-C3'-C2' 100.391 -2.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.637 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.554 1 P-O3'-C3' 124.767 4.223 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.375 0 O4'-C4'-C3' 107.915 2.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.541 0 O4'-C4'-C3' 108.195 2.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.857 0 P-O3'-C3' 122.007 1.922 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.518 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 29.6 m -106.37 74.04 1.0 Allowed 'General case' 0 C--N 1.381 1.969 0 CA-C-N 113.652 -1.613 . . . . 0.0 108.694 164.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 170.15 -38.34 0.0 OUTLIER 'General case' 0 C--N 1.389 2.303 0 CA-C-N 113.534 -1.666 . . . . 0.0 107.942 -168.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -104.9 94.28 1.0 Allowed Glycine 0 C--N 1.381 3.055 0 N-CA-C 108.94 -1.664 . . . . 0.0 108.94 -164.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.645 HD22 ' HD2' ' P' ' 106' ' ' PRO . 0.2 OUTLIER -86.52 -175.95 0.68 Allowed Pre-proline 0 CA--C 1.582 2.176 0 CA-C-N 113.662 -1.269 . . . . 0.0 108.788 173.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.645 ' HD2' HD22 ' P' ' 105' ' ' LEU . 96.2 Cg_exo -54.3 91.47 0.04 OUTLIER 'Trans proline' 0 C--N 1.397 3.081 0 C-N-CA 122.763 2.308 . . . . 0.0 110.314 155.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -126.81 -178.54 4.43 Favored 'General case' 0 C--N 1.382 2.018 0 CA-C-O 122.451 1.12 . . . . 0.0 109.176 167.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -95.56 98.76 10.75 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-N 113.675 -1.602 . . . . 0.0 108.136 171.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 1.042 ' HE3' ' CG ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -58.84 100.36 0.07 Allowed 'General case' 0 C--N 1.382 1.989 0 CA-C-N 113.662 -1.608 . . . . 0.0 109.089 -176.655 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 1.042 ' CG ' ' HE3' ' P' ' 109' ' ' LYS . 4.1 mmt85 71.26 98.37 0.07 Allowed 'General case' 0 C--N 1.411 3.247 0 CA-C-N 112.557 -2.111 . . . . 0.0 108.616 156.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.69 ' HD2' " O3'" ' A' ' 8' ' ' ' DA' . 0.7 OUTLIER -79.52 88.72 5.06 Favored 'General case' 0 C--N 1.384 2.097 0 CA-C-N 113.096 -1.866 . . . . 0.0 108.154 171.782 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . 0.443 ' HA ' " H4'" ' B' ' 28' ' ' ' DA' . 2.8 mtp85 -70.73 177.44 3.57 Favored 'General case' 0 C--N 1.393 2.459 0 CA-C-N 111.675 -2.511 . . . . 0.0 108.779 156.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.97 ' CG ' HD23 ' P' ' 115' ' ' LEU . 0.9 OUTLIER -84.93 119.04 24.91 Favored 'General case' 0 C--N 1.386 2.173 0 CA-C-N 113.614 -1.63 . . . . 0.0 106.897 168.846 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.429 HG12 ' O ' ' P' ' 114' ' ' VAL . 13.8 p -110.2 58.36 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.129 0 CA-C-O 124.972 2.32 . . . . 0.0 107.844 -155.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.97 HD23 ' CG ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.56 139.36 39.54 Favored 'General case' 0 C--N 1.391 2.379 0 CA-C-N 110.852 -2.885 . . . . 0.0 109.792 -155.465 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.571 ' HD1' HD23 ' P' ' 148' ' ' LEU . 0.9 OUTLIER -92.05 146.5 23.68 Favored 'General case' 0 C--N 1.381 1.942 0 CA-C-N 113.946 -1.479 . . . . 0.0 108.216 -178.123 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -65.95 147.53 53.21 Favored 'General case' 0 C--N 1.382 2.011 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 -172.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -42.65 -35.94 1.26 Allowed 'General case' 0 C--N 1.382 1.99 0 CA-C-N 113.547 -1.66 . . . . 0.0 109.594 -176.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.08 -68.12 0.21 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 124.078 1.894 . . . . 0.0 109.146 173.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.537 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 78.1 mt-30 -46.45 -50.58 16.62 Favored 'General case' 0 C--N 1.382 1.999 0 C-N-CA 127.166 2.186 . . . . 0.0 109.966 175.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.598 ' HA ' HD13 ' P' ' 124' ' ' LEU . 20.2 m -50.78 -57.26 8.82 Favored 'General case' 0 C--N 1.384 2.068 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 170.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.563 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.18 -46.25 68.87 Favored 'General case' 0 C--N 1.383 2.047 0 CA-C-O 122.329 1.061 . . . . 0.0 109.818 -170.217 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 1.013 ' CD ' HG23 ' P' ' 146' ' ' ILE . 6.5 mt-10 -66.86 -37.11 83.81 Favored 'General case' 0 C--N 1.379 1.872 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.496 178.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.847 HD21 ' HB3' ' P' ' 156' ' ' TRP . 3.2 mt -60.4 -51.24 70.34 Favored 'General case' 0 C--N 1.382 2.009 0 O-C-N 119.89 -1.756 . . . . 0.0 110.401 169.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.543 ' O ' ' N ' ' P' ' 129' ' ' ARG . 16.2 mt-10 -54.63 -52.88 60.89 Favored 'General case' 0 C--N 1.379 1.859 0 CA-C-O 122.434 1.111 . . . . 0.0 109.267 177.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.563 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -38.96 -67.62 0.2 Allowed 'General case' 0 C--N 1.379 1.891 0 CA-C-N 111.823 -2.444 . . . . 0.0 108.717 176.04 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.745 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.3 OUTLIER -62.28 -32.64 73.39 Favored 'General case' 0 C--N 1.393 2.462 0 CA-C-N 112.484 -2.144 . . . . 0.0 108.289 -170.117 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.829 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 12.6 t80 -68.8 -50.48 49.82 Favored 'General case' 0 C--N 1.388 2.247 0 CA-C-O 122.073 0.939 . . . . 0.0 110.77 174.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.543 ' N ' ' O ' ' P' ' 125' ' ' GLU . 8.6 mmm180 -62.33 -11.81 17.48 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.083 -1.871 . . . . 0.0 108.128 -167.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . 0.423 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 33.6 mt-30 -107.99 -40.46 5.23 Favored 'General case' 0 C--N 1.379 1.886 0 C-N-CA 126.378 1.871 . . . . 0.0 107.772 -172.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.495 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -155.19 102.48 2.3 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 111.943 -2.39 . . . . 0.0 109.501 -153.442 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . 0.718 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -77.15 -15.79 59.39 Favored 'General case' 0 C--N 1.387 2.205 0 CA-C-N 112.323 -2.217 . . . . 0.0 110.335 -165.629 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.814 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 2.6 m-30 -154.84 115.69 3.95 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.999 -1.455 . . . . 0.0 108.544 -158.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.665 HD12 ' HD3' ' P' ' 127' ' ' ARG . 21.1 mt -130.08 134.18 47.19 Favored 'General case' 0 C--N 1.398 2.717 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -157.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.2 154.11 25.62 Favored 'General case' 0 C--N 1.381 1.959 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 171.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.496 ' HA ' ' HG3' ' P' ' 139' ' ' ARG . . . -58.86 -45.89 99.58 Favored Pre-proline 0 CA--C 1.584 2.251 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -158.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.492 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 0.1 OUTLIER -52.55 -41.1 70.34 Favored 'Trans proline' 0 C--N 1.396 3.05 0 C-N-CA 122.631 2.22 . . . . 0.0 117.647 179.337 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.503 ' HG3' HD21 ' P' ' 134' ' ' LEU . 1.6 mm-40 -50.2 -69.45 0.11 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-O 123.509 1.623 . . . . 0.0 107.135 166.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.543 ' HD3' HG13 ' P' ' 153' ' ' VAL . 1.0 OUTLIER -69.12 -35.56 76.55 Favored 'General case' 0 C--N 1.389 2.291 0 CA-C-N 110.072 -3.24 . . . . 0.0 108.494 -158.339 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.629 ' O ' ' N ' ' P' ' 144' ' ' SER . 4.2 mt-10 -53.29 -41.05 65.21 Favored 'General case' 0 C--N 1.38 1.926 0 CA-C-O 123.112 1.434 . . . . 0.0 108.539 176.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -64.67 -35.8 82.2 Favored 'General case' 0 C--N 1.38 1.921 0 CA-C-N 112.81 -1.996 . . . . 0.0 108.804 -169.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.745 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.3 tp -65.64 -42.99 90.84 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-O 123.211 1.482 . . . . 0.0 109.198 168.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.598 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.9 -33.89 67.38 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.429 -2.169 . . . . 0.0 108.227 174.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.629 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.7 m -73.28 -42.72 62.12 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 113.699 -1.591 . . . . 0.0 109.752 -178.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 78.7 mt -66.62 -48.02 70.79 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 124.659 2.171 . . . . 0.0 108.318 -165.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 1.013 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -96.56 -12.84 8.31 Favored 'Isoleucine or valine' 0 C--N 1.389 2.322 0 CA-C-N 110.821 -2.9 . . . . 0.0 107.933 -167.11 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 82.44 35.03 0.07 Allowed 'General case' 0 C--N 1.381 1.939 0 CA-C-O 125.755 2.693 . . . . 0.0 107.865 152.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.988 HD13 ' CD1' ' P' ' 146' ' ' ILE . 8.8 mt -96.17 170.81 9.0 Favored 'General case' 0 C--N 1.397 2.659 0 CA-C-N 111.571 -2.559 . . . . 0.0 109.382 169.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.643 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.2 p -92.46 140.15 24.04 Favored Pre-proline 0 CA--C 1.592 2.566 0 CA-C-O 122.738 1.256 . . . . 0.0 108.752 170.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.518 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 21.4 Cg_exo -55.08 -33.48 83.79 Favored 'Trans proline' 1 C--N 1.415 4.036 0 C-N-CA 122.902 2.401 . . . . 0.0 113.815 -160.234 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.21 -38.26 73.46 Favored 'General case' 0 C--N 1.382 2.003 0 C-N-CA 119.084 -1.046 . . . . 0.0 109.442 166.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.643 ' N ' ' O ' ' P' ' 149' ' ' THR . 49.1 mt-30 -69.36 -28.4 66.17 Favored 'General case' 0 C--N 1.387 2.214 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 -174.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.645 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.1 t -64.2 -71.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.186 0 CA-C-N 121.394 1.906 . . . . 0.0 109.259 164.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.491 ' N ' HG13 ' P' ' 153' ' ' VAL . 0.0 OUTLIER -34.69 -58.46 0.5 Allowed 'General case' 0 C--N 1.384 2.093 0 C-N-CA 125.012 1.325 . . . . 0.0 110.54 -176.175 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 28.8 mm -60.65 -38.85 79.69 Favored 'Isoleucine or valine' 0 C--N 1.381 1.969 0 CA-C-N 113.328 -1.76 . . . . 0.0 108.859 -172.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.847 ' HB3' HD21 ' P' ' 124' ' ' LEU . 4.1 t90 -67.66 -31.88 72.17 Favored 'General case' 0 C--N 1.384 2.07 0 O-C-N 121.168 -0.957 . . . . 0.0 109.451 172.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.829 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 62.9 m-85 -75.18 -40.14 59.63 Favored 'General case' 0 C--O 1.274 2.358 0 O-C-N 121.231 -0.918 . . . . 0.0 112.115 173.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.431 ' N ' ' O ' ' P' ' 154' ' ' LYS . 77.1 mt-30 -51.72 -61.76 2.05 Favored 'General case' 0 C--N 1.376 1.754 0 O-C-N 119.709 -1.869 . . . . 0.0 106.479 168.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -56.43 -24.19 43.62 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-O 117.446 -1.264 . . . . 0.0 109.448 -167.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.53 ' HB3' ' CD2' ' P' ' 128' ' ' PHE . 3.1 t60 -78.33 -39.66 38.91 Favored 'General case' 0 C--O 1.282 2.785 0 CA-C-N 121.606 2.003 . . . . 0.0 111.489 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.814 ' HD3' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -68.51 -31.07 70.06 Favored 'General case' 0 C--O 1.265 1.903 0 CA-C-N 122.668 2.485 . . . . 0.0 111.137 -177.692 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.437 ' CE1' " H2'" ' B' ' 23' ' ' ' DA' . 39.1 t80 -67.89 -45.9 73.16 Favored 'General case' 0 C--N 1.38 1.904 0 CA-C-N 120.738 1.608 . . . . 0.0 108.495 172.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -39.52 93.04 Favored 'General case' 0 C--N 1.381 1.973 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -164.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.547 HG21 ' HG2' ' P' ' 165' ' ' LYS . 0.5 OUTLIER -52.11 -61.45 2.26 Favored 'General case' 0 C--N 1.378 1.841 0 CA-C-O 124.475 2.083 . . . . 0.0 106.937 -173.95 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.547 ' HG2' HG21 ' P' ' 164' ' ' THR . 5.1 mmmt -59.53 -51.24 70.69 Favored 'General case' 0 C--N 1.385 2.119 1 CA-C-N 108.256 -4.066 . . . . 0.0 108.483 -160.529 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 13.0 ttt85 -52.41 -40.3 61.96 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 112.459 -2.155 . . . . 0.0 109.22 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . 0.506 ' HB1' ' O ' ' P' ' 164' ' ' THR . . . -63.11 -33.81 76.26 Favored 'General case' 0 C--N 1.385 2.125 0 CA-C-N 112.791 -2.004 . . . . 0.0 109.05 -172.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . 0.401 ' HA ' ' HG3' ' P' ' 171' ' ' LYS . 0.1 OUTLIER -81.62 -21.09 38.49 Favored 'General case' 0 C--N 1.388 2.265 0 CA-C-N 112.149 -2.296 . . . . 0.0 109.267 -173.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -57.19 -29.28 63.56 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.701 1.239 . . . . 0.0 110.042 168.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -73.6 -35.34 65.38 Favored 'General case' 0 C--N 1.386 2.18 0 CA-C-N 113.6 -1.636 . . . . 0.0 108.243 -166.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . 0.401 ' HG3' ' HA ' ' P' ' 168' ' ' GLN . 6.8 mttt -83.88 94.56 8.26 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 113.947 -1.478 . . . . 0.0 109.169 -155.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 116.33 -83.48 0.34 Allowed Glycine 0 C--N 1.383 3.15 0 N-CA-C 108.738 -1.745 . . . . 0.0 108.738 -155.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . 0.418 ' HD1' ' O ' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 155.19 170.8 0.01 OUTLIER 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.399 -1.4 . . . . 0.0 109.786 166.367 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -81.68 51.51 1.71 Allowed 'General case' 0 C--N 1.381 1.941 0 CA-C-N 112.103 -2.317 . . . . 0.0 110.009 174.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -93.53 -38.3 5.33 Favored Glycine 0 C--N 1.384 3.24 0 O-C-N 120.185 -1.572 . . . . 0.0 109.177 -155.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -131.72 116.89 16.14 Favored Pre-proline 0 CA--C 1.581 2.145 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 -169.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo . . . . . 0 CA--C 1.594 3.478 0 C-N-CA 121.432 1.421 . . . . 0.0 111.574 164.117 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.83 0 N19-C1'-C2' 119.027 3.017 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.542 ' N1 ' ' C2 ' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.542 3.88 1 P-O3'-C3' 128.413 7.261 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.505 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.912 0 C2'-C3'-O3' 117.214 2.45 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.544 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.643 0 P-O3'-C3' 123.894 3.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.509 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.558 3.952 1 P-O3'-C3' 131.945 10.204 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.509 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.85 1 P-O3'-C3' 127.305 6.338 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 1.007 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.514 0 C3'-C2'-C1' 106.982 3.058 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 1.007 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.474 0 C4'-C3'-C2' 100.216 -2.984 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.724 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.402 0 P-O3'-C3' 123.281 2.985 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.568 ' H71' ' C8 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.887 0 P-O3'-C3' 123.363 3.053 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.514 ' C8 ' H2'' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.474 0 P-O3'-C3' 123.01 2.759 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.604 0 C4'-C3'-C2' 100.456 -2.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.51 ' C2 ' ' C5 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.735 1 P-O3'-C3' 125.191 4.576 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.51 ' C5 ' ' C2 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.688 0 O4'-C4'-C3' 108.017 2.417 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.796 ' C4 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.904 1 O4'-C1'-N19 111.301 4.376 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.796 ' H72' ' C4 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.528 0 P-O3'-C3' 122.166 2.055 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.558 0 O5'-C5'-C4' 115.074 3.482 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.516 H2'' ' C8 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.579 0 O4'-C4'-C3' 108.304 2.704 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.516 ' C8 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.338 0 O4'-C4'-C3' 108.122 2.522 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.5 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.393 0 O4'-C4'-C3' 108.108 2.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.57 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.572 4.381 0 N19-C1'-C2' 119.164 3.102 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.57 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.556 3.762 1 P-O3'-C3' 126.531 5.692 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.576 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.533 0 C3'-C2'-C1' 107.312 3.294 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.701 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.613 0 O4'-C4'-C3' 108.698 3.098 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.701 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.771 0 O4'-C4'-C3' 108.412 2.812 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.517 ' C6 ' H2'' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.568 3.978 0 N19-C1'-C2' 118.918 2.949 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.577 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.698 0 P-O3'-C3' 122.868 2.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.577 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.561 3.319 0 P-O3'-C3' 122.629 2.441 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.544 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.6 0 O4'-C4'-C3' 108.371 2.771 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.594 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.406 0 O4'-C4'-C3' 107.928 2.328 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.594 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.605 0 O4'-C4'-C3' 108.364 2.764 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . 0.542 ' C2 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.866 0 O4'-C1'-N19 109.406 2.008 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.514 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.94 142.0 23.07 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 113.685 -1.598 . . . . 0.0 108.664 -179.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 169.49 37.7 0.0 OUTLIER 'General case' 0 C--N 1.396 2.604 0 CA-C-N 113.342 -1.754 . . . . 0.0 109.5 -171.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . 0.456 ' O ' HD23 ' P' ' 105' ' ' LEU . . . 110.24 -49.3 0.86 Allowed Glycine 0 C--N 1.38 3.028 0 N-CA-C 108.72 -1.752 . . . . 0.0 108.72 162.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.726 HD11 ' HD2' ' P' ' 106' ' ' PRO . 3.4 mm? -134.57 161.56 62.94 Favored Pre-proline 0 CA--C 1.581 2.16 0 CA-C-N 113.746 -1.227 . . . . 0.0 108.69 161.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.726 ' HD2' HD11 ' P' ' 105' ' ' LEU . 0.1 OUTLIER -84.96 44.31 1.43 Allowed 'Trans proline' 0 C--N 1.394 2.939 0 C-N-CA 123.089 2.526 . . . . 0.0 110.484 169.736 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 52.8 m-20 -98.29 169.97 9.2 Favored 'General case' 0 C--N 1.383 2.033 0 CA-C-N 113.903 -1.499 . . . . 0.0 109.137 -173.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.87 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -90.46 131.51 36.17 Favored 'General case' 0 C--N 1.382 2.009 0 CA-C-N 113.645 -1.616 . . . . 0.0 108.104 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.19 144.06 44.93 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 113.798 -1.547 . . . . 0.0 109.145 170.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.87 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.8 OUTLIER -110.22 50.4 0.8 Allowed 'General case' 0 C--N 1.382 1.979 0 CA-C-N 114.072 -1.422 . . . . 0.0 109.754 -155.116 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.651 ' HD3' " O3'" ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -124.08 101.09 7.04 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.667 -1.606 . . . . 0.0 109.094 171.241 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -102.95 152.58 21.15 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 112.085 -2.325 . . . . 0.0 108.237 154.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.986 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.8 OUTLIER -70.17 114.83 8.7 Favored 'General case' 0 C--N 1.387 2.201 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 -171.73 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.537 HG22 ' P ' ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -102.32 63.95 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.17 0 CA-C-O 125.811 2.72 . . . . 0.0 107.914 -157.482 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.986 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.36 109.42 10.06 Favored 'General case' 0 C--N 1.393 2.488 0 CA-C-N 111.166 -2.743 . . . . 0.0 109.232 -159.432 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.636 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.8 m-85 -75.72 143.2 42.2 Favored 'General case' 0 C--N 1.388 2.264 0 CA-C-N 112.603 -2.089 . . . . 0.0 108.05 -168.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -65.88 147.64 53.05 Favored 'General case' 0 C--N 1.382 2.006 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -169.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -42.85 -36.56 1.53 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-N 113.843 -1.526 . . . . 0.0 109.286 -176.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.89 -65.54 0.55 Allowed 'General case' 0 C--N 1.382 2.014 0 CA-C-O 124.172 1.939 . . . . 0.0 109.261 174.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.537 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.0 mt-30 -50.96 -47.39 61.29 Favored 'General case' 0 C--N 1.381 1.967 0 CA-C-N 112.426 -2.17 . . . . 0.0 110.073 177.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.536 ' HA ' HD13 ' P' ' 124' ' ' LEU . 11.3 m -50.02 -57.83 6.76 Favored 'General case' 0 C--N 1.383 2.03 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 168.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.57 ' CE2' ' CZ ' ' P' ' 126' ' ' ARG . 0.9 OUTLIER -52.86 -47.79 67.55 Favored 'General case' 0 C--N 1.383 2.038 0 CA-C-O 122.377 1.084 . . . . 0.0 110.017 -169.097 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.987 ' CD ' HG23 ' P' ' 146' ' ' ILE . 7.1 mt-10 -66.94 -35.86 80.93 Favored 'General case' 0 C--N 1.379 1.862 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.973 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.8 mt -60.43 -52.4 65.37 Favored 'General case' 0 C--N 1.383 2.043 0 O-C-N 120.044 -1.66 . . . . 0.0 110.592 168.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.549 ' O ' ' N ' ' P' ' 129' ' ' ARG . 15.8 mt-10 -53.77 -53.65 49.35 Favored 'General case' 0 C--N 1.379 1.854 0 CA-C-O 122.248 1.023 . . . . 0.0 108.874 177.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.57 ' CZ ' ' CE2' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -38.05 -67.25 0.21 Allowed 'General case' 0 C--N 1.38 1.926 0 CA-C-N 111.683 -2.508 . . . . 0.0 108.679 176.403 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.746 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -64.14 -29.94 71.04 Favored 'General case' 0 C--N 1.394 2.501 0 CA-C-N 112.287 -2.233 . . . . 0.0 108.23 -169.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.839 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 12.3 t80 -69.44 -50.73 42.91 Favored 'General case' 0 C--N 1.389 2.29 0 O-C-N 121.134 -0.979 . . . . 0.0 110.956 172.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' P' ' 125' ' ' GLU . 10.1 mmm180 -62.28 -11.87 17.5 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.083 -1.872 . . . . 0.0 108.093 -166.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . 0.445 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 34.2 mt-30 -109.19 -39.74 5.16 Favored 'General case' 0 C--N 1.38 1.892 0 C-N-CA 126.355 1.862 . . . . 0.0 108.044 -171.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.505 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -153.15 109.36 3.35 Favored 'General case' 0 C--N 1.389 2.295 0 CA-C-N 112.24 -2.255 . . . . 0.0 109.217 -153.579 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -77.05 -19.77 56.73 Favored 'General case' 0 C--N 1.394 2.519 0 CA-C-N 112.171 -2.286 . . . . 0.0 110.806 -168.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.593 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 15.4 m-85 -159.82 114.34 2.31 Favored 'General case' 0 C--N 1.38 1.9 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.373 -153.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.69 HD12 ' HD3' ' P' ' 127' ' ' ARG . 27.1 mt -126.66 136.97 53.19 Favored 'General case' 0 C--N 1.399 2.754 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -158.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 155.16 25.93 Favored 'General case' 0 C--N 1.382 1.998 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 166.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.528 ' HB2' ' HD3' ' P' ' 137' ' ' PRO . . . -59.57 -49.62 91.2 Favored Pre-proline 0 CA--C 1.582 2.209 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.355 -161.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.528 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 81.3 Cg_exo -58.2 -28.69 84.99 Favored 'Trans proline' 0 C--N 1.401 3.297 0 C-N-CA 121.048 1.165 . . . . 0.0 114.894 -174.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.652 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.1 OUTLIER -54.03 -71.06 0.08 Allowed 'General case' 0 C--N 1.38 1.9 0 CA-C-O 124.704 2.192 . . . . 0.0 106.334 160.393 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.822 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.1 -40.14 82.66 Favored 'General case' 0 C--N 1.389 2.303 0 CA-C-N 109.965 -3.289 . . . . 0.0 108.885 -154.927 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.611 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 3.9 mt-10 -53.35 -39.17 63.93 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 123.163 1.459 . . . . 0.0 108.304 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -64.28 -35.46 80.91 Favored 'General case' 0 C--N 1.38 1.918 0 CA-C-N 112.945 -1.934 . . . . 0.0 108.732 -171.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.746 HD12 ' CG ' ' P' ' 127' ' ' ARG . 2.3 tp -65.47 -42.77 91.9 Favored 'General case' 0 C--N 1.383 2.023 0 CA-C-O 123.223 1.487 . . . . 0.0 109.038 168.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.611 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -57.04 -34.71 68.5 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-N 112.38 -2.191 . . . . 0.0 108.592 174.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.632 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 0.9 OUTLIER -73.51 -43.22 60.56 Favored 'General case' 0 C--N 1.387 2.225 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.19 -179.443 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . 0.736 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 75.0 mt -66.19 -48.06 71.9 Favored 'General case' 0 C--N 1.379 1.888 0 CA-C-O 124.743 2.211 . . . . 0.0 107.954 -164.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.987 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -94.68 -17.03 7.26 Favored 'Isoleucine or valine' 0 C--N 1.385 2.145 0 CA-C-N 110.544 -3.025 . . . . 0.0 107.84 -172.104 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . 0.736 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.0 OUTLIER 81.19 37.21 0.08 Allowed 'General case' 0 C--N 1.385 2.126 0 CA-C-N 111.494 -2.594 . . . . 0.0 108.112 152.777 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.979 HD13 ' CD1' ' P' ' 146' ' ' ILE . 6.1 mt -95.24 168.08 10.96 Favored 'General case' 0 C--N 1.39 2.35 0 CA-C-N 112.13 -2.305 . . . . 0.0 109.416 168.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.643 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.0 p -88.12 143.97 33.73 Favored Pre-proline 0 CA--C 1.587 2.392 0 CA-C-O 122.986 1.374 . . . . 0.0 108.273 172.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.433 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 1.3 Cg_endo -59.73 -38.44 80.85 Favored 'Trans proline' 1 C--N 1.415 4.031 0 C-N-CA 122.715 2.277 . . . . 0.0 112.073 -155.568 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 151' ' ' THR . . . . . 0.518 HG23 HG12 ' P' ' 155' ' ' ILE . 0.4 OUTLIER -57.81 -29.47 64.93 Favored 'General case' 0 C--N 1.385 2.129 0 CA-C-O 118.081 -0.961 . . . . 0.0 110.343 167.754 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.643 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -73.64 -28.04 61.58 Favored 'General case' 0 C--N 1.388 2.258 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.585 HG11 ' CD1' ' P' ' 157' ' ' PHE . 1.3 t -64.38 -72.53 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 122.019 2.19 . . . . 0.0 109.439 164.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.822 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.27 -57.44 0.49 Allowed 'General case' 0 C--N 1.385 2.148 0 C-N-CA 125.188 1.395 . . . . 0.0 111.017 -177.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.518 HG12 HG23 ' P' ' 151' ' ' THR . 0.7 OUTLIER -53.04 -47.81 53.71 Favored 'Isoleucine or valine' 0 C--N 1.386 2.17 0 CA-C-N 112.86 -1.973 . . . . 0.0 108.967 -176.45 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.973 ' HB3' HD21 ' P' ' 124' ' ' LEU . 4.4 t90 -66.19 -31.06 71.67 Favored 'General case' 0 C--N 1.382 1.98 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.839 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 69.0 m-85 -74.82 -39.87 61.4 Favored 'General case' 0 C--O 1.274 2.373 0 O-C-N 121.257 -0.902 . . . . 0.0 112.057 174.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' P' ' 154' ' ' LYS . 24.7 mt-30 -49.71 -63.87 0.98 Allowed 'General case' 0 C--N 1.377 1.762 0 O-C-N 119.558 -1.964 . . . . 0.0 106.953 167.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -57.48 -13.55 3.79 Favored 'General case' 0 C--N 1.388 2.253 0 CA-C-O 118.129 -0.938 . . . . 0.0 111.024 -165.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.559 ' ND1' ' CE2' ' P' ' 128' ' ' PHE . 31.5 t-80 -78.44 -56.45 4.43 Favored 'General case' 0 C--O 1.279 2.655 0 CA-C-N 120.46 1.482 . . . . 0.0 110.92 167.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.657 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -65.63 -37.54 86.86 Favored 'General case' 0 C--O 1.267 2.016 0 O-C-N 118.639 -2.538 . . . . 0.0 110.587 -155.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -69.04 -35.87 77.08 Favored 'General case' 0 C--N 1.38 1.92 0 O-C-N 119.94 -1.725 . . . . 0.0 109.657 175.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -41.59 92.23 Favored 'General case' 0 C--N 1.381 1.938 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -170.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.657 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -52.2 -58.8 5.51 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 125.329 2.49 . . . . 0.0 106.57 -171.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.433 ' HG2' HG21 ' P' ' 164' ' ' THR . 9.6 mmmt -58.71 -41.94 87.48 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 108.51 -3.95 . . . . 0.0 109.348 -168.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.6 -47.54 63.55 Favored 'General case' 0 C--N 1.38 1.93 0 CA-C-N 112.754 -2.021 . . . . 0.0 111.109 175.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -45.92 -40.28 9.96 Favored 'General case' 0 C--N 1.382 2.004 0 CA-C-O 123.548 1.642 . . . . 0.0 108.207 177.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -81.2 -23.04 38.42 Favored 'General case' 0 C--N 1.392 2.427 0 CA-C-N 111.445 -2.616 . . . . 0.0 109.949 -166.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -60.7 -33.55 73.04 Favored 'General case' 0 C--N 1.383 2.035 0 CA-C-N 113.498 -1.683 . . . . 0.0 109.466 169.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -61.27 -41.27 96.65 Favored 'General case' 0 C--N 1.384 2.086 0 CA-C-N 114.25 -1.341 . . . . 0.0 108.104 177.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -85.41 85.53 7.43 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-N 113.73 -1.577 . . . . 0.0 109.073 -158.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 131.3 -80.62 0.34 Allowed Glycine 0 C--N 1.382 3.09 0 N-CA-C 108.896 -1.682 . . . . 0.0 108.896 -155.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . 0.502 ' C ' ' HD1' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 158.85 173.33 0.01 OUTLIER 'General case' 0 C--N 1.382 2.019 0 CA-C-O 123.023 1.392 . . . . 0.0 109.856 160.478 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.93 69.42 9.73 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-N 112.239 -2.255 . . . . 0.0 109.404 176.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -61.66 -159.3 0.11 Allowed Glycine 0 C--N 1.379 2.955 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 166.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 16.7 p-80 -103.45 136.26 19.25 Favored Pre-proline 0 CA--C 1.58 2.114 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -177.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo . . . . . 0 CA--C 1.594 3.522 0 C-N-CA 121.542 1.494 . . . . 0.0 111.58 178.002 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . 0.432 ' H71' ' H61' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.566 3.788 0 O5'-C5'-C4' 114.352 2.966 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.796 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.364 0 P-O3'-C3' 122.723 2.519 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.796 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.877 1 P-O3'-C3' 125.257 4.631 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.648 ' C8 ' ' H71' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.529 0 P-O3'-C3' 123.38 3.066 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.648 ' H71' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.914 0 N19-C1'-C2' 118.154 2.471 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.518 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 1 C4'--C3' 1.57 4.169 1 P-O3'-C3' 127.428 6.44 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 1.036 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.57 4.236 0 P-O3'-C3' 124.262 3.802 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 1.036 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.543 3.998 1 P-O3'-C3' 126.51 5.675 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.666 ' C8 ' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.654 0 O4'-C4'-C3' 108.71 3.11 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.559 ' C7 ' ' C8 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.929 0 P-O3'-C3' 123.119 2.849 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.497 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.65 0 C3'-C2'-C1' 106.586 2.776 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . 0.517 H2'' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.402 1 P-O3'-C3' 129.43 8.108 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.624 ' C5 ' ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.644 0 O4'-C4'-C3' 108.335 2.735 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.624 ' H72' ' C5 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.602 0 O4'-C4'-C3' 108.686 3.086 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.992 ' C5 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.541 3.718 1 O4'-C1'-N19 111.308 4.385 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.992 ' H72' ' C5 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.545 0 O4'-C1'-N19 109.725 2.406 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.674 0 O5'-C5'-C4' 115.074 3.481 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.533 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.64 1 P-O3'-C3' 126.964 6.053 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.533 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.491 1 P-O3'-C3' 129.171 7.892 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.531 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.349 0 O4'-C4'-C3' 107.924 2.324 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.605 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.573 4.477 0 O4'-C1'-N19 105.237 -3.203 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.605 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.557 3.881 0 P-O3'-C3' 123.745 3.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.643 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.661 1 P-O3'-C3' 124.868 4.306 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.751 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.465 0 O4'-C4'-C3' 108.613 3.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.751 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.156 0 C2'-C3'-O3' 117.026 2.38 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.546 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.568 3.989 0 P-O3'-C3' 124.148 3.706 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.605 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.567 1 P-O3'-C3' 126.338 5.532 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.625 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.375 0 P-O3'-C3' 122.546 2.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.625 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.678 1 P-O3'-C3' 125.869 5.141 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.43 0 O4'-C4'-C3' 107.944 2.344 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.641 ' N4 ' ' O6 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.632 0 O4'-C4'-C3' 108.285 2.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . 0.432 ' H61' ' H71' ' A' ' 1' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.905 0 O4'-C1'-N19 109.351 1.939 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.511 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.2 m -70.57 -45.2 65.87 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 113.703 -1.59 . . . . 0.0 108.682 -173.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 2.1 p30 170.3 -38.33 0.0 OUTLIER 'General case' 0 C--N 1.388 2.28 0 CA-C-N 113.518 -1.674 . . . . 0.0 107.965 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . 0.694 ' O ' HD12 ' P' ' 105' ' ' LEU . . . -121.81 -69.15 0.26 Allowed Glycine 0 C--N 1.382 3.084 0 N-CA-C 108.892 -1.683 . . . . 0.0 108.892 -162.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.694 HD12 ' O ' ' P' ' 104' ' ' GLY . 0.4 OUTLIER -171.66 151.69 2.94 Favored Pre-proline 0 CA--C 1.581 2.158 0 CA-C-N 113.658 -1.271 . . . . 0.0 108.553 -173.582 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -50.23 92.49 0.03 OUTLIER 'Trans proline' 0 C--N 1.396 3.074 0 C-N-CA 122.783 2.322 . . . . 0.0 110.354 155.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -81.39 100.6 9.34 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-O 122.485 1.136 . . . . 0.0 109.138 163.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 15.1 mtpt -128.1 -67.68 0.8 Allowed 'General case' 0 C--N 1.383 2.032 0 CA-C-N 113.707 -1.588 . . . . 0.0 108.142 -177.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.541 ' HE3' ' N ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -67.11 149.68 50.22 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 113.623 -1.626 . . . . 0.0 108.99 -171.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.568 ' HD2' ' C ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER 177.93 130.06 0.06 Allowed 'General case' 0 C--N 1.382 2.015 0 CA-C-O 123.832 1.777 . . . . 0.0 108.558 -155.372 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.853 ' HD3' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -138.81 111.83 7.9 Favored 'General case' 0 C--N 1.384 2.1 0 CA-C-N 112.606 -2.088 . . . . 0.0 107.501 156.673 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . 0.463 ' NH2' HG13 ' P' ' 114' ' ' VAL . 8.0 mtm180 -71.68 -176.12 1.54 Allowed 'General case' 0 C--N 1.385 2.131 0 CA-C-N 113.134 -1.848 . . . . 0.0 108.627 173.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 1.104 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.0 OUTLIER -91.89 95.37 9.79 Favored 'General case' 0 C--N 1.381 1.977 0 N-CA-C 105.911 -1.885 . . . . 0.0 105.911 162.796 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.723 HG21 ' OP2' ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -97.97 56.86 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.391 2.37 0 CA-C-O 125.472 2.558 . . . . 0.0 108.408 -169.245 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 1.104 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.1 OUTLIER -77.66 105.71 9.0 Favored 'General case' 0 C--N 1.388 2.259 0 CA-C-N 110.701 -2.954 . . . . 0.0 109.317 -157.33 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.599 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 -76.22 141.18 41.83 Favored 'General case' 0 C--N 1.392 2.441 0 CA-C-N 112.081 -2.327 . . . . 0.0 107.793 -162.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.62 147.56 53.2 Favored 'General case' 0 C--N 1.382 1.98 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -166.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -42.62 -36.0 1.26 Allowed 'General case' 0 C--N 1.381 1.963 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.489 -176.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.04 -67.78 0.23 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 123.995 1.855 . . . . 0.0 109.207 173.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.55 ' O ' HD13 ' P' ' 124' ' ' LEU . 78.6 mt-30 -47.68 -50.56 24.49 Favored 'General case' 0 C--N 1.382 2.014 0 CA-C-N 112.47 -2.15 . . . . 0.0 110.217 176.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.477 ' HA ' HD13 ' P' ' 124' ' ' LEU . 16.1 m -49.44 -58.73 4.61 Favored 'General case' 0 C--N 1.383 2.026 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 169.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.575 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 1.2 t80 -52.97 -47.2 68.33 Favored 'General case' 0 C--N 1.384 2.071 0 CA-C-O 122.435 1.112 . . . . 0.0 109.825 -169.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 1.019 ' CD ' HG23 ' P' ' 146' ' ' ILE . 3.2 mt-10 -66.81 -36.7 82.99 Favored 'General case' 0 C--O 1.265 1.91 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.063 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.947 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.7 mt -60.56 -52.19 66.21 Favored 'General case' 0 C--N 1.382 1.984 0 O-C-N 119.521 -1.987 . . . . 0.0 109.88 169.033 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.571 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.2 mt-10 -53.77 -51.35 63.71 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-O 122.245 1.021 . . . . 0.0 109.213 178.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.575 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.6 -69.68 0.12 Allowed 'General case' 0 C--N 1.379 1.874 0 CA-C-N 111.767 -2.47 . . . . 0.0 108.69 175.045 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.833 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.4 OUTLIER -58.2 -38.09 76.07 Favored 'General case' 0 C--N 1.391 2.398 0 CA-C-N 112.999 -1.91 . . . . 0.0 108.288 -171.768 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.831 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 20.8 t80 -69.71 -45.5 68.1 Favored 'General case' 0 C--N 1.381 1.958 0 O-C-N 121.559 -0.713 . . . . 0.0 110.817 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.571 ' N ' ' O ' ' P' ' 125' ' ' GLU . 13.8 mmm180 -62.33 -15.98 51.41 Favored 'General case' 0 C--N 1.38 1.915 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 -170.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -104.41 -37.9 7.02 Favored 'General case' 0 C--N 1.38 1.908 0 C-N-CA 126.776 2.031 . . . . 0.0 107.503 -168.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.52 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -155.34 107.75 2.69 Favored 'General case' 0 C--N 1.387 2.232 0 CA-C-N 111.914 -2.403 . . . . 0.0 108.84 -153.86 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.86 -21.12 60.22 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 112.218 -2.265 . . . . 0.0 110.873 -167.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.553 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 33.8 m-85 -159.33 112.84 2.28 Favored 'General case' 0 C--N 1.38 1.901 0 CA-C-N 113.305 -1.77 . . . . 0.0 108.14 -153.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.833 HD12 ' HD3' ' P' ' 127' ' ' ARG . 18.6 mt -124.63 135.83 53.42 Favored 'General case' 0 C--N 1.396 2.611 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 -158.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.12 155.05 26.44 Favored 'General case' 0 C--N 1.381 1.973 0 O-C-N 120.612 -1.305 . . . . 0.0 107.498 167.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.535 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.42 -49.62 91.51 Favored Pre-proline 0 CA--C 1.583 2.22 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 -160.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.535 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 79.7 Cg_exo -58.15 -30.03 89.21 Favored 'Trans proline' 0 C--N 1.402 3.342 0 N-CA-C 114.87 1.065 . . . . 0.0 114.87 -175.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.601 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.3 OUTLIER -54.37 -69.46 0.13 Allowed 'General case' 0 C--N 1.38 1.912 0 CA-C-O 124.54 2.114 . . . . 0.0 106.378 161.164 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.919 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.08 -39.5 82.91 Favored 'General case' 0 C--N 1.392 2.428 0 CA-C-N 109.942 -3.299 . . . . 0.0 108.657 -154.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.633 ' O ' ' N ' ' P' ' 144' ' ' SER . 4.0 mt-10 -53.13 -38.03 62.31 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-O 122.498 1.142 . . . . 0.0 108.568 178.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -64.22 -37.03 86.03 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-N 113.142 -1.845 . . . . 0.0 109.347 -174.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.689 HD11 HD12 ' P' ' 146' ' ' ILE . 0.4 OUTLIER -57.86 -47.33 83.02 Favored 'General case' 0 C--N 1.385 2.151 0 CA-C-O 123.125 1.44 . . . . 0.0 108.719 164.804 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.555 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -62.73 -31.71 72.69 Favored 'General case' 0 C--N 1.387 2.208 0 CA-C-N 112.104 -2.316 . . . . 0.0 109.087 -179.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.633 ' N ' ' O ' ' P' ' 140' ' ' GLU . 5.9 t -74.45 -41.95 59.94 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-N 114.243 -1.344 . . . . 0.0 109.037 -178.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 39.5 mt -63.86 -46.62 84.18 Favored 'General case' 0 C--N 1.381 1.962 0 CA-C-O 124.52 2.105 . . . . 0.0 108.269 -167.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 1.019 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -101.41 -12.67 8.55 Favored 'Isoleucine or valine' 0 C--N 1.388 2.25 0 CA-C-N 110.739 -2.937 . . . . 0.0 108.155 -165.437 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 82.08 34.42 0.08 Allowed 'General case' 0 C--N 1.383 2.047 0 CA-C-O 125.547 2.594 . . . . 0.0 108.147 153.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.993 HD13 ' CD1' ' P' ' 146' ' ' ILE . 7.6 mt -96.49 169.47 9.88 Favored 'General case' 0 C--N 1.397 2.637 0 CA-C-N 111.652 -2.522 . . . . 0.0 109.475 169.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.613 ' O ' ' N ' ' P' ' 152' ' ' GLN . 21.5 p -91.31 145.29 31.17 Favored Pre-proline 0 CA--C 1.588 2.435 0 CA-C-O 122.91 1.338 . . . . 0.0 108.735 171.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.07 -37.43 64.1 Favored 'Trans proline' 1 C--N 1.414 4.021 0 C-N-CA 122.682 2.255 . . . . 0.0 113.128 -155.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 151' ' ' THR . . . . . 0.441 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.2 OUTLIER -53.92 -35.62 61.86 Favored 'General case' 0 C--N 1.384 2.066 0 C-N-CA 119.676 -0.81 . . . . 0.0 109.671 165.157 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.613 ' N ' ' O ' ' P' ' 149' ' ' THR . 44.3 mt-30 -70.48 -27.42 64.2 Favored 'General case' 0 C--N 1.389 2.296 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 -177.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.668 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.3 t -64.68 -71.84 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.105 0 CA-C-N 121.487 1.949 . . . . 0.0 109.666 163.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.919 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.8 -59.61 0.4 Allowed 'General case' 0 C--N 1.386 2.188 0 CA-C-O 122.668 1.223 . . . . 0.0 110.656 -178.163 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 10.2 mm -56.25 -41.89 71.85 Favored 'Isoleucine or valine' 0 C--N 1.381 1.948 0 CA-C-N 113.114 -1.857 . . . . 0.0 108.984 -174.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.947 ' HB3' HD21 ' P' ' 124' ' ' LEU . 7.4 t90 -68.24 -32.24 72.3 Favored 'General case' 0 C--N 1.382 1.98 0 O-C-N 120.962 -1.086 . . . . 0.0 109.637 173.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.831 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 59.6 m-85 -74.81 -40.48 61.07 Favored 'General case' 0 C--O 1.276 2.484 0 O-C-N 120.932 -1.105 . . . . 0.0 112.074 174.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' P' ' 154' ' ' LYS . 25.3 mt-30 -48.94 -64.19 0.88 Allowed 'General case' 0 C--N 1.377 1.795 0 O-C-N 119.543 -1.973 . . . . 0.0 106.674 167.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -55.94 -23.34 31.37 Favored 'General case' 0 C--N 1.389 2.285 0 CA-C-O 117.579 -1.2 . . . . 0.0 109.706 -163.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.537 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.7 OUTLIER -76.34 -47.64 22.78 Favored 'General case' 0 C--O 1.281 2.758 0 CA-C-N 121.239 1.836 . . . . 0.0 110.949 177.108 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.698 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -66.69 -36.36 82.34 Favored 'General case' 0 C--O 1.266 1.933 0 CA-C-N 122.815 2.552 . . . . 0.0 110.619 -161.925 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.509 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 58.3 t80 -68.88 -35.79 77.31 Favored 'General case' 0 C--N 1.38 1.913 0 O-C-N 120.081 -1.637 . . . . 0.0 109.588 171.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -63.83 -39.27 93.83 Favored 'General case' 0 C--N 1.382 2.004 0 O-C-N 121.608 -0.683 . . . . 0.0 109.432 -169.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.698 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -54.95 -60.98 2.62 Favored 'General case' 0 C--N 1.378 1.836 0 CA-C-O 125.008 2.337 . . . . 0.0 106.416 -173.159 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.441 ' HG2' HG21 ' P' ' 164' ' ' THR . 7.7 mmmt -58.97 -46.56 87.8 Favored 'General case' 0 C--N 1.387 2.215 1 CA-C-N 108.171 -4.104 . . . . 0.0 108.1 -161.026 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 10.9 ttt180 -56.82 -42.52 79.73 Favored 'General case' 0 C--N 1.38 1.92 0 CA-C-N 112.274 -2.239 . . . . 0.0 109.23 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . 0.405 ' HB1' ' O ' ' P' ' 164' ' ' THR . . . -58.97 -33.19 70.37 Favored 'General case' 0 C--N 1.383 2.047 0 CA-C-O 124.283 1.992 . . . . 0.0 109.167 -177.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . 0.432 ' HA ' ' HG3' ' P' ' 171' ' ' LYS . 0.1 OUTLIER -84.58 -22.61 29.98 Favored 'General case' 0 C--N 1.393 2.494 0 CA-C-N 112.062 -2.336 . . . . 0.0 110.064 -173.239 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -50.39 -32.27 17.08 Favored 'General case' 0 C--N 1.379 1.875 0 CA-C-O 122.932 1.349 . . . . 0.0 109.705 167.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -78.2 -34.23 49.54 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.137 -1.847 . . . . 0.0 107.879 -159.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . 0.432 ' HG3' ' HA ' ' P' ' 168' ' ' GLN . 16.1 mttt -73.21 87.19 1.44 Allowed 'General case' 0 C--N 1.382 1.978 0 CA-C-N 113.653 -1.612 . . . . 0.0 108.809 -157.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . 0.459 ' C ' ' CG ' ' P' ' 173' ' ' TYR . . . 102.09 -94.47 1.2 Allowed Glycine 0 C--N 1.382 3.088 0 N-CA-C 108.333 -1.907 . . . . 0.0 108.333 -154.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . 0.459 ' CG ' ' C ' ' P' ' 172' ' ' GLY . 0.0 OUTLIER 172.26 141.27 0.03 OUTLIER 'General case' 0 C--N 1.381 1.96 0 CA-C-N 113.107 -1.546 . . . . 0.0 109.116 -177.655 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -167.38 174.37 8.06 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-N 113.314 -1.767 . . . . 0.0 107.343 154.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 109.55 38.49 1.75 Allowed Glycine 0 C--N 1.38 3.025 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 160.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -147.11 131.16 8.48 Favored Pre-proline 0 CA--C 1.58 2.127 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 167.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo . . . . . 0 CA--C 1.593 3.466 0 C-N-CA 121.457 1.438 . . . . 0.0 111.606 -170.838 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . 0.5 ' H73' ' H61' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.566 3.779 0 O5'-C5'-C4' 114.381 2.986 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.543 ' N1 ' ' N3 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.317 1 P-O3'-C3' 127.247 6.289 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.526 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.568 3.965 0 P-O3'-C3' 122.582 2.402 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.526 ' C8 ' H2'' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.626 0 P-O3'-C3' 123.301 3.001 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.518 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.855 0 O4'-C4'-C3' 107.977 2.377 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.534 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.951 0 P-O3'-C3' 123.031 2.776 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.774 " H4'" ' HG2' ' P' ' 113' ' ' ARG . . . . . . . . 0 C4'--C3' 1.566 3.847 0 P-O3'-C3' 123.924 3.52 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.565 ' C6 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.582 0 P-O3'-C3' 123.893 3.494 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.636 ' N1 ' ' N3 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.562 3.361 0 P-O3'-C3' 123.802 3.419 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.606 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.935 0 P-O3'-C3' 123.937 3.531 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.523 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.398 0 P-O3'-C3' 122.816 2.597 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.388 0 O4'-C4'-C3' 108.176 2.576 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.529 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.734 1 P-O3'-C3' 125.739 5.033 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.529 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.706 0 P-O3'-C3' 122.441 2.284 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.763 ' C8 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.543 4.005 1 O4'-C1'-N19 111.059 4.074 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.763 ' H72' ' C8 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.559 1 P-O3'-C3' 124.564 4.054 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.866 0 O5'-C5'-C4' 115.023 3.445 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.443 H2'' ' C8 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.974 1 P-O3'-C3' 126.507 5.672 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.443 ' C8 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.427 0 O4'-C4'-C3' 108.005 2.405 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.404 ' N3 ' ' N3 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.3 0 O4'-C4'-C3' 108.203 2.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.568 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.572 4.406 0 N19-C1'-C2' 119.13 3.081 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.568 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.558 3.996 1 P-O3'-C3' 126.598 5.748 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.602 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.562 3.445 1 P-O3'-C3' 125.098 4.499 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.73 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.702 0 O4'-C4'-C3' 108.28 2.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.73 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.225 1 P-O3'-C3' 126.477 5.648 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.523 " C2'" ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.223 0 P-O3'-C3' 124.389 3.907 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.552 ' C2 ' ' C2 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.675 0 P-O3'-C3' 124.104 3.67 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.531 ' C8 ' H2'' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.635 0 C4'-C3'-C2' 100.167 -3.033 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.427 ' O2 ' ' N2 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.568 4.028 0 P-O3'-C3' 123.506 3.172 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.586 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.31 0 O4'-C4'-C3' 107.874 2.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.586 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.587 0 O4'-C4'-C3' 108.285 2.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . 0.5 ' H61' ' H73' ' A' ' 1' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.927 0 O4'-C1'-N19 109.341 1.926 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.528 3.473 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 12.7 m 81.83 89.28 0.04 OUTLIER 'General case' 0 C--N 1.381 1.973 0 CA-C-N 113.639 -1.619 . . . . 0.0 108.647 164.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 1.2 p30 169.36 -26.08 0.0 OUTLIER 'General case' 0 C--N 1.391 2.371 0 CA-C-N 113.496 -1.684 . . . . 0.0 108.098 176.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -134.53 142.41 13.87 Favored Glycine 0 C--N 1.382 3.085 0 N-CA-C 108.914 -1.675 . . . . 0.0 108.914 171.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.595 HD22 ' HD2' ' P' ' 106' ' ' PRO . 0.2 OUTLIER -105.99 -176.18 0.41 Allowed Pre-proline 0 CA--C 1.582 2.175 0 CA-C-N 113.702 -1.249 . . . . 0.0 108.779 172.871 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.595 ' HD2' HD22 ' P' ' 105' ' ' LEU . 94.9 Cg_exo -54.0 91.52 0.04 OUTLIER 'Trans proline' 0 C--N 1.397 3.092 0 C-N-CA 122.823 2.348 . . . . 0.0 110.297 155.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -127.98 155.41 44.31 Favored 'General case' 0 C--N 1.381 1.967 0 CA-C-O 122.45 1.119 . . . . 0.0 109.202 167.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.563 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -109.26 168.11 9.62 Favored 'General case' 0 C--N 1.382 2.013 0 CA-C-N 113.703 -1.59 . . . . 0.0 108.239 159.273 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.444 ' HG3' ' N ' ' P' ' 110' ' ' ARG . 0.1 OUTLIER -80.62 152.83 28.33 Favored 'General case' 0 C--N 1.381 1.935 0 CA-C-N 113.761 -1.563 . . . . 0.0 109.317 -176.065 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.563 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.6 OUTLIER -144.57 89.56 2.01 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 113.646 -1.615 . . . . 0.0 109.208 -155.447 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.509 ' HD3' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -27.68 92.45 0.01 OUTLIER 'General case' 0 C--N 1.381 1.966 0 CA-C-N 113.328 -1.76 . . . . 0.0 110.273 174.907 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 70.5 mtt85 -65.28 172.87 2.84 Favored 'General case' 0 C--N 1.39 2.342 0 CA-C-N 111.855 -2.429 . . . . 0.0 108.839 155.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.892 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.3 OUTLIER -93.28 117.49 30.14 Favored 'General case' 0 C--N 1.382 2.015 0 CA-C-N 113.902 -1.499 . . . . 0.0 107.163 167.645 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.412 ' HB ' ' NE2' ' P' ' 152' ' ' GLN . 0.1 OUTLIER -108.32 64.76 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.162 0 CA-C-O 125.817 2.722 . . . . 0.0 107.911 -161.173 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.892 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.17 110.29 10.54 Favored 'General case' 0 C--N 1.391 2.407 0 CA-C-N 111.206 -2.724 . . . . 0.0 109.123 -158.069 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.589 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 1.1 m-85 -76.05 143.53 41.34 Favored 'General case' 0 C--N 1.389 2.321 0 CA-C-N 112.799 -2.0 . . . . 0.0 107.832 -167.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.41 148.03 52.42 Favored 'General case' 0 C--N 1.382 1.99 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -168.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -42.15 -36.02 1.08 Allowed 'General case' 0 C--N 1.381 1.966 0 CA-C-N 114.037 -1.438 . . . . 0.0 109.29 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.93 -67.72 0.24 Allowed 'General case' 0 C--N 1.382 1.982 0 CA-C-O 124.217 1.961 . . . . 0.0 109.104 173.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.533 ' O ' HD13 ' P' ' 124' ' ' LEU . 78.7 mt-30 -48.56 -48.05 39.02 Favored 'General case' 0 C--N 1.382 2.008 0 CA-C-N 112.419 -2.173 . . . . 0.0 110.052 177.188 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.551 ' HA ' HD13 ' P' ' 124' ' ' LEU . 19.9 m -52.05 -56.37 14.78 Favored 'General case' 0 C--N 1.383 2.027 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 169.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.667 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.2 t80 -53.16 -46.68 68.99 Favored 'General case' 0 C--N 1.383 2.023 0 CA-C-O 122.325 1.059 . . . . 0.0 110.15 -170.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.813 ' CG ' HG23 ' P' ' 146' ' ' ILE . 0.1 OUTLIER -66.29 -39.17 89.19 Favored 'General case' 0 C--N 1.38 1.894 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.219 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.983 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -60.16 -49.74 76.42 Favored 'General case' 0 C--N 1.385 2.142 0 O-C-N 120.691 -1.255 . . . . 0.0 109.727 172.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.569 ' O ' ' N ' ' P' ' 129' ' ' ARG . 13.3 mt-10 -55.17 -53.3 57.78 Favored 'General case' 0 C--N 1.38 1.909 0 CA-C-O 122.509 1.147 . . . . 0.0 109.461 176.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.667 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.9 -69.23 0.14 Allowed 'General case' 0 C--N 1.378 1.825 0 CA-C-N 111.897 -2.41 . . . . 0.0 108.665 177.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.857 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -57.49 -37.25 72.62 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 112.686 -2.052 . . . . 0.0 108.342 -173.334 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.847 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 24.7 t80 -70.0 -45.98 66.13 Favored 'General case' 0 C--N 1.38 1.927 0 CA-C-O 121.58 0.705 . . . . 0.0 110.752 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.569 ' N ' ' O ' ' P' ' 125' ' ' GLU . 7.6 mmm180 -62.54 -14.45 42.16 Favored 'General case' 0 C--N 1.381 1.941 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -169.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -107.67 -37.84 6.04 Favored 'General case' 0 C--N 1.38 1.91 0 C-N-CA 126.607 1.963 . . . . 0.0 107.687 -167.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.498 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -154.2 105.78 2.73 Favored 'General case' 0 C--N 1.388 2.273 0 CA-C-N 112.018 -2.355 . . . . 0.0 108.83 -153.552 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . 0.752 ' C ' ' HD1' ' P' ' 133' ' ' TYR . 3.2 mtt85 -77.36 -18.31 57.48 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 111.841 -2.436 . . . . 0.0 110.474 -169.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.752 ' HD1' ' C ' ' P' ' 132' ' ' ARG . 4.1 m-30 -154.66 111.25 3.28 Favored 'General case' 0 C--N 1.38 1.921 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.3 -154.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.651 HD21 ' HG3' ' P' ' 138' ' ' GLU . 31.5 mt -126.13 136.66 53.15 Favored 'General case' 0 C--N 1.397 2.65 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -161.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.54 155.31 25.8 Favored 'General case' 0 C--N 1.382 1.989 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 166.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.53 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.59 -49.43 92.09 Favored Pre-proline 0 CA--C 1.583 2.228 0 C-N-CA 120.049 -0.661 . . . . 0.0 109.347 -161.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.53 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 82.9 Cg_exo -58.15 -28.64 84.62 Favored 'Trans proline' 0 C--N 1.401 3.31 0 C-N-CA 121.001 1.134 . . . . 0.0 114.969 -175.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.651 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -53.85 -71.06 0.08 Allowed 'General case' 0 C--N 1.38 1.933 0 CA-C-O 124.524 2.107 . . . . 0.0 106.44 160.201 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.899 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.33 -39.66 81.87 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 109.969 -3.287 . . . . 0.0 108.79 -154.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.62 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 4.5 mt-10 -53.28 -39.3 63.82 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-O 123.177 1.465 . . . . 0.0 108.42 177.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -63.67 -35.29 80.04 Favored 'General case' 0 C--N 1.379 1.885 0 CA-C-N 112.846 -1.979 . . . . 0.0 108.633 -171.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.857 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.4 tp -65.95 -42.7 89.65 Favored 'General case' 0 C--N 1.383 2.056 0 CA-C-O 123.333 1.54 . . . . 0.0 109.186 169.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.62 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.76 -34.33 67.47 Favored 'General case' 0 C--N 1.39 2.334 0 CA-C-N 112.287 -2.233 . . . . 0.0 108.378 174.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.561 ' N ' ' O ' ' P' ' 140' ' ' GLU . 2.6 t -73.35 -43.6 60.4 Favored 'General case' 0 C--N 1.387 2.237 0 CA-C-N 114.242 -1.344 . . . . 0.0 110.296 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.99 -47.72 73.59 Favored 'General case' 0 C--N 1.378 1.847 0 CA-C-O 124.895 2.283 . . . . 0.0 107.922 -163.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.968 HD13 ' CD1' ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.66 -16.83 7.17 Favored 'Isoleucine or valine' 0 C--N 1.385 2.125 0 CA-C-N 110.482 -3.054 . . . . 0.0 107.761 -171.767 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 6.4 mmt180 81.31 37.36 0.08 Allowed 'General case' 0 C--N 1.384 2.095 0 CA-C-N 111.566 -2.561 . . . . 0.0 108.111 152.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.968 ' CD1' HD13 ' P' ' 146' ' ' ILE . 6.4 mt -95.27 167.99 11.01 Favored 'General case' 0 C--N 1.391 2.391 0 CA-C-N 112.179 -2.282 . . . . 0.0 109.46 168.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.647 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -88.51 144.07 33.15 Favored Pre-proline 0 CA--C 1.588 2.404 0 CA-C-O 122.95 1.357 . . . . 0.0 108.299 173.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.42 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 1.8 Cg_endo -60.28 -38.38 75.93 Favored 'Trans proline' 1 C--N 1.414 4.02 0 C-N-CA 122.736 2.291 . . . . 0.0 112.416 -155.436 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 151' ' ' THR . . . . . 0.542 HG23 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -57.05 -29.37 63.35 Favored 'General case' 0 C--N 1.384 2.103 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.203 167.255 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.647 ' N ' ' O ' ' P' ' 149' ' ' THR . 43.9 mt-30 -74.08 -28.36 61.35 Favored 'General case' 0 C--N 1.388 2.28 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.662 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.1 t -64.29 -71.44 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.077 0 CA-C-N 122.074 2.215 . . . . 0.0 109.399 164.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.899 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.36 -59.35 0.45 Allowed 'General case' 0 C--N 1.386 2.154 0 CA-C-O 122.969 1.366 . . . . 0.0 110.853 -177.518 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.542 HG12 HG23 ' P' ' 151' ' ' THR . 0.5 OUTLIER -52.43 -47.19 47.49 Favored 'Isoleucine or valine' 0 C--N 1.389 2.309 0 CA-C-N 112.653 -2.067 . . . . 0.0 108.7 -176.121 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.983 ' HB3' HD21 ' P' ' 124' ' ' LEU . 6.2 t90 -66.58 -32.13 73.28 Favored 'General case' 0 C--N 1.382 2.013 0 O-C-N 121.432 -0.792 . . . . 0.0 109.144 177.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.847 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 63.7 m-85 -75.57 -40.04 57.26 Favored 'General case' 0 C--O 1.275 2.419 0 O-C-N 120.962 -1.086 . . . . 0.0 112.275 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -46.91 -66.62 0.38 Allowed 'General case' 0 C--N 1.376 1.737 0 O-C-N 119.44 -2.038 . . . . 0.0 107.171 165.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -56.01 -23.81 35.26 Favored 'General case' 0 C--N 1.391 2.403 0 CA-C-N 113.994 -1.457 . . . . 0.0 109.324 -161.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.539 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.8 OUTLIER -78.87 -40.11 33.38 Favored 'General case' 0 C--O 1.288 3.116 0 CA-C-N 121.249 1.84 . . . . 0.0 111.78 174.377 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.705 ' HD2' ' HE1' ' P' ' 133' ' ' TYR 0.278 40.0 mtm180 -68.49 -25.23 64.87 Favored 'General case' 0 C--O 1.271 2.213 0 CA-C-N 123.588 2.904 . . . . 0.0 110.531 -176.619 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.461 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 5.1 t80 -68.3 -44.57 75.15 Favored 'General case' 0 C--N 1.379 1.866 0 CA-C-N 121.893 2.133 . . . . 0.0 109.055 170.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt -65.68 -39.08 90.93 Favored 'General case' 0 C--N 1.381 1.963 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 -167.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.568 ' O ' ' HB1' ' P' ' 167' ' ' ALA . 0.5 OUTLIER -54.41 -59.59 4.48 Favored 'General case' 0 C--N 1.378 1.82 0 CA-C-O 124.857 2.265 . . . . 0.0 106.64 -172.208 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.503 ' HG2' HG21 ' P' ' 164' ' ' THR . 0.3 OUTLIER -58.77 -42.22 88.42 Favored 'General case' 0 C--N 1.385 2.149 0 CA-C-N 108.558 -3.928 . . . . 0.0 108.573 -164.977 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . 0.419 ' HG3' ' CZ ' ' P' ' 162' ' ' TYR . 0.9 OUTLIER -52.64 -48.71 66.23 Favored 'General case' 0 C--N 1.38 1.906 0 CA-C-N 113.313 -1.767 . . . . 0.0 110.252 176.645 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . 0.568 ' HB1' ' O ' ' P' ' 164' ' ' THR . . . -45.12 -41.56 8.03 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.585 -2.098 . . . . 0.0 108.731 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -80.71 -27.06 37.06 Favored 'General case' 0 C--N 1.388 2.266 0 CA-C-N 111.886 -2.415 . . . . 0.0 110.723 -167.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -51.64 -30.23 20.76 Favored 'General case' 0 C--N 1.389 2.306 0 CA-C-N 113.509 -1.678 . . . . 0.0 109.462 169.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . 0.634 ' OE2' ' HE1' ' P' ' 173' ' ' TYR . 5.4 tm-20 -74.21 -34.79 63.81 Favored 'General case' 0 C--N 1.385 2.152 0 CA-C-N 113.376 -1.738 . . . . 0.0 108.142 -163.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -88.6 88.18 7.52 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-N 113.99 -1.459 . . . . 0.0 109.189 -158.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 123.52 -64.86 0.53 Allowed Glycine 0 C--N 1.383 3.139 0 N-CA-C 108.7 -1.76 . . . . 0.0 108.7 -163.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . 0.634 ' HE1' ' OE2' ' P' ' 170' ' ' GLU . 26.7 m-85 108.22 149.75 0.0 OUTLIER 'General case' 0 C--N 1.385 2.124 0 CA-C-N 112.753 -1.724 . . . . 0.0 109.07 169.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.44 72.15 5.18 Favored 'General case' 0 C--N 1.387 2.238 0 CA-C-N 111.796 -2.456 . . . . 0.0 109.331 167.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -48.93 115.6 2.77 Favored Glycine 0 C--N 1.379 2.954 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 170.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -70.69 147.64 94.59 Favored Pre-proline 0 CA--C 1.58 2.128 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 171.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo . . . . . 0 CA--C 1.594 3.524 0 C-N-CA 121.463 1.442 . . . . 0.0 111.59 163.704 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . 0.596 ' C4 ' ' C2 ' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.743 0 O5'-C5'-C4' 114.272 2.908 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.933 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.299 0 O4'-C4'-C3' 108.171 2.571 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.933 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.784 0 P-O3'-C3' 122.528 2.357 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.609 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.393 0 P-O3'-C3' 122.84 2.616 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.534 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.556 3.782 1 P-O3'-C3' 125.651 4.96 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.576 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.004 1 P-O3'-C3' 127.536 6.53 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.6 H5'' HD21 ' P' ' 115' ' ' LEU . . . . . . . . 0 C4'--C3' 1.564 3.633 1 O4'-C1'-N19 111.276 4.345 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.796 H2'' " C5'" ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.711 0 O5'-C5'-C4' 114.23 2.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.796 " C5'" H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.517 0 O5'-C5'-C4' 113.898 2.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.611 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.809 1 P-O3'-C3' 126.902 6.002 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.522 H2'' ' C8 ' ' A' ' 12' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.445 0 O4'-C4'-C3' 108.17 2.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . 0.522 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.4 0 P-O3'-C3' 122.501 2.334 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.504 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.633 0 O4'-C4'-C3' 108.418 2.818 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.846 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.71 0 C4'-C3'-C2' 100.964 -2.236 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.846 H5'' H2'' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.838 1 O4'-C1'-N19 111.207 4.259 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.711 ' H72' ' C8 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.563 0 P-O3'-C3' 122.195 2.079 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.65 0 O5'-C5'-C4' 115.075 3.482 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.55 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.622 0 O4'-C4'-C3' 108.215 2.615 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.55 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.424 0 P-O3'-C3' 124.28 3.817 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.517 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.412 0 O4'-C4'-C3' 108.09 2.49 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.701 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.57 4.232 0 N19-C1'-C2' 119.12 3.075 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.701 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.557 3.886 0 N19-C1'-C2' 118.692 2.808 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.549 ' N3 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.568 3.976 1 P-O3'-C3' 124.81 4.259 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.774 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.699 0 P-O3'-C3' 123.219 2.932 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.774 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.782 0 P-O3'-C3' 124.375 3.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.485 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.557 3.932 0 N19-C1'-C2' 119.2 3.125 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.603 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.725 0 P-O3'-C3' 122.852 2.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.624 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.338 0 P-O3'-C3' 122.612 2.427 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.624 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.623 0 O4'-C4'-C3' 108.284 2.684 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.599 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.319 0 O4'-C4'-C3' 107.906 2.306 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.599 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.69 0 O4'-C4'-C3' 108.566 2.966 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . 0.596 ' C2 ' ' C4 ' ' A' ' 1' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.543 4.022 1 P-O3'-C3' 125.052 4.46 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.475 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.58 128.5 56.06 Favored 'General case' 0 C--N 1.383 2.025 0 CA-C-N 113.669 -1.605 . . . . 0.0 108.632 173.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 170.28 -38.38 0.0 OUTLIER 'General case' 0 C--N 1.388 2.258 0 CA-C-N 113.565 -1.652 . . . . 0.0 107.996 -178.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . 0.495 ' O ' HD22 ' P' ' 105' ' ' LEU . . . -91.03 -35.34 7.16 Favored Glycine 0 C--N 1.381 3.065 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 -163.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.495 HD22 ' O ' ' P' ' 104' ' ' GLY . 0.2 OUTLIER -133.03 162.37 58.05 Favored Pre-proline 0 CA--C 1.582 2.193 0 CA-C-N 113.705 -1.248 . . . . 0.0 108.779 -178.551 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.475 ' HG2' ' O ' ' P' ' 106' ' ' PRO . 0.2 OUTLIER -95.19 76.41 0.15 Allowed 'Trans proline' 0 C--N 1.394 2.946 0 C-N-CA 123.692 2.928 . . . . 0.0 110.273 -160.304 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 29.7 m-20 -65.38 158.39 26.74 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.745 -1.57 . . . . 0.0 109.174 -171.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.88 85.7 7.05 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.701 -1.591 . . . . 0.0 108.178 -172.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.505 ' HB3' ' HE2' ' P' ' 109' ' ' LYS . 0.1 OUTLIER -68.04 168.92 11.02 Favored 'General case' 0 C--N 1.381 1.972 0 CA-C-N 113.668 -1.606 . . . . 0.0 109.054 177.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.472 ' N ' ' HE3' ' P' ' 109' ' ' LYS . 0.3 OUTLIER -124.73 79.06 1.74 Allowed 'General case' 0 C--N 1.382 2.008 0 CA-C-N 113.652 -1.613 . . . . 0.0 108.646 -156.306 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.417 ' NZ ' ' HB3' ' P' ' 111' ' ' LYS . 0.0 OUTLIER -25.64 89.63 0.0 OUTLIER 'General case' 0 C--N 1.381 1.964 0 C-N-CA 126.456 1.902 . . . . 0.0 110.501 177.085 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 3.7 mtp-105 -53.79 -173.13 0.0 OUTLIER 'General case' 0 C--N 1.383 2.024 0 CA-C-N 112.684 -2.053 . . . . 0.0 109.447 155.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.89 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.5 OUTLIER -99.53 120.7 40.07 Favored 'General case' 0 C--N 1.382 2.009 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 154.917 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.447 HG12 ' O ' ' P' ' 114' ' ' VAL . 14.4 p -111.06 59.61 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.1 0 CA-C-O 124.911 2.291 . . . . 0.0 107.769 -156.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.89 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.12 139.63 40.02 Favored 'General case' 0 C--N 1.39 2.349 0 CA-C-N 111.106 -2.77 . . . . 0.0 109.923 -155.072 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.574 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.5 OUTLIER -91.4 147.07 23.3 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-N 114.213 -1.358 . . . . 0.0 108.273 178.529 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.16 149.07 51.0 Favored 'General case' 0 C--N 1.383 2.06 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 -175.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -44.85 -36.35 3.23 Favored 'General case' 0 C--N 1.382 1.981 0 CA-C-N 113.165 -1.834 . . . . 0.0 109.219 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.0 -63.78 1.03 Allowed 'General case' 0 C--N 1.382 2.008 0 CA-C-O 124.266 1.984 . . . . 0.0 109.22 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.574 ' O ' HD13 ' P' ' 124' ' ' LEU . 80.0 mt-30 -52.33 -43.17 64.42 Favored 'General case' 0 C--N 1.382 1.989 0 CA-C-N 112.407 -2.179 . . . . 0.0 109.734 177.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.524 ' HA ' HD13 ' P' ' 124' ' ' LEU . 16.9 m -54.39 -55.49 28.09 Favored 'General case' 0 C--N 1.381 1.965 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 169.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.68 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.6 OUTLIER -53.04 -47.57 68.28 Favored 'General case' 0 C--N 1.383 2.045 0 CA-C-O 122.622 1.201 . . . . 0.0 110.003 -169.805 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.862 ' HB2' HD12 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -66.52 -38.38 87.08 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 113.864 -1.516 . . . . 0.0 108.004 179.936 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.954 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.1 mt -61.05 -50.56 72.82 Favored 'General case' 0 C--N 1.385 2.12 0 O-C-N 120.169 -1.582 . . . . 0.0 109.544 171.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.591 ' O ' ' N ' ' P' ' 129' ' ' ARG . 13.4 mt-10 -55.14 -44.65 75.29 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 122.756 1.265 . . . . 0.0 109.4 178.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.68 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -49.23 -66.77 0.34 Allowed 'General case' 0 C--N 1.377 1.795 0 CA-C-N 112.08 -2.327 . . . . 0.0 108.405 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.659 ' HB3' HD12 ' P' ' 134' ' ' LEU . 4.0 mmt85 -58.47 -36.01 73.07 Favored 'General case' 0 C--N 1.381 1.97 0 CA-C-N 113.29 -1.777 . . . . 0.0 109.61 -177.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.826 ' HD2' ' HD1' ' P' ' 157' ' ' PHE . 11.5 t80 -67.44 -51.81 47.12 Favored 'General case' 0 C--N 1.385 2.141 0 CA-C-N 119.627 1.103 . . . . 0.0 110.266 174.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.591 ' N ' ' O ' ' P' ' 125' ' ' GLU . 0.2 OUTLIER -62.79 -14.82 49.71 Favored 'General case' 0 C--N 1.379 1.889 0 CA-C-N 112.815 -1.993 . . . . 0.0 108.203 -164.466 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -104.61 -40.09 6.14 Favored 'General case' 0 C--N 1.378 1.846 0 C-N-CA 126.327 1.851 . . . . 0.0 106.966 -171.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.504 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.5 OUTLIER -155.74 98.73 1.95 Allowed 'General case' 0 C--N 1.385 2.145 0 CA-C-N 111.952 -2.385 . . . . 0.0 110.003 -153.2 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . 0.506 ' HG2' ' CD2' ' P' ' 133' ' ' TYR . 0.1 OUTLIER -76.53 -6.72 53.06 Favored 'General case' 0 C--N 1.394 2.523 0 CA-C-N 112.133 -2.303 . . . . 0.0 110.985 -162.164 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.538 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 6.0 m-85 -162.68 108.51 1.19 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.0 -156.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.659 HD12 ' HB3' ' P' ' 127' ' ' ARG . 15.0 mt -122.44 135.65 54.72 Favored 'General case' 0 C--N 1.4 2.764 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -154.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.23 154.52 25.37 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 169.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.551 ' HB2' ' HD3' ' P' ' 137' ' ' PRO . . . -58.92 -49.23 94.5 Favored Pre-proline 0 CA--C 1.583 2.249 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.438 -161.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.551 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 81.9 Cg_exo -58.7 -29.61 90.0 Favored 'Trans proline' 0 C--N 1.401 3.341 0 N-CA-C 115.016 1.122 . . . . 0.0 115.016 -173.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.588 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -54.89 -70.48 0.1 Allowed 'General case' 0 C--N 1.382 2.006 0 CA-C-O 124.754 2.216 . . . . 0.0 106.31 161.905 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 1.015 ' NH2' ' HG3' ' P' ' 154' ' ' LYS . 2.0 ptt85 -66.85 -40.63 87.98 Favored 'General case' 0 C--N 1.393 2.476 0 CA-C-N 109.97 -3.287 . . . . 0.0 108.684 -155.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.627 ' O ' ' N ' ' P' ' 144' ' ' SER . 3.5 mt-10 -53.57 -41.01 66.09 Favored 'General case' 0 C--N 1.38 1.931 0 O-C-N 120.68 -1.262 . . . . 0.0 108.486 176.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . 0.419 ' HA ' ' HB2' ' P' ' 144' ' ' SER . 5.6 t-160 -63.71 -37.89 89.05 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 112.933 -1.939 . . . . 0.0 109.15 -172.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.862 HD12 ' HB2' ' P' ' 123' ' ' GLU . 0.8 OUTLIER -58.1 -45.78 86.65 Favored 'General case' 0 C--N 1.386 2.172 0 CA-C-O 123.136 1.446 . . . . 0.0 109.056 167.278 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -62.87 -33.18 74.74 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 112.175 -2.284 . . . . 0.0 109.093 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.627 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.6 OUTLIER -73.66 -39.76 64.2 Favored 'General case' 0 C--N 1.384 2.101 0 CA-C-N 114.071 -1.422 . . . . 0.0 109.471 -177.52 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 40.1 mt -66.87 -47.41 71.97 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-O 124.57 2.128 . . . . 0.0 108.491 -166.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.994 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -98.41 -12.74 8.29 Favored 'Isoleucine or valine' 0 C--N 1.389 2.312 0 CA-C-N 110.87 -2.877 . . . . 0.0 107.954 -166.932 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 82.34 35.43 0.07 Allowed 'General case' 0 C--N 1.381 1.959 0 CA-C-O 125.774 2.702 . . . . 0.0 107.788 153.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.994 HD13 ' CD1' ' P' ' 146' ' ' ILE . 7.7 mt -96.17 170.28 9.37 Favored 'General case' 0 C--N 1.397 2.642 0 CA-C-N 111.54 -2.573 . . . . 0.0 109.42 168.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.618 ' O ' ' N ' ' P' ' 152' ' ' GLN . 19.2 p -92.93 144.65 28.79 Favored Pre-proline 0 CA--C 1.59 2.484 0 CA-C-O 123.168 1.461 . . . . 0.0 108.977 171.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.473 ' HB2' ' NH1' ' P' ' 139' ' ' ARG . 1.2 Cg_endo -58.76 -38.98 86.13 Favored 'Trans proline' 1 C--N 1.416 4.096 0 C-N-CA 122.616 2.211 . . . . 0.0 113.064 -156.093 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -34.89 62.75 Favored 'General case' 0 C--N 1.383 2.048 0 C-N-CA 119.945 -0.702 . . . . 0.0 109.755 167.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.618 ' N ' ' O ' ' P' ' 149' ' ' THR . 46.1 mt-30 -69.89 -27.92 65.2 Favored 'General case' 0 C--N 1.389 2.295 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 -176.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.64 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.4 t -64.39 -72.37 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.122 0 CA-C-N 121.273 1.852 . . . . 0.0 109.629 164.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 1.015 ' HG3' ' NH2' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.26 -55.3 0.51 Allowed 'General case' 0 C--N 1.383 2.065 0 C-N-CA 124.975 1.31 . . . . 0.0 110.536 -176.402 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 11.3 mm -61.49 -40.57 86.87 Favored 'Isoleucine or valine' 0 C--N 1.383 2.041 0 CA-C-N 113.999 -1.455 . . . . 0.0 109.481 -173.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.954 ' HB3' HD21 ' P' ' 124' ' ' LEU . 5.3 t90 -67.37 -31.53 71.83 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 121.168 -0.957 . . . . 0.0 109.195 172.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.826 ' HD1' ' HD2' ' P' ' 128' ' ' PHE . 30.1 m-85 -75.42 -42.85 52.59 Favored 'General case' 0 C--O 1.274 2.383 0 O-C-N 121.132 -0.98 . . . . 0.0 111.871 175.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -49.27 -60.37 2.87 Favored 'General case' 0 C--N 1.378 1.807 0 O-C-N 119.51 -1.994 . . . . 0.0 107.117 169.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -56.01 -24.99 42.44 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-O 117.677 -1.154 . . . . 0.0 109.494 -166.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.551 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.5 OUTLIER -77.15 -45.45 26.74 Favored 'General case' 0 C--O 1.284 2.88 0 CA-C-N 121.374 1.897 . . . . 0.0 111.479 178.344 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.828 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -67.55 -39.89 84.95 Favored 'General case' 0 C--O 1.267 1.988 0 CA-C-N 122.586 2.448 . . . . 0.0 109.513 -164.007 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.435 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 49.3 t80 -65.12 -35.19 80.35 Favored 'General case' 0 C--N 1.38 1.931 0 O-C-N 120.176 -1.578 . . . . 0.0 108.694 170.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.2 -28.93 69.13 Favored 'General case' 0 C--N 1.381 1.962 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -170.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.828 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -71.65 -56.42 5.87 Favored 'General case' 0 CA--C 1.573 1.844 0 CA-C-O 125.685 2.66 . . . . 0.0 105.844 -166.128 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.407 ' CD ' ' O ' ' P' ' 161' ' ' ARG . 9.5 mtpt -59.13 -45.05 91.94 Favored 'General case' 0 C--N 1.391 2.395 1 CA-C-N 107.772 -4.286 . . . . 0.0 109.157 -169.604 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 -62.1 -36.37 81.52 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-N 112.571 -2.104 . . . . 0.0 109.297 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . 0.593 ' HB1' ' O ' ' P' ' 164' ' ' THR . . . -47.42 -40.98 19.24 Favored 'General case' 0 C--N 1.385 2.113 0 CA-C-O 123.541 1.639 . . . . 0.0 108.301 176.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -80.97 -24.0 38.37 Favored 'General case' 0 C--N 1.391 2.399 0 CA-C-N 111.609 -2.541 . . . . 0.0 109.96 -166.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -58.7 -28.02 65.39 Favored 'General case' 0 C--N 1.383 2.059 0 CA-C-N 113.591 -1.64 . . . . 0.0 109.494 170.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -73.56 -43.5 59.7 Favored 'General case' 0 C--N 1.386 2.156 0 CA-C-N 113.648 -1.615 . . . . 0.0 108.175 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.36 94.86 8.04 Favored 'General case' 0 C--N 1.38 1.924 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.273 -161.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 127.67 -62.22 0.63 Allowed Glycine 0 C--N 1.382 3.108 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 -164.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 117.61 165.65 0.0 OUTLIER 'General case' 0 C--N 1.381 1.959 0 CA-C-N 113.009 -1.596 . . . . 0.0 109.013 163.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -83.26 69.48 9.96 Favored 'General case' 0 C--N 1.381 1.978 0 CA-C-N 112.195 -2.275 . . . . 0.0 108.821 174.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -126.48 106.4 0.84 Allowed Glycine 0 C--N 1.383 3.185 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 161.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -158.96 124.01 2.26 Favored Pre-proline 0 CA--C 1.58 2.125 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo . . . . . 0 CA--C 1.594 3.5 0 C-N-CA 121.482 1.454 . . . . 0.0 111.61 173.443 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.844 0 O5'-C5'-C4' 114.357 2.969 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.662 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.369 1 P-O3'-C3' 127.127 6.189 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.662 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.886 0 P-O3'-C3' 123.115 2.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.626 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 P-O3'-C3' 123.565 3.221 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.553 ' H71' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.905 1 P-O3'-C3' 125.592 4.91 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.551 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.567 3.894 1 P-O3'-C3' 126.348 5.54 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 1.051 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 C3'-C2'-C1' 106.731 2.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 1.051 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.566 0 O5'-C5'-C4' 113.785 2.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.619 ' C8 ' ' H71' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.537 0 O5'-C5'-C4' 113.906 2.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.619 ' H71' ' C8 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.781 0 P-O3'-C3' 124.017 3.597 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.521 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.561 3.348 0 P-O3'-C3' 122.718 2.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.411 0 P-O3'-C3' 123.742 3.368 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.502 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.583 0 O4'-C4'-C3' 108.4 2.8 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.502 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.595 0 C4'-C3'-C2' 100.817 -2.383 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.638 ' C8 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.861 1 O4'-C1'-N19 111.327 4.409 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.638 ' H72' ' C8 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.544 0 P-O3'-C3' 122.173 2.061 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.764 0 O5'-C5'-C4' 115.069 3.478 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.589 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.658 1 P-O3'-C3' 125.459 4.799 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.589 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.607 0 P-O3'-C3' 122.685 2.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.31 0 O4'-C4'-C3' 108.063 2.463 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.578 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.571 4.336 0 N19-C1'-C2' 119.243 3.152 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.578 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.561 4.319 1 P-O3'-C3' 126.688 5.823 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.628 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.437 1 P-O3'-C3' 127.137 6.197 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.871 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.562 3.449 0 O4'-C4'-C3' 108.559 2.959 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.871 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.237 0 C2'-C3'-O3' 117.057 2.392 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.536 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.242 0 P-O3'-C3' 124.08 3.65 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.606 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.645 0 P-O3'-C3' 124.295 3.829 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.61 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.595 0 C4'-C3'-C2' 100.539 -2.661 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.626 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.653 1 P-O3'-C3' 124.578 4.065 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.588 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.361 0 O4'-C4'-C3' 108.161 2.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.634 ' N4 ' ' O6 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.68 0 P-O3'-C3' 123.549 3.208 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.968 0 O4'-C1'-N19 109.321 1.901 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.528 3.463 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 4.6 m -161.54 164.36 29.58 Favored 'General case' 0 C--N 1.382 1.986 0 CA-C-N 113.677 -1.601 . . . . 0.0 108.617 -170.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 170.38 -38.33 0.0 OUTLIER 'General case' 0 C--N 1.389 2.288 0 CA-C-N 113.498 -1.683 . . . . 0.0 107.949 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -176.96 127.58 1.23 Allowed Glycine 0 C--N 1.381 3.067 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 -163.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.442 HD22 ' HD2' ' P' ' 106' ' ' PRO . 0.2 OUTLIER -139.72 170.8 9.06 Favored Pre-proline 0 CA--C 1.582 2.19 0 CA-C-N 113.751 -1.224 . . . . 0.0 108.804 -171.98 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.445 ' HG2' ' O ' ' P' ' 106' ' ' PRO . 0.2 OUTLIER -94.73 75.76 0.19 Allowed 'Trans proline' 0 C--N 1.395 2.974 0 C-N-CA 123.871 3.047 . . . . 0.0 110.239 -166.099 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 56.34 -164.17 0.15 Allowed 'General case' 0 C--N 1.382 1.982 0 CA-C-N 113.713 -1.585 . . . . 0.0 109.141 -170.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.655 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -133.08 -68.37 0.59 Allowed 'General case' 0 C--N 1.382 1.986 0 CA-C-N 113.696 -1.593 . . . . 0.0 108.107 176.056 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.683 ' HE3' ' CA ' ' P' ' 109' ' ' LYS . 0.0 OUTLIER -72.9 162.46 29.46 Favored 'General case' 0 C--N 1.382 1.984 0 CA-C-N 113.576 -1.647 . . . . 0.0 109.269 175.627 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.655 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 2.1 mmt-85 -125.08 83.26 2.14 Favored 'General case' 0 C--N 1.383 2.052 0 CA-C-N 113.645 -1.616 . . . . 0.0 108.912 -157.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.514 ' HD3' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -27.68 92.43 0.01 OUTLIER 'General case' 0 C--N 1.381 1.942 0 CA-C-N 113.15 -1.841 . . . . 0.0 109.975 172.949 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 23.7 mtt-85 -61.25 -173.11 0.03 OUTLIER 'General case' 0 C--N 1.388 2.264 0 CA-C-N 112.0 -2.364 . . . . 0.0 108.889 155.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.905 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.5 OUTLIER -93.94 120.38 34.11 Favored 'General case' 0 C--N 1.383 2.058 0 CA-C-N 113.986 -1.461 . . . . 0.0 107.217 156.21 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.535 HG12 ' OP1' ' A' ' 8' ' ' ' DA' . 8.4 p -113.3 61.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.111 0 CA-C-O 124.937 2.303 . . . . 0.0 107.668 -157.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.905 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.06 142.18 39.95 Favored 'General case' 0 C--N 1.388 2.281 0 CA-C-N 111.129 -2.759 . . . . 0.0 110.056 -154.452 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.644 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.7 OUTLIER -93.19 146.21 23.85 Favored 'General case' 0 C--N 1.381 1.967 0 CA-C-N 113.404 -1.725 . . . . 0.0 108.447 178.214 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.84 148.58 50.99 Favored 'General case' 0 C--N 1.384 2.105 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 -174.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 22.9 ttmt -44.9 -36.72 3.47 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-N 113.134 -1.848 . . . . 0.0 109.17 -177.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.35 -62.06 1.89 Allowed 'General case' 0 C--N 1.383 2.046 0 CA-C-O 124.242 1.973 . . . . 0.0 109.242 174.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.601 ' O ' HD13 ' P' ' 124' ' ' LEU . 82.0 mt-30 -54.48 -45.55 73.24 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 112.538 -2.119 . . . . 0.0 109.872 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.488 ' HA ' HD13 ' P' ' 124' ' ' LEU . 10.7 m -49.74 -56.68 9.35 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 168.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.76 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.4 OUTLIER -52.94 -48.27 67.47 Favored 'General case' 0 C--N 1.382 2.01 0 CA-C-O 122.609 1.195 . . . . 0.0 110.052 -168.985 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.875 ' CG ' HG23 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.75 -37.1 83.96 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.113 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.893 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.9 mt -60.52 -51.86 67.66 Favored 'General case' 0 C--N 1.384 2.086 0 O-C-N 120.281 -1.512 . . . . 0.0 109.493 170.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.571 ' O ' ' N ' ' P' ' 129' ' ' ARG . 10.2 mt-10 -55.35 -48.97 73.44 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-O 122.686 1.231 . . . . 0.0 109.598 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.76 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.92 -67.52 0.25 Allowed 'General case' 0 C--N 1.378 1.814 0 CA-C-N 112.191 -2.277 . . . . 0.0 109.14 174.954 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.824 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.5 OUTLIER -60.33 -37.87 81.98 Favored 'General case' 0 C--N 1.39 2.37 0 CA-C-N 112.388 -2.187 . . . . 0.0 108.191 -171.345 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.808 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 15.7 t80 -69.94 -47.59 61.74 Favored 'General case' 0 C--N 1.381 1.976 0 O-C-N 121.409 -0.807 . . . . 0.0 110.183 177.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.571 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.6 mmm180 -62.35 -20.04 63.98 Favored 'General case' 0 C--N 1.38 1.927 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -168.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -91.58 -42.55 10.16 Favored 'General case' 0 C--N 1.379 1.85 0 CA-C-O 124.126 1.917 . . . . 0.0 106.935 -174.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.484 ' HG2' ' CD2' ' P' ' 134' ' ' LEU . 2.6 tp-100 -152.81 123.87 7.5 Favored 'General case' 0 C--N 1.386 2.169 0 CA-C-N 111.422 -2.626 . . . . 0.0 110.313 -155.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . 0.53 ' HG2' ' CG ' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -79.29 -23.83 43.31 Favored 'General case' 0 C--N 1.386 2.166 0 CA-C-N 112.784 -2.007 . . . . 0.0 110.8 -173.172 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.691 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 1.0 OUTLIER -155.22 112.21 3.28 Favored 'General case' 0 C--N 1.377 1.798 0 CA-C-O 123.472 1.606 . . . . 0.0 108.986 -152.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.824 HD12 ' HD3' ' P' ' 127' ' ' ARG . 27.3 mt -123.22 134.79 54.1 Favored 'General case' 0 C--N 1.405 3.011 0 CA-C-N 112.598 -2.092 . . . . 0.0 108.042 -160.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.08 155.24 26.39 Favored 'General case' 0 C--N 1.382 1.988 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 167.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.558 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.46 -49.42 92.44 Favored Pre-proline 0 CA--C 1.583 2.244 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.233 -160.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.558 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 76.7 Cg_exo -58.63 -29.23 88.6 Favored 'Trans proline' 0 C--N 1.401 3.332 0 C-N-CA 121.057 1.171 . . . . 0.0 115.041 -175.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.655 ' HG3' HD21 ' P' ' 134' ' ' LEU . 2.4 mm-40 -54.02 -70.43 0.1 Allowed 'General case' 0 C--N 1.38 1.896 0 CA-C-O 124.624 2.154 . . . . 0.0 106.456 160.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.873 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.18 -39.15 82.6 Favored 'General case' 0 C--N 1.39 2.368 0 CA-C-N 109.907 -3.315 . . . . 0.0 108.75 -154.592 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.62 ' O ' ' N ' ' P' ' 144' ' ' SER . 5.1 mt-10 -53.36 -39.02 63.83 Favored 'General case' 0 C--N 1.38 1.91 0 CA-C-O 122.61 1.195 . . . . 0.0 108.505 177.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -63.54 -37.13 86.13 Favored 'General case' 0 C--N 1.379 1.879 0 CA-C-N 113.016 -1.902 . . . . 0.0 109.322 -173.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.785 HD12 ' HB2' ' P' ' 123' ' ' GLU . 0.7 OUTLIER -58.7 -46.12 87.98 Favored 'General case' 0 C--N 1.387 2.201 0 CA-C-O 122.974 1.368 . . . . 0.0 108.87 166.287 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.557 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -63.38 -31.71 72.93 Favored 'General case' 0 C--N 1.385 2.139 0 CA-C-N 112.339 -2.21 . . . . 0.0 109.217 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.62 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.9 OUTLIER -74.25 -41.56 61.08 Favored 'General case' 0 C--N 1.384 2.08 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.666 179.552 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . 0.567 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 43.5 mt -65.13 -48.44 73.57 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-O 124.906 2.289 . . . . 0.0 108.039 -165.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.979 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.51 -16.94 7.02 Favored 'Isoleucine or valine' 0 C--N 1.386 2.153 0 CA-C-N 110.316 -3.129 . . . . 0.0 107.739 -170.828 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . 0.612 ' HG3' ' O ' ' P' ' 144' ' ' SER . 0.1 OUTLIER 81.21 37.71 0.08 Allowed 'General case' 0 C--N 1.386 2.188 0 CA-C-N 111.375 -2.648 . . . . 0.0 108.055 153.008 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.979 HD13 ' CD1' ' P' ' 146' ' ' ILE . 5.7 mt -95.03 168.5 10.74 Favored 'General case' 0 C--N 1.39 2.354 0 CA-C-N 112.224 -2.262 . . . . 0.0 109.294 168.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.65 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.9 p -88.6 143.03 31.44 Favored Pre-proline 0 CA--C 1.588 2.415 0 CA-C-O 122.854 1.311 . . . . 0.0 108.01 173.128 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -60.19 -37.41 83.47 Favored 'Trans proline' 0 C--N 1.413 3.953 0 C-N-CA 122.652 2.235 . . . . 0.0 112.054 -155.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 151' ' ' THR . . . . . 0.431 HG23 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -58.35 -29.06 65.67 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.67 167.507 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.65 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.9 mt-30 -73.52 -28.33 61.83 Favored 'General case' 0 C--N 1.39 2.333 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.678 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.2 t -64.48 -71.14 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.077 0 CA-C-N 121.901 2.137 . . . . 0.0 109.597 165.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.873 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.95 -57.98 0.45 Allowed 'General case' 0 C--N 1.385 2.139 0 C-N-CA 124.762 1.225 . . . . 0.0 110.531 -176.916 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.589 HD11 ' OE1' ' P' ' 158' ' ' GLN . 0.2 OUTLIER -58.59 -42.39 84.63 Favored 'Isoleucine or valine' 0 C--N 1.383 2.057 0 CA-C-N 113.389 -1.732 . . . . 0.0 108.994 -172.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.893 ' HB3' HD21 ' P' ' 124' ' ' LEU . 5.4 t90 -66.68 -32.23 73.42 Favored 'General case' 0 C--N 1.385 2.11 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.808 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 49.0 m-85 -74.35 -40.56 62.06 Favored 'General case' 0 C--O 1.272 2.261 0 O-C-N 121.072 -1.018 . . . . 0.0 111.998 173.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.589 ' OE1' HD11 ' P' ' 155' ' ' ILE . 73.2 mt-30 -50.97 -59.32 4.27 Favored 'General case' 0 C--N 1.378 1.813 0 O-C-N 119.664 -1.898 . . . . 0.0 106.77 169.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -56.04 -25.01 43.02 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.923 -166.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.557 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.4 OUTLIER -77.39 -47.58 19.47 Favored 'General case' 0 C--O 1.281 2.736 0 CA-C-N 121.714 2.052 . . . . 0.0 111.327 175.354 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.691 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -67.89 -34.14 76.07 Favored 'General case' 0 C--O 1.266 1.957 0 CA-C-N 122.985 2.63 . . . . 0.0 110.762 -160.694 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.507 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 14.2 t80 -69.0 -35.9 77.21 Favored 'General case' 0 C--N 1.38 1.928 0 O-C-N 119.967 -1.708 . . . . 0.0 109.51 171.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 4.0 mmmt -65.16 -42.87 93.3 Favored 'General case' 0 C--N 1.382 2.0 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -169.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.593 ' O ' ' HB1' ' P' ' 167' ' ' ALA . 0.5 OUTLIER -54.2 -60.59 3.14 Favored 'General case' 0 CA--C 1.573 1.831 0 CA-C-O 124.733 2.206 . . . . 0.0 106.472 -170.633 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.464 ' HG2' HG21 ' P' ' 164' ' ' THR . 8.6 mmmt -59.33 -45.0 92.56 Favored 'General case' 0 C--N 1.386 2.156 1 CA-C-N 108.221 -4.081 . . . . 0.0 108.81 -163.67 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . 0.479 ' HB2' ' CZ ' ' P' ' 162' ' ' TYR . 0.0 OUTLIER -61.29 -37.19 82.29 Favored 'General case' 0 C--N 1.383 2.022 0 CA-C-N 112.289 -2.232 . . . . 0.0 108.596 -175.73 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . 0.593 ' HB1' ' O ' ' P' ' 164' ' ' THR . . . -50.81 -41.19 57.08 Favored 'General case' 0 C--N 1.386 2.196 0 CA-C-N 113.581 -1.645 . . . . 0.0 108.862 177.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -81.82 -21.53 37.6 Favored 'General case' 0 C--N 1.388 2.278 0 CA-C-N 111.715 -2.493 . . . . 0.0 110.297 -168.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.94 -31.19 66.6 Favored 'General case' 0 C--N 1.386 2.169 0 CA-C-N 113.931 -1.486 . . . . 0.0 109.533 169.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -68.52 -33.53 74.29 Favored 'General case' 0 C--N 1.387 2.225 0 CA-C-N 112.874 -1.966 . . . . 0.0 108.235 -167.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 49.1 mttp -91.92 88.03 6.45 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-N 113.992 -1.458 . . . . 0.0 109.257 -155.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 132.29 -61.76 0.65 Allowed Glycine 0 C--N 1.383 3.145 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 -157.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 20.8 m-30 120.64 166.97 0.0 OUTLIER 'General case' 0 C--N 1.382 1.982 0 CA-C-N 113.092 -1.554 . . . . 0.0 108.883 160.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.03 54.32 2.89 Favored 'General case' 0 C--N 1.387 2.197 0 CA-C-N 112.162 -2.29 . . . . 0.0 109.472 175.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -64.44 100.45 0.42 Allowed Glycine 0 C--N 1.38 2.996 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 -160.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -173.54 138.65 0.77 Allowed Pre-proline 0 CA--C 1.581 2.155 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 -171.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo . . . . . 0 CA--C 1.593 3.443 0 C-N-CA 121.507 1.471 . . . . 0.0 111.631 176.924 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.77 0 O5'-C5'-C4' 114.35 2.965 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.656 " C2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.322 1 P-O3'-C3' 126.845 5.955 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.656 ' H72' " C2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.858 0 P-O3'-C3' 123.008 2.757 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.615 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.387 0 P-O3'-C3' 123.716 3.347 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.545 ' C2 ' ' C2 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.746 0 P-O3'-C3' 122.981 2.734 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.555 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.998 0 N19-C1'-C2' 119.406 3.254 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.579 ' C6 ' ' C6 ' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.391 0 O4'-C1'-N19 110.631 3.539 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.839 H2'' H5'' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.398 0 C4'-C3'-C2' 100.272 -2.928 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.839 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.561 3.337 0 P-O3'-C3' 122.962 2.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.714 ' H71' ' C8 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.822 0 P-O3'-C3' 123.016 2.763 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.513 H2'' ' C8 ' ' A' ' 12' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.456 0 P-O3'-C3' 122.877 2.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . 0.513 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.561 3.308 0 P-O3'-C3' 122.513 2.344 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.496 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.596 0 P-O3'-C3' 122.693 2.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.921 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.61 0 P-O3'-C3' 123.49 3.158 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.926 ' N9 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.544 4.073 0 O4'-C1'-N19 110.985 3.981 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.926 ' H72' ' N9 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.6 0 P-O3'-C3' 124.209 3.757 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.782 0 O5'-C5'-C4' 115.056 3.468 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.6 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.565 1 P-O3'-C3' 125.941 5.201 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.6 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.314 0 P-O3'-C3' 124.094 3.662 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.296 0 O4'-C4'-C3' 108.116 2.516 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.603 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.571 4.341 0 N19-C1'-C2' 119.245 3.153 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.603 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.558 4.016 1 P-O3'-C3' 124.52 4.017 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.546 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.747 0 O4'-C1'-N19 110.053 2.817 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.649 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.721 0 P-O3'-C3' 123.767 3.389 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.649 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.805 0 O4'-C4'-C3' 107.897 2.297 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.528 " C2'" ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.559 4.052 0 N19-C1'-C2' 118.689 2.805 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.606 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.553 3.508 1 P-O3'-C3' 127.373 6.394 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.609 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.553 0 C4'-C3'-C2' 100.354 -2.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.615 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.568 1 P-O3'-C3' 124.52 4.017 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.59 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.401 0 O4'-C4'-C3' 107.984 2.384 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.65 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.586 0 O4'-C4'-C3' 108.367 2.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.886 0 O4'-C1'-N19 109.371 1.964 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.481 0 N-CA-C 107.807 -1.182 . . . . 0.0 107.807 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.42 162.26 13.38 Favored 'General case' 0 C--N 1.382 1.989 0 CA-C-N 113.709 -1.587 . . . . 0.0 108.67 -164.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 170.19 -38.39 0.0 OUTLIER 'General case' 0 C--N 1.388 2.282 0 CA-C-N 113.538 -1.665 . . . . 0.0 108.02 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -129.18 -71.69 0.13 Allowed Glycine 0 C--N 1.382 3.093 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 -167.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.432 ' HB3' ' CD ' ' P' ' 106' ' ' PRO . 1.2 mp -149.13 178.14 1.57 Allowed Pre-proline 0 CA--C 1.583 2.233 0 CA-C-N 113.699 -1.25 . . . . 0.0 108.871 155.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.432 ' CD ' ' HB3' ' P' ' 105' ' ' LEU . 0.8 OUTLIER -50.48 93.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.396 3.032 0 C-N-CA 123.92 3.08 . . . . 0.0 110.552 162.732 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -98.6 139.1 34.82 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-O 122.368 1.08 . . . . 0.0 109.138 155.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.495 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.3 OUTLIER -136.06 35.99 2.81 Favored 'General case' 0 C--N 1.382 1.979 0 CA-C-N 113.781 -1.554 . . . . 0.0 108.221 173.307 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.733 ' HE3' ' H ' ' P' ' 112' ' ' ARG . 0.0 OUTLIER -59.4 153.74 18.45 Favored 'General case' 0 C--N 1.38 1.926 0 CA-C-N 113.75 -1.568 . . . . 0.0 109.567 171.615 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.581 ' N ' ' HG3' ' P' ' 109' ' ' LYS . 2.1 mmt85 -143.32 54.46 1.35 Allowed 'General case' 0 C--N 1.384 2.104 0 CA-C-N 113.605 -1.634 . . . . 0.0 109.519 -170.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.715 ' HD2' " O3'" ' A' ' 8' ' ' ' DA' . 1.6 ttpp 47.99 91.04 0.02 OUTLIER 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.712 -1.586 . . . . 0.0 109.002 -174.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . 0.733 ' H ' ' HE3' ' P' ' 109' ' ' LYS . 2.0 mtp-105 -59.63 -169.61 0.01 OUTLIER 'General case' 0 C--N 1.382 2.012 0 CA-C-N 113.388 -1.733 . . . . 0.0 108.744 155.107 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.883 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.3 OUTLIER -98.38 119.08 36.46 Favored 'General case' 0 C--N 1.382 2.019 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 154.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.514 HG12 ' OP1' ' A' ' 8' ' ' ' DA' . 12.9 p -111.63 59.71 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.13 0 CA-C-O 124.991 2.329 . . . . 0.0 107.651 -156.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.883 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.25 139.99 39.98 Favored 'General case' 0 C--N 1.39 2.344 0 CA-C-N 110.962 -2.835 . . . . 0.0 109.832 -155.043 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.593 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 0.4 OUTLIER -91.11 148.11 22.6 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.268 178.087 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.45 149.48 50.17 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -175.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -44.94 -36.06 3.18 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.538 -1.665 . . . . 0.0 109.252 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -52.88 -62.73 1.46 Allowed 'General case' 0 C--N 1.383 2.033 0 CA-C-O 124.305 2.003 . . . . 0.0 109.128 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.581 ' O ' HD13 ' P' ' 124' ' ' LEU . 80.4 mt-30 -54.85 -43.99 73.57 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-N 112.42 -2.173 . . . . 0.0 109.709 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.458 ' HA ' HD13 ' P' ' 124' ' ' LEU . 9.8 m -51.18 -57.68 8.12 Favored 'General case' 0 C--N 1.385 2.129 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 166.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.714 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.7 OUTLIER -53.04 -48.15 67.86 Favored 'General case' 0 C--N 1.382 2.021 0 CA-C-O 122.487 1.136 . . . . 0.0 110.051 -168.5 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.9 ' CG ' HG23 ' P' ' 146' ' ' ILE . 0.5 OUTLIER -66.33 -37.85 86.31 Favored 'General case' 0 C--N 1.378 1.834 0 CA-C-N 114.562 -1.199 . . . . 0.0 107.878 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.941 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.6 mt -60.46 -50.82 72.07 Favored 'General case' 0 C--N 1.384 2.084 0 O-C-N 120.536 -1.352 . . . . 0.0 109.615 171.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.557 ' O ' ' N ' ' P' ' 129' ' ' ARG . 20.0 mt-10 -54.39 -52.76 60.66 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-O 122.384 1.088 . . . . 0.0 109.21 177.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.714 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.98 -67.78 0.22 Allowed 'General case' 0 C--N 1.378 1.818 0 CA-C-N 111.872 -2.422 . . . . 0.0 108.754 177.378 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.672 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.3 OUTLIER -59.21 -36.81 76.05 Favored 'General case' 0 C--N 1.397 2.634 0 CA-C-N 112.032 -2.349 . . . . 0.0 108.373 -172.478 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.873 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 12.6 t80 -69.21 -48.85 60.91 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-N 119.1 0.864 . . . . 0.0 109.679 178.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.557 ' N ' ' O ' ' P' ' 125' ' ' GLU . 27.3 mtm180 -62.96 -15.96 57.71 Favored 'General case' 0 C--N 1.38 1.931 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -166.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -101.66 -39.86 7.26 Favored 'General case' 0 C--N 1.379 1.862 0 C-N-CA 126.669 1.988 . . . . 0.0 107.374 -170.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.499 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.1 OUTLIER -153.2 104.49 2.8 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 111.723 -2.489 . . . . 0.0 108.64 -153.963 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . 0.486 ' HB3' ' CD2' ' P' ' 133' ' ' TYR . 3.2 mtt85 -74.48 -15.79 60.87 Favored 'General case' 0 C--N 1.391 2.41 0 CA-C-N 112.197 -2.274 . . . . 0.0 110.721 -166.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.486 ' CD2' ' HB3' ' P' ' 132' ' ' ARG . 66.8 m-85 -160.16 112.14 2.0 Favored 'General case' 0 C--N 1.378 1.835 0 CA-C-N 113.842 -1.526 . . . . 0.0 108.289 -153.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.672 HD12 ' HD3' ' P' ' 127' ' ' ARG . 19.1 mt -129.45 133.33 47.25 Favored 'General case' 0 C--N 1.396 2.595 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.028 -155.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . 0.338 1.3 t -92.6 166.57 12.43 Favored 'General case' 0 C--N 1.394 2.533 0 CA-C-N 122.103 2.229 . . . . 0.0 107.372 174.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.535 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.75 -46.47 98.45 Favored Pre-proline 0 CA--C 1.582 2.188 0 CA-C-N 113.573 -1.648 . . . . 0.0 108.684 -155.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.535 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 0.1 OUTLIER -53.64 -46.49 33.34 Favored 'Trans proline' 0 C--N 1.395 2.982 0 N-CA-C 116.73 1.781 . . . . 0.0 116.73 177.413 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.557 ' HB3' HD21 ' P' ' 134' ' ' LEU . 1.6 mm-40 -51.86 -65.68 0.52 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 123.726 1.727 . . . . 0.0 106.813 170.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.95 ' NH2' ' HG3' ' P' ' 154' ' ' LYS . 1.7 ptt180 -69.62 -32.18 70.74 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 109.942 -3.299 . . . . 0.0 108.718 -160.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.589 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 2.4 mt-10 -52.81 -47.02 67.93 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 122.987 1.375 . . . . 0.0 108.131 170.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -64.78 -37.85 89.01 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-N 112.416 -2.175 . . . . 0.0 109.608 -166.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.579 HD11 HD12 ' P' ' 146' ' ' ILE . 1.3 tm? -59.29 -44.5 92.51 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-O 123.169 1.461 . . . . 0.0 108.913 169.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.589 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -63.89 -34.27 77.58 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-N 112.037 -2.347 . . . . 0.0 109.095 177.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.581 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -72.5 -37.69 68.33 Favored 'General case' 0 C--N 1.388 2.243 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.451 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 45.7 mt -67.25 -52.48 40.35 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 124.777 2.227 . . . . 0.0 108.337 -167.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.987 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -91.61 -16.6 7.94 Favored 'Isoleucine or valine' 0 C--N 1.386 2.194 0 CA-C-N 110.498 -3.046 . . . . 0.0 107.959 -172.831 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . 0.527 ' HD3' ' O ' ' P' ' 144' ' ' SER . 3.2 mmt-85 81.3 38.54 0.07 Allowed 'General case' 0 C--N 1.385 2.144 0 CA-C-N 111.464 -2.607 . . . . 0.0 107.822 153.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.987 HD13 ' CD1' ' P' ' 146' ' ' ILE . 5.8 mt -94.19 171.79 8.62 Favored 'General case' 0 C--N 1.39 2.335 0 CA-C-N 112.023 -2.353 . . . . 0.0 109.055 166.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.64 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.4 p -89.99 139.86 27.49 Favored Pre-proline 0 CA--C 1.588 2.432 0 CA-C-O 123.148 1.451 . . . . 0.0 108.061 171.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.489 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 0.6 OUTLIER -46.34 -48.6 13.05 Favored 'Trans proline' 0 C--N 1.406 3.566 0 C-N-CA 124.935 3.757 . . . . 0.0 115.286 -165.436 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.41 -29.61 35.88 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 118.347 -0.835 . . . . 0.0 110.06 169.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.64 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -74.85 -27.67 60.36 Favored 'General case' 0 C--N 1.39 2.347 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.868 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.5 t -64.69 -72.86 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.382 2.007 0 CA-C-N 122.069 2.213 . . . . 0.0 109.883 162.322 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.95 ' HG3' ' NH2' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.47 -54.93 0.54 Allowed 'General case' 0 C--N 1.386 2.154 0 C-N-CA 124.896 1.278 . . . . 0.0 110.409 -175.504 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 16.5 mm -60.98 -41.7 90.12 Favored 'Isoleucine or valine' 0 C--N 1.387 2.199 0 CA-C-N 114.072 -1.422 . . . . 0.0 109.498 -174.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.941 ' HB3' HD21 ' P' ' 124' ' ' LEU . 7.7 t90 -66.81 -32.08 73.12 Favored 'General case' 0 C--N 1.382 2.0 0 O-C-N 121.228 -0.92 . . . . 0.0 109.076 172.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.873 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 52.2 m-85 -74.9 -42.2 58.24 Favored 'General case' 0 C--O 1.276 2.463 0 O-C-N 121.376 -0.827 . . . . 0.0 111.815 176.073 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.428 ' N ' ' O ' ' P' ' 154' ' ' LYS . 60.5 mt-30 -50.57 -60.25 3.22 Favored 'General case' 0 C--N 1.377 1.778 0 O-C-N 119.571 -1.956 . . . . 0.0 107.28 169.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -56.25 -23.42 36.0 Favored 'General case' 0 C--N 1.391 2.374 0 CA-C-O 117.358 -1.306 . . . . 0.0 109.629 -166.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.556 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 2.2 t60 -75.28 -50.64 15.43 Favored 'General case' 0 C--O 1.281 2.744 0 CA-C-N 121.307 1.867 . . . . 0.0 110.128 175.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.725 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -66.67 -35.84 81.13 Favored 'General case' 0 C--O 1.267 2.018 0 CA-C-N 122.538 2.427 . . . . 0.0 110.732 -158.373 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.46 ' CZ ' ' HG3' ' P' ' 166' ' ' ARG . 9.3 t80 -69.03 -38.37 79.13 Favored 'General case' 0 C--N 1.38 1.92 0 O-C-N 119.973 -1.704 . . . . 0.0 109.252 172.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.41 -38.23 90.31 Favored 'General case' 0 C--N 1.382 1.996 0 O-C-N 121.345 -0.847 . . . . 0.0 109.136 -168.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.725 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.6 OUTLIER -52.81 -60.32 3.41 Favored 'General case' 0 C--N 1.38 1.897 0 CA-C-O 125.47 2.557 . . . . 0.0 106.504 -174.208 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.433 ' HA ' ' HG3' ' P' ' 168' ' ' GLN . 0.3 OUTLIER -58.32 -43.07 88.05 Favored 'General case' 0 C--N 1.388 2.246 1 CA-C-N 108.33 -4.032 . . . . 0.0 108.065 -163.591 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . 0.46 ' HG3' ' CZ ' ' P' ' 162' ' ' TYR . 1.2 ttt180 -54.05 -45.91 71.8 Favored 'General case' 0 C--N 1.379 1.882 0 CA-C-N 113.051 -1.886 . . . . 0.0 110.146 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.67 -34.08 72.39 Favored 'General case' 0 C--N 1.385 2.126 0 CA-C-N 112.727 -2.033 . . . . 0.0 108.662 -175.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . 0.433 ' HG3' ' HA ' ' P' ' 165' ' ' LYS . 0.3 OUTLIER -80.04 -23.35 41.49 Favored 'General case' 0 C--N 1.388 2.263 0 CA-C-N 111.847 -2.433 . . . . 0.0 109.498 -174.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -56.35 -32.44 64.71 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-O 122.796 1.284 . . . . 0.0 109.749 168.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -66.96 -34.96 78.91 Favored 'General case' 0 C--N 1.386 2.179 0 CA-C-N 113.031 -1.895 . . . . 0.0 108.057 -166.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.02 86.81 5.95 Favored 'General case' 0 C--N 1.38 1.93 0 CA-C-N 113.824 -1.535 . . . . 0.0 109.32 -159.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 132.65 -60.45 0.67 Allowed Glycine 0 C--N 1.382 3.088 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 -157.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 102.2 147.62 0.01 OUTLIER 'General case' 0 C--N 1.388 2.272 0 CA-C-N 112.553 -1.824 . . . . 0.0 108.499 173.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -162.76 174.14 12.89 Favored 'General case' 0 C--N 1.393 2.486 0 CA-C-N 112.983 -1.917 . . . . 0.0 107.438 156.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 171.41 174.29 38.99 Favored Glycine 0 C--N 1.379 2.95 0 CA-C-O 122.971 1.317 . . . . 0.0 110.049 166.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 6.3 p-80 -146.82 129.32 7.79 Favored Pre-proline 0 CA--C 1.58 2.125 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 155.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo . . . . . 0 CA--C 1.594 3.49 0 C-N-CA 121.58 1.52 . . . . 0.0 111.62 -161.958 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . 0.659 ' H73' ' O6 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.831 0 O5'-C5'-C4' 114.346 2.961 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.773 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.562 3.387 0 O4'-C4'-C3' 108.176 2.576 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.773 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.843 0 P-O3'-C3' 122.684 2.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.624 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.578 0 C4'-C3'-C2' 100.437 -2.763 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.552 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.568 3.957 1 P-O3'-C3' 125.391 4.742 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.533 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.824 1 P-O3'-C3' 124.732 4.193 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.819 H2'' " H5'" ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.56 0 C3'-C2'-C1' 106.788 2.92 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.868 H2'' H5'' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.916 0 O5'-C5'-C4' 115.32 3.657 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.868 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.502 1 P-O3'-C3' 128.17 7.058 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.605 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.827 1 P-O3'-C3' 127.927 6.856 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.574 ' C6 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.407 0 O4'-C4'-C3' 108.15 2.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . 0.496 H2'' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.434 0 P-O3'-C3' 122.709 2.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.709 ' C5 ' ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.558 0 O4'-C4'-C3' 108.448 2.848 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.709 ' H72' ' C5 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.529 0 O4'-C4'-C3' 108.24 2.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.696 H5'' H2'' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.541 3.728 1 O4'-C1'-N19 111.304 4.379 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.659 ' H72' ' C8 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.588 0 P-O3'-C3' 122.248 2.123 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . 0.433 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.661 0 O5'-C5'-C4' 115.06 3.472 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.507 H2'' ' C8 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.603 0 C3'-C2'-C1' 106.802 2.93 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.507 ' C8 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.473 1 P-O3'-C3' 127.441 6.45 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.516 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.302 1 P-O3'-C3' 124.84 4.284 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.558 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.571 4.321 0 N19-C1'-C2' 119.372 3.233 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.558 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.525 1 P-O3'-C3' 127.534 6.529 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.627 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.472 0 O4'-C4'-C3' 108.247 2.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.781 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.512 0 O4'-C4'-C3' 108.606 3.006 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.781 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.636 0 P-O3'-C3' 123.75 3.375 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.504 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.208 0 N19-C1'-C2' 119.309 3.193 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.604 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.739 0 P-O3'-C3' 123.664 3.304 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.604 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.643 0 C4'-C3'-C2' 100.404 -2.796 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.624 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.615 1 P-O3'-C3' 125.023 4.436 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.493 ' C8 ' H2'' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.301 0 O4'-C4'-C3' 107.966 2.366 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.533 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.609 0 O4'-C4'-C3' 108.385 2.785 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.911 0 O4'-C1'-N19 109.284 1.856 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.505 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.59 -40.5 6.29 Favored 'General case' 0 C--N 1.382 2.006 0 CA-C-N 113.663 -1.608 . . . . 0.0 108.706 -177.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 170.51 -38.41 0.0 OUTLIER 'General case' 0 C--N 1.389 2.3 0 CA-C-N 113.54 -1.664 . . . . 0.0 107.98 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -149.0 -144.87 4.03 Favored Glycine 0 C--N 1.381 3.065 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -160.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.846 HD11 ' HD2' ' P' ' 106' ' ' PRO . 0.0 OUTLIER -115.78 170.03 6.21 Favored Pre-proline 0 CA--C 1.581 2.136 0 CA-C-N 113.672 -1.264 . . . . 0.0 108.6 170.619 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.846 ' HD2' HD11 ' P' ' 105' ' ' LEU . 48.3 Cg_exo -46.59 93.09 0.02 OUTLIER 'Trans proline' 0 C--N 1.399 3.195 0 C-N-CA 123.029 2.486 . . . . 0.0 110.361 155.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -112.18 89.66 3.13 Favored 'General case' 0 C--N 1.381 1.97 0 CA-C-O 122.358 1.075 . . . . 0.0 109.101 156.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.518 ' C ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -102.78 -71.74 0.71 Allowed 'General case' 0 C--N 1.382 1.995 0 CA-C-N 113.779 -1.555 . . . . 0.0 108.071 -166.385 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.885 ' HE2' ' N ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -83.48 146.05 28.6 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 113.846 -1.524 . . . . 0.0 109.359 -176.725 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.885 ' N ' ' HE2' ' P' ' 109' ' ' LYS . 0.4 OUTLIER -147.51 71.68 1.21 Allowed 'General case' 0 C--N 1.383 2.06 0 CA-C-N 113.734 -1.576 . . . . 0.0 109.29 -155.423 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.77 ' HD2' " O4'" ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -26.71 89.54 0.0 OUTLIER 'General case' 0 C--N 1.38 1.934 0 C-N-CA 126.348 1.859 . . . . 0.0 110.448 -170.619 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . 0.574 ' HD3' ' OP1' ' B' ' 29' ' ' ' DC' . 71.1 mtt85 -76.08 178.04 6.65 Favored 'General case' 0 C--N 1.388 2.245 0 CA-C-N 112.282 -2.235 . . . . 0.0 109.001 155.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.946 ' CD ' HD23 ' P' ' 115' ' ' LEU . 1.3 ttm180 -89.08 119.09 29.28 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-N 113.415 -1.721 . . . . 0.0 107.152 164.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.23 67.16 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.159 0 CA-C-O 125.411 2.529 . . . . 0.0 108.058 -162.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.946 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.46 107.74 8.94 Favored 'General case' 0 C--N 1.391 2.376 0 CA-C-N 111.62 -2.536 . . . . 0.0 109.374 -157.892 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.594 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.6 m-85 -76.42 142.47 41.05 Favored 'General case' 0 C--N 1.389 2.285 0 CA-C-N 112.5 -2.136 . . . . 0.0 108.112 -170.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.19 147.82 52.75 Favored 'General case' 0 C--N 1.381 1.976 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -168.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -42.82 -36.22 1.41 Allowed 'General case' 0 C--N 1.381 1.963 0 CA-C-N 113.716 -1.584 . . . . 0.0 109.381 -177.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.77 -67.39 0.26 Allowed 'General case' 0 C--N 1.383 2.025 0 CA-C-O 123.981 1.848 . . . . 0.0 109.088 173.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.58 ' O ' HD13 ' P' ' 124' ' ' LEU . 79.1 mt-30 -48.32 -48.8 35.84 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 112.435 -2.166 . . . . 0.0 110.038 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.525 ' HA ' HD13 ' P' ' 124' ' ' LEU . 9.1 m -50.39 -58.38 5.84 Favored 'General case' 0 C--N 1.384 2.071 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.538 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 0.6 OUTLIER -52.94 -46.99 68.39 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.985 -170.246 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.858 ' CG ' HG23 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -67.06 -35.94 80.94 Favored 'General case' 0 C--O 1.265 1.898 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.137 177.416 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.89 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.7 mt -59.98 -53.97 51.51 Favored 'General case' 0 C--N 1.381 1.956 0 O-C-N 119.593 -1.942 . . . . 0.0 109.619 168.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.576 ' O ' ' N ' ' P' ' 129' ' ' ARG . 11.6 mt-10 -55.36 -42.37 73.81 Favored 'General case' 0 C--N 1.381 1.962 0 CA-C-O 122.564 1.173 . . . . 0.0 109.679 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.538 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -47.41 -71.6 0.07 Allowed 'General case' 0 C--N 1.38 1.912 0 CA-C-N 111.235 -2.712 . . . . 0.0 108.132 177.085 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.812 ' HD2' HD23 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -60.82 -33.3 72.81 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 113.933 -1.485 . . . . 0.0 108.405 -172.397 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.859 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 30.6 t80 -69.89 -48.9 56.9 Favored 'General case' 0 C--N 1.38 1.929 0 CA-C-N 119.623 1.102 . . . . 0.0 109.998 176.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.576 ' N ' ' O ' ' P' ' 125' ' ' GLU . 71.3 mtt180 -62.19 -19.08 62.75 Favored 'General case' 0 C--N 1.38 1.93 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -167.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -99.92 -40.02 7.88 Favored 'General case' 0 C--N 1.379 1.85 0 C-N-CA 126.279 1.832 . . . . 0.0 107.097 -169.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.498 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.8 OUTLIER -154.58 102.86 2.43 Favored 'General case' 0 C--N 1.384 2.102 0 CA-C-N 111.953 -2.385 . . . . 0.0 109.329 -152.61 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . 0.894 ' NH2' HG22 ' P' ' 164' ' ' THR . 0.6 OUTLIER -74.45 -13.89 60.76 Favored 'General case' 0 C--N 1.394 2.533 0 CA-C-N 112.244 -2.253 . . . . 0.0 111.212 -161.354 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.464 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 12.8 m-85 -159.23 111.09 2.12 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-N 113.36 -1.745 . . . . 0.0 108.089 -154.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.812 HD23 ' HD2' ' P' ' 127' ' ' ARG . 29.2 mt -123.4 132.36 53.93 Favored 'General case' 0 C--N 1.398 2.703 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -155.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.0 155.46 23.94 Favored 'General case' 0 C--N 1.38 1.934 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 171.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.557 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.17 -49.32 93.6 Favored Pre-proline 0 CA--C 1.584 2.276 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -160.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.557 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 75.5 Cg_exo -59.84 -28.8 88.02 Favored 'Trans proline' 0 C--N 1.401 3.312 0 N-CA-C 115.402 1.27 . . . . 0.0 115.402 -176.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.452 ' HB3' HD21 ' P' ' 134' ' ' LEU . 2.9 mm-40 -53.33 -72.4 0.06 Allowed 'General case' 0 C--N 1.379 1.872 0 CA-C-O 124.822 2.249 . . . . 0.0 106.795 158.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.896 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -66.45 -39.44 88.88 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 110.267 -3.152 . . . . 0.0 108.407 -154.318 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.635 ' O ' ' N ' ' P' ' 144' ' ' SER . 1.7 mt-10 -53.81 -43.2 69.15 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.576 1.179 . . . . 0.0 108.319 177.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -63.55 -36.81 85.03 Favored 'General case' 0 C--N 1.381 1.936 0 CA-C-N 112.693 -2.048 . . . . 0.0 109.277 -174.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.679 HD12 ' HB2' ' P' ' 123' ' ' GLU . 0.8 OUTLIER -60.02 -45.65 92.07 Favored 'General case' 0 C--N 1.386 2.172 0 CA-C-O 122.79 1.281 . . . . 0.0 108.857 165.675 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.556 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -63.75 -30.53 71.62 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 112.606 -2.088 . . . . 0.0 109.368 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.635 ' N ' ' O ' ' P' ' 140' ' ' GLU . 8.0 t -74.81 -43.46 54.56 Favored 'General case' 0 C--N 1.383 2.04 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.327 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . 0.549 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 39.4 mt -62.51 -44.06 97.28 Favored 'General case' 0 C--N 1.38 1.914 0 CA-C-O 124.727 2.203 . . . . 0.0 107.794 -164.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.983 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -102.87 -17.24 7.13 Favored 'Isoleucine or valine' 0 C--N 1.385 2.135 0 CA-C-N 110.283 -3.144 . . . . 0.0 107.792 -168.766 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . 0.549 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.0 OUTLIER 81.22 37.55 0.08 Allowed 'General case' 0 C--N 1.388 2.249 0 CA-C-N 111.249 -2.705 . . . . 0.0 108.292 153.496 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.983 HD13 ' CD1' ' P' ' 146' ' ' ILE . 5.7 mt -95.25 168.04 10.98 Favored 'General case' 0 C--N 1.39 2.332 0 CA-C-N 112.353 -2.203 . . . . 0.0 109.416 167.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.638 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -88.77 143.38 31.64 Favored Pre-proline 0 CA--C 1.587 2.378 0 CA-C-O 122.948 1.356 . . . . 0.0 108.25 173.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -60.74 -37.32 79.56 Favored 'Trans proline' 1 C--N 1.415 4.062 0 C-N-CA 122.621 2.214 . . . . 0.0 112.885 -155.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 151' ' ' THR . . . . . 0.401 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.2 OUTLIER -54.79 -34.9 63.26 Favored 'General case' 0 C--N 1.384 2.092 0 C-N-CA 119.593 -0.843 . . . . 0.0 109.774 165.727 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.638 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.7 mt-30 -70.91 -27.67 63.96 Favored 'General case' 0 C--N 1.388 2.272 0 N-CA-C 105.639 -1.986 . . . . 0.0 105.639 -177.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.752 HG12 ' HB2' ' P' ' 139' ' ' ARG . 1.3 t -64.55 -71.99 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.096 0 CA-C-N 121.537 1.971 . . . . 0.0 109.567 164.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.896 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.75 -58.93 0.42 Allowed 'General case' 0 C--N 1.385 2.144 0 C-N-CA 124.807 1.243 . . . . 0.0 110.784 -177.8 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.481 HD12 ' OE1' ' P' ' 158' ' ' GLN . 22.7 mm -58.81 -40.86 81.03 Favored 'Isoleucine or valine' 0 C--N 1.381 1.969 0 CA-C-N 113.089 -1.869 . . . . 0.0 108.847 -172.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.89 ' HB3' HD21 ' P' ' 124' ' ' LEU . 5.9 t90 -67.71 -31.89 72.14 Favored 'General case' 0 C--N 1.382 2.011 0 O-C-N 121.419 -0.801 . . . . 0.0 109.311 173.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.859 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 72.5 m-85 -75.18 -38.76 60.69 Favored 'General case' 0 C--O 1.274 2.345 0 O-C-N 121.274 -0.891 . . . . 0.0 112.302 173.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.481 ' OE1' HD12 ' P' ' 155' ' ' ILE . 81.1 mt-30 -53.22 -62.93 1.33 Allowed 'General case' 0 C--N 1.376 1.754 0 O-C-N 119.879 -1.763 . . . . 0.0 106.465 167.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -56.53 -24.49 47.11 Favored 'General case' 0 C--N 1.39 2.331 0 CA-C-O 117.672 -1.156 . . . . 0.0 109.648 -166.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.527 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 5.4 t60 -79.26 -38.03 36.48 Favored 'General case' 0 C--O 1.282 2.787 0 CA-C-N 121.491 1.95 . . . . 0.0 111.895 178.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.525 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -68.08 -32.51 72.88 Favored 'General case' 0 C--O 1.266 1.96 0 CA-C-N 122.997 2.635 . . . . 0.0 111.225 179.748 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.773 ' HE2' ' CZ ' ' P' ' 166' ' ' ARG . 53.9 t80 -67.46 -43.66 80.52 Favored 'General case' 0 C--N 1.381 1.953 0 CA-C-N 120.825 1.648 . . . . 0.0 108.792 172.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -65.72 -39.96 91.71 Favored 'General case' 0 C--N 1.382 1.984 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -167.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.894 HG22 ' NH2' ' P' ' 132' ' ' ARG . 0.5 OUTLIER -51.69 -59.65 4.05 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-O 125.022 2.344 . . . . 0.0 106.958 -172.892 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.518 ' HG2' HG21 ' P' ' 164' ' ' THR . 6.4 mmmt -59.35 -46.89 87.37 Favored 'General case' 0 C--N 1.387 2.203 1 CA-C-N 108.128 -4.124 . . . . 0.0 108.21 -161.568 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . 0.773 ' CZ ' ' HE2' ' P' ' 162' ' ' TYR . 1.6 mtt180 -46.05 -51.96 12.79 Favored 'General case' 0 C--N 1.381 1.937 0 CA-C-N 112.852 -1.976 . . . . 0.0 111.072 173.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -55.85 -33.26 64.35 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 112.568 -2.105 . . . . 0.0 108.9 -173.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.63 -27.91 28.82 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 111.929 -2.396 . . . . 0.0 110.238 -173.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.63 -31.92 39.26 Favored 'General case' 0 C--N 1.378 1.815 0 CA-C-O 123.187 1.47 . . . . 0.0 110.43 170.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -68.97 -32.96 72.92 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 112.822 -1.99 . . . . 0.0 108.343 -166.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 48.4 mttt -83.61 80.81 9.0 Favored 'General case' 0 C--N 1.382 1.999 0 CA-C-N 113.5 -1.682 . . . . 0.0 109.095 -155.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 123.66 -49.26 0.91 Allowed Glycine 0 C--N 1.382 3.11 0 N-CA-C 108.914 -1.674 . . . . 0.0 108.914 -169.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 96.32 150.65 0.02 OUTLIER 'General case' 0 C--N 1.393 2.491 0 CA-C-N 112.373 -1.914 . . . . 0.0 108.396 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -164.39 158.43 18.54 Favored 'General case' 0 C--N 1.388 2.262 0 CA-C-N 113.448 -1.705 . . . . 0.0 107.424 156.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -150.22 25.58 1.12 Allowed Glycine 0 C--N 1.379 2.968 0 O-C-N 120.562 -1.336 . . . . 0.0 110.156 -162.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 46.6 t60 179.83 140.89 0.31 Allowed Pre-proline 0 CA--C 1.58 2.115 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo . . . . . 0 CA--C 1.594 3.482 0 C-N-CA 121.55 1.5 . . . . 0.0 111.63 169.571 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . 0.492 ' H73' ' H61' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.566 3.824 0 O5'-C5'-C4' 114.344 2.96 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.841 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.561 3.312 0 O4'-C4'-C3' 108.186 2.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.841 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.863 0 P-O3'-C3' 122.76 2.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.613 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.483 0 P-O3'-C3' 123.439 3.116 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.539 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.742 0 O4'-C4'-C3' 108.046 2.446 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.565 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.57 4.231 0 N19-C1'-C2' 119.473 3.296 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.843 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.872 2 P-O3'-C3' 125.575 4.895 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.843 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.423 0 O5'-C5'-C4' 114.913 3.367 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.767 " H5'" ' HD3' ' P' ' 111' ' ' LYS . . . . . . . . 0 C5'--C4' 1.539 3.523 0 O4'-C4'-C3' 108.542 2.942 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.436 ' C2 ' ' C2 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.898 1 P-O3'-C3' 125.045 4.454 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.519 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.552 1 P-O3'-C3' 127.893 6.827 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.301 0 P-O3'-C3' 123.174 2.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.505 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.523 0 O4'-C4'-C3' 108.194 2.594 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.505 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.591 0 P-O3'-C3' 124.272 3.81 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.869 ' N9 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.88 1 O4'-C1'-N19 111.169 4.212 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.869 ' H72' ' N9 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.565 0 P-O3'-C3' 122.208 2.09 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.759 0 O5'-C5'-C4' 115.042 3.459 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.491 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.655 1 P-O3'-C3' 125.072 4.477 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.491 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.535 0 O4'-C4'-C3' 108.109 2.509 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.522 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.334 0 O4'-C4'-C3' 108.101 2.501 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.563 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.572 4.356 0 N19-C1'-C2' 119.204 3.127 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.563 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.498 1 P-O3'-C3' 126.997 6.081 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.612 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.411 0 O4'-C4'-C3' 108.529 2.929 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.612 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.499 0 O4'-C4'-C3' 108.564 2.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.563 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.705 0 O4'-C4'-C3' 108.294 2.694 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.515 ' C6 ' H2'' ' B' ' 25' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.558 4.018 0 N19-C1'-C2' 118.868 2.918 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.618 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.6 0 C4'-C3'-C2' 100.685 -2.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.62 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.526 0 C3'-C2'-C1' 106.383 2.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.62 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.713 1 P-O3'-C3' 125.296 4.664 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.406 0 O4'-C4'-C3' 108.104 2.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.597 0 P-O3'-C3' 123.45 3.125 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . 0.492 ' H61' ' H73' ' A' ' 1' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.842 0 O4'-C1'-N19 109.365 1.956 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.486 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 74.88 150.11 0.11 Allowed 'General case' 0 C--N 1.381 1.968 0 CA-C-N 113.734 -1.575 . . . . 0.0 108.643 -172.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 170.94 -38.45 0.0 OUTLIER 'General case' 0 C--N 1.388 2.281 0 CA-C-N 113.527 -1.67 . . . . 0.0 107.962 -173.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -120.15 106.15 1.16 Allowed Glycine 0 C--N 1.381 3.044 0 N-CA-C 108.899 -1.68 . . . . 0.0 108.899 -161.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.531 HD11 ' HD2' ' P' ' 106' ' ' PRO . 0.0 OUTLIER -138.37 168.91 14.15 Favored Pre-proline 0 CA--C 1.583 2.227 0 CA-C-N 113.683 -1.258 . . . . 0.0 108.775 179.421 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.531 ' HD2' HD11 ' P' ' 105' ' ' LEU . 0.3 OUTLIER -94.25 83.0 0.15 Allowed 'Trans proline' 0 C--N 1.394 2.972 0 C-N-CA 123.857 3.038 . . . . 0.0 110.226 -164.228 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -96.72 105.19 17.26 Favored 'General case' 0 C--N 1.383 2.032 0 CA-C-N 113.645 -1.616 . . . . 0.0 109.185 174.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.749 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -93.0 -42.4 9.46 Favored 'General case' 0 C--N 1.382 2.01 0 CA-C-N 113.73 -1.577 . . . . 0.0 108.15 -175.789 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.562 ' HG3' ' N ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -71.3 160.58 32.55 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 113.761 -1.563 . . . . 0.0 109.102 172.099 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.749 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.7 OUTLIER -137.91 -155.09 0.57 Allowed 'General case' 0 C--N 1.378 1.832 0 CA-C-O 123.226 1.488 . . . . 0.0 107.452 -154.715 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.806 ' HD2' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -96.29 90.73 5.56 Favored 'General case' 0 C--N 1.385 2.141 0 CA-C-N 111.905 -2.407 . . . . 0.0 108.297 -167.558 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 69.0 mtt85 -53.59 166.29 0.32 Allowed 'General case' 0 C--N 1.392 2.416 0 CA-C-N 111.671 -2.513 . . . . 0.0 108.71 155.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.865 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.6 OUTLIER -88.8 118.82 28.77 Favored 'General case' 0 C--N 1.384 2.085 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 155.161 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.723 HG23 ' OP1' ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -111.11 62.84 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.175 0 CA-C-O 125.839 2.733 . . . . 0.0 107.878 -157.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.865 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.1 108.15 8.82 Favored 'General case' 0 C--N 1.392 2.439 0 CA-C-N 110.94 -2.845 . . . . 0.0 109.2 -155.353 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.596 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 -75.24 142.21 43.4 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-N 112.531 -2.122 . . . . 0.0 108.057 -167.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.29 148.13 52.3 Favored 'General case' 0 C--N 1.381 1.965 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -169.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -43.43 -36.15 1.86 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-N 113.384 -1.734 . . . . 0.0 109.226 -177.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.67 -66.86 0.32 Allowed 'General case' 0 C--N 1.382 2.019 0 CA-C-O 124.109 1.909 . . . . 0.0 109.138 173.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.527 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 79.7 mt-30 -48.71 -45.92 39.95 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-N 112.476 -2.147 . . . . 0.0 109.663 177.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.625 ' HA ' HD13 ' P' ' 124' ' ' LEU . 19.0 m -54.73 -54.75 37.83 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.59 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.6 t80 -53.18 -46.13 68.81 Favored 'General case' 0 C--N 1.382 2.014 0 CA-C-O 122.381 1.086 . . . . 0.0 110.161 -171.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.817 ' HG3' HG23 ' P' ' 146' ' ' ILE . 0.3 OUTLIER -66.35 -40.15 89.64 Favored 'General case' 0 C--N 1.38 1.893 0 CA-C-N 114.245 -1.343 . . . . 0.0 107.803 179.417 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.819 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.7 mt -60.98 -48.94 79.5 Favored 'General case' 0 C--N 1.386 2.174 0 O-C-N 120.528 -1.357 . . . . 0.0 109.607 173.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.532 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.6 mt-10 -55.18 -52.63 62.72 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.755 1.264 . . . . 0.0 109.398 176.266 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.59 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -42.28 -58.67 2.09 Favored 'General case' 0 C--N 1.379 1.848 0 CA-C-N 112.209 -2.269 . . . . 0.0 109.075 177.073 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.706 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -69.83 -32.72 71.3 Favored 'General case' 0 C--N 1.396 2.596 0 CA-C-N 112.481 -2.145 . . . . 0.0 108.467 -168.083 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.771 ' HD2' ' HD1' ' P' ' 157' ' ' PHE . 6.0 t80 -68.95 -52.09 32.87 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-O 121.81 0.814 . . . . 0.0 109.638 171.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.634 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 3.2 mmm180 -62.58 -14.07 38.4 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-N 113.545 -1.661 . . . . 0.0 108.302 -164.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -95.91 -47.33 6.17 Favored 'General case' 0 C--N 1.379 1.87 0 CA-C-O 123.93 1.824 . . . . 0.0 106.539 -176.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.676 ' CD ' HD22 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -159.36 123.1 3.78 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 111.919 -2.401 . . . . 0.0 110.256 -166.043 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . 0.5 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 1.1 ptt-85 -80.45 -7.65 59.23 Favored 'General case' 0 C--N 1.387 2.223 0 CA-C-N 112.36 -2.2 . . . . 0.0 111.243 -162.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.652 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 0.4 OUTLIER -152.84 90.6 1.48 Allowed 'General case' 0 C--N 1.378 1.837 0 CA-C-O 126.846 3.212 . . . . 0.0 109.183 -154.268 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.676 HD22 ' CD ' ' P' ' 131' ' ' GLN . 65.0 mt -97.3 137.88 35.62 Favored 'General case' 0 C--N 1.415 3.413 0 CA-C-N 111.863 -2.426 . . . . 0.0 108.528 -166.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.31 156.68 25.4 Favored 'General case' 0 C--N 1.381 1.971 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 161.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.562 ' HB2' ' HD3' ' P' ' 137' ' ' PRO . . . -59.11 -50.01 90.05 Favored Pre-proline 0 CA--C 1.583 2.221 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.458 -163.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.562 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 69.9 Cg_exo -57.05 -28.86 80.72 Favored 'Trans proline' 0 C--N 1.4 3.269 0 N-CA-C 115.011 1.12 . . . . 0.0 115.011 -172.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.607 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.1 OUTLIER -55.53 -70.88 0.1 Allowed 'General case' 0 C--N 1.384 2.093 0 CA-C-O 125.039 2.352 . . . . 0.0 105.734 164.421 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 1.015 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.59 -40.51 80.46 Favored 'General case' 0 C--N 1.391 2.388 0 CA-C-N 109.514 -3.494 . . . . 0.0 108.739 -156.047 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.613 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 4.8 mt-10 -53.17 -41.28 65.04 Favored 'General case' 0 C--N 1.38 1.901 0 CA-C-O 123.482 1.611 . . . . 0.0 108.368 178.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -64.03 -35.13 79.7 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.99 -172.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.706 HD12 ' CG ' ' P' ' 127' ' ' ARG . 2.5 tp -65.33 -43.04 92.21 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-O 123.282 1.515 . . . . 0.0 108.957 168.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.613 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.2 -34.98 66.77 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-N 112.32 -2.218 . . . . 0.0 108.37 174.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.572 ' N ' ' O ' ' P' ' 140' ' ' GLU . 3.1 t -73.49 -44.27 58.28 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.248 -179.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 81.2 mt -66.19 -47.01 75.31 Favored 'General case' 0 C--N 1.379 1.88 0 CA-C-O 124.897 2.284 . . . . 0.0 107.933 -163.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.983 HD13 HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.66 -17.07 7.1 Favored 'Isoleucine or valine' 0 C--N 1.385 2.124 0 CA-C-N 110.539 -3.028 . . . . 0.0 107.688 -171.565 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 81.26 37.11 0.08 Allowed 'General case' 0 C--N 1.385 2.148 0 CA-C-N 111.44 -2.618 . . . . 0.0 108.181 152.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.983 HD13 HD13 ' P' ' 146' ' ' ILE . 6.0 mt -95.32 168.25 10.84 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 112.084 -2.325 . . . . 0.0 109.395 168.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.65 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.9 p -89.28 143.8 31.45 Favored Pre-proline 0 CA--C 1.588 2.407 0 CA-C-O 122.794 1.283 . . . . 0.0 108.26 172.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -60.66 -37.82 76.52 Favored 'Trans proline' 0 C--N 1.414 3.993 0 C-N-CA 122.531 2.154 . . . . 0.0 112.409 -155.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 151' ' ' THR . . . . . 0.401 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -55.27 -32.65 62.55 Favored 'General case' 0 C--N 1.385 2.121 0 C-N-CA 119.512 -0.875 . . . . 0.0 109.806 166.717 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.65 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.8 mt-30 -72.4 -29.44 63.74 Favored 'General case' 0 C--N 1.389 2.283 0 N-CA-C 105.848 -1.908 . . . . 0.0 105.848 -178.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.774 HG12 ' HB2' ' P' ' 139' ' ' ARG . 1.2 t -64.71 -69.75 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.098 0 CA-C-N 121.9 2.137 . . . . 0.0 109.562 166.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 1.015 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.68 -59.18 0.41 Allowed 'General case' 0 C--N 1.387 2.234 0 C-N-CA 124.986 1.315 . . . . 0.0 110.801 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.736 HG22 " C5'" ' A' ' 8' ' ' ' DA' . 3.4 mm -55.22 -43.15 69.49 Favored 'Isoleucine or valine' 0 C--N 1.384 2.082 0 CA-C-N 112.825 -1.989 . . . . 0.0 110.089 -176.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.819 ' HB3' HD21 ' P' ' 124' ' ' LEU . 6.0 t90 -66.83 -30.56 70.77 Favored 'General case' 0 C--N 1.382 1.981 0 O-C-N 120.912 -1.118 . . . . 0.0 108.998 174.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.771 ' HD1' ' HD2' ' P' ' 128' ' ' PHE . 45.2 m-85 -76.11 -44.39 38.8 Favored 'General case' 0 C--O 1.276 2.493 0 O-C-N 121.235 -0.916 . . . . 0.0 111.939 174.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' P' ' 154' ' ' LYS . 23.5 mt-30 -42.71 -66.3 0.38 Allowed 'General case' 0 C--N 1.378 1.807 0 O-C-N 119.078 -2.264 . . . . 0.0 107.713 167.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -56.66 -21.93 30.97 Favored 'General case' 0 C--N 1.396 2.628 0 CA-C-N 112.759 -2.019 . . . . 0.0 109.695 -165.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.531 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.8 OUTLIER -76.12 -49.84 16.29 Favored 'General case' 0 C--O 1.284 2.876 0 CA-C-N 120.9 1.682 . . . . 0.0 110.809 172.253 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.818 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -69.2 -41.31 77.29 Favored 'General case' 0 C--O 1.269 2.083 0 CA-C-N 122.505 2.411 . . . . 0.0 109.578 -160.062 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.405 ' CZ ' ' HB2' ' P' ' 166' ' ' ARG . 35.3 t80 -66.04 -31.72 72.76 Favored 'General case' 0 C--N 1.38 1.931 0 O-C-N 119.951 -1.718 . . . . 0.0 109.359 171.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -32.67 74.26 Favored 'General case' 0 C--N 1.381 1.96 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -171.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.818 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.4 OUTLIER -69.02 -56.25 8.34 Favored 'General case' 0 C--N 1.378 1.828 0 CA-C-O 125.035 2.35 . . . . 0.0 105.556 -165.321 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . . . . . . . . . 7.9 mtpt -58.26 -51.65 68.86 Favored 'General case' 0 C--N 1.388 2.269 0 CA-C-N 108.437 -3.983 . . . . 0.0 109.016 -170.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . 0.405 ' HB2' ' CZ ' ' P' ' 162' ' ' TYR . 0.0 OUTLIER -58.44 -30.27 66.79 Favored 'General case' 0 C--N 1.382 1.996 0 CA-C-N 112.293 -2.231 . . . . 0.0 108.079 179.471 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . 0.643 ' HB1' ' O ' ' P' ' 164' ' ' THR . . . -68.36 -32.25 72.2 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-O 124.237 1.97 . . . . 0.0 109.529 -174.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.21 -20.72 31.85 Favored 'General case' 0 C--N 1.392 2.425 0 CA-C-N 112.695 -2.048 . . . . 0.0 109.913 -175.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -53.42 -32.57 50.34 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-O 123.901 1.81 . . . . 0.0 109.812 167.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.19 -33.67 43.67 Favored 'General case' 0 C--N 1.38 1.923 0 CA-C-N 112.183 -2.281 . . . . 0.0 107.466 -154.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 11.0 mttt -72.5 87.59 1.2 Allowed 'General case' 0 C--N 1.381 1.965 0 CA-C-N 113.51 -1.677 . . . . 0.0 109.02 -158.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . 0.448 ' C ' ' CD1' ' P' ' 173' ' ' TYR . . . 111.95 -93.46 0.7 Allowed Glycine 0 C--N 1.382 3.131 0 N-CA-C 108.545 -1.822 . . . . 0.0 108.545 -155.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . 0.484 ' HD1' ' N ' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 140.31 158.4 0.0 OUTLIER 'General case' 0 C--N 1.382 1.999 0 CA-C-N 113.051 -1.575 . . . . 0.0 109.604 -175.482 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.15 70.51 10.57 Favored 'General case' 0 C--N 1.391 2.394 0 CA-C-N 111.779 -2.464 . . . . 0.0 109.11 168.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -86.21 52.46 4.52 Favored Glycine 0 C--N 1.38 2.975 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 171.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -171.94 133.36 0.79 Allowed Pre-proline 0 CA--C 1.579 2.092 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 156.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo . . . . . 0 CA--C 1.594 3.482 0 C-N-CA 121.443 1.429 . . . . 0.0 111.552 167.703 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.838 0 O5'-C5'-C4' 114.345 2.961 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.672 ' N1 ' ' N3 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.438 1 P-O3'-C3' 126.812 5.927 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.526 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.84 0 P-O3'-C3' 123.268 2.973 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.646 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.52 0 P-O3'-C3' 123.852 3.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.506 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.863 0 P-O3'-C3' 122.854 2.629 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.549 ' C5 ' ' N6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.569 4.05 0 O4'-C4'-C3' 108.152 2.552 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.71 H2'' " H5'" ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.483 0 P-O3'-C3' 123.973 3.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.744 " H4'" ' HG3' ' P' ' 111' ' ' LYS . . . . . . . . 0 C5'--C4' 1.541 3.793 0 O4'-C1'-N19 110.419 3.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.59 ' C8 ' ' H71' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.524 0 O4'-C4'-C3' 108.201 2.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.59 ' H71' ' C8 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.925 0 N19-C1'-C2' 117.745 2.216 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.511 ' C8 ' H2'' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.606 0 O4'-C4'-C3' 108.59 2.99 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . 0.464 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.561 3.335 1 P-O3'-C3' 127.369 6.391 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.907 ' C6 ' ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.532 0 O4'-C4'-C3' 108.428 2.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.907 ' H72' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.525 0 O4'-C4'-C3' 108.211 2.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.813 ' C4 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.898 1 O4'-C1'-N19 111.371 4.463 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.813 ' H72' ' C4 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.602 0 P-O3'-C3' 122.21 2.092 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . 0.414 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.611 0 O5'-C5'-C4' 115.061 3.472 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.592 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.601 0 O4'-C4'-C3' 108.494 2.894 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.592 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.335 0 O4'-C4'-C3' 108.09 2.49 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.524 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.386 0 O4'-C4'-C3' 107.966 2.366 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.684 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.572 4.366 0 N19-C1'-C2' 118.963 2.977 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.684 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.532 0 P-O3'-C3' 122.877 2.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.627 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.439 0 C3'-C2'-C1' 106.986 3.061 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.737 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.703 0 P-O3'-C3' 123.305 3.005 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.737 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.568 3.981 0 P-O3'-C3' 124.018 3.598 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.632 ' C4 ' ' C2 ' ' B' ' 25' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.56 4.198 0 P-O3'-C3' 124.124 3.686 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.603 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.617 0 C4'-C3'-C2' 100.616 -2.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.608 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.489 0 P-O3'-C3' 122.628 2.44 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.646 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.567 0 O4'-C4'-C3' 108.402 2.802 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.671 " H5'" HH12 ' P' ' 113' ' ' ARG . . . . . . . . 0 C5'--C4' 1.538 3.427 0 O4'-C4'-C3' 107.915 2.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.672 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.563 0 O4'-C4'-C3' 108.217 2.617 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.791 0 O4'-C1'-N19 109.349 1.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.485 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -101.97 163.81 12.05 Favored 'General case' 0 C--N 1.382 2.011 0 CA-C-N 113.638 -1.619 . . . . 0.0 108.647 -172.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 170.3 -38.34 0.0 OUTLIER 'General case' 0 C--N 1.389 2.292 0 CA-C-N 113.546 -1.661 . . . . 0.0 108.011 -174.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -114.35 -129.01 4.71 Favored Glycine 0 C--N 1.382 3.1 0 N-CA-C 108.879 -1.688 . . . . 0.0 108.879 -161.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.938 HD12 ' HD2' ' P' ' 106' ' ' PRO . 0.1 OUTLIER -172.12 154.78 3.44 Favored Pre-proline 0 CA--C 1.581 2.16 0 CA-C-N 113.662 -1.269 . . . . 0.0 108.632 167.357 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.938 ' HD2' HD12 ' P' ' 105' ' ' LEU . 65.9 Cg_exo -49.01 92.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.398 3.157 0 C-N-CA 122.871 2.381 . . . . 0.0 110.372 155.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . 0.573 ' O ' ' HG2' ' P' ' 108' ' ' LYS . 8.4 m-20 -107.0 148.02 29.19 Favored 'General case' 0 C--N 1.381 1.971 0 CA-C-O 122.429 1.109 . . . . 0.0 109.149 158.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.605 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.1 OUTLIER -162.55 33.81 0.11 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-N 113.683 -1.599 . . . . 0.0 108.151 -172.311 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.22 162.32 0.09 Allowed 'General case' 0 C--N 1.381 1.951 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.083 166.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.605 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.6 OUTLIER -123.72 86.42 2.57 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-N 113.669 -1.605 . . . . 0.0 108.909 -155.553 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.744 ' HG3' " H4'" ' A' ' 8' ' ' ' DA' . 0.4 OUTLIER -25.01 91.97 0.01 OUTLIER 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.187 -1.824 . . . . 0.0 110.313 169.089 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . 0.413 ' HA ' " H4'" ' B' ' 28' ' ' ' DA' . 36.1 mtt85 -70.4 -175.77 1.09 Allowed 'General case' 0 C--N 1.388 2.266 0 CA-C-N 112.112 -2.313 . . . . 0.0 108.926 155.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.915 ' CD ' HD23 ' P' ' 115' ' ' LEU . 1.0 OUTLIER -95.8 118.37 32.32 Favored 'General case' 0 C--N 1.384 2.071 0 CA-C-N 113.579 -1.646 . . . . 0.0 107.164 160.125 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.513 HG22 " O3'" ' A' ' 7' ' ' ' DA' . 0.1 OUTLIER -105.65 68.08 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.388 2.249 0 CA-C-O 125.265 2.46 . . . . 0.0 108.011 -163.48 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.915 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.89 108.75 10.15 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 111.52 -2.582 . . . . 0.0 109.335 -159.669 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.648 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.9 OUTLIER -77.49 143.63 38.34 Favored 'General case' 0 C--N 1.391 2.411 0 CA-C-N 112.725 -2.034 . . . . 0.0 107.705 -170.579 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.68 148.17 52.28 Favored 'General case' 0 C--N 1.382 1.984 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 -171.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -43.78 -36.51 2.32 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-N 113.279 -1.782 . . . . 0.0 109.157 -177.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.51 -65.16 0.61 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 124.203 1.954 . . . . 0.0 109.237 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.56 ' O ' HD13 ' P' ' 124' ' ' LEU . 78.2 mt-30 -49.32 -47.61 46.99 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 127.081 2.152 . . . . 0.0 109.722 176.189 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.54 ' HA ' HD13 ' P' ' 124' ' ' LEU . 16.5 m -51.16 -56.18 14.08 Favored 'General case' 0 C--N 1.384 2.072 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 169.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.543 ' CE1' ' CZ ' ' P' ' 126' ' ' ARG . 2.6 t80 -52.96 -48.62 67.24 Favored 'General case' 0 C--N 1.381 1.975 0 CA-C-O 122.593 1.187 . . . . 0.0 110.048 -169.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.996 ' CD ' HG23 ' P' ' 146' ' ' ILE . 6.9 mt-10 -66.23 -36.97 84.42 Favored 'General case' 0 C--N 1.377 1.798 0 CA-C-N 114.253 -1.34 . . . . 0.0 107.826 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.95 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -59.98 -51.85 67.92 Favored 'General case' 0 C--N 1.384 2.079 0 O-C-N 120.76 -1.212 . . . . 0.0 109.871 170.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' P' ' 129' ' ' ARG . 24.2 mt-10 -54.59 -51.47 65.22 Favored 'General case' 0 C--N 1.379 1.872 0 CA-C-O 122.629 1.205 . . . . 0.0 109.294 178.209 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.543 ' CZ ' ' CE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.46 -70.06 0.12 Allowed 'General case' 0 C--N 1.379 1.873 0 CA-C-N 111.683 -2.508 . . . . 0.0 108.681 177.076 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.808 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.7 OUTLIER -56.67 -38.73 72.63 Favored 'General case' 0 C--N 1.387 2.238 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.259 -173.181 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.867 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 27.5 t80 -69.47 -46.44 66.66 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-O 121.541 0.686 . . . . 0.0 110.144 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' P' ' 125' ' ' GLU . 13.2 mtp85 -62.63 -13.96 37.74 Favored 'General case' 0 C--N 1.381 1.936 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 -168.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -107.44 -37.19 6.28 Favored 'General case' 0 C--N 1.379 1.887 0 C-N-CA 126.938 2.095 . . . . 0.0 107.96 -168.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.495 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -153.43 108.37 3.17 Favored 'General case' 0 C--N 1.39 2.328 0 CA-C-N 111.971 -2.377 . . . . 0.0 108.615 -153.45 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -76.15 -19.37 58.53 Favored 'General case' 0 C--N 1.39 2.36 0 CA-C-N 112.021 -2.354 . . . . 0.0 110.508 -168.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.476 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 36.5 m-85 -162.27 112.54 1.53 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 113.875 -1.511 . . . . 0.0 108.313 -153.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.808 HD12 ' HD3' ' P' ' 127' ' ' ARG . 29.6 mt -120.84 142.69 49.4 Favored 'General case' 0 C--N 1.398 2.706 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -163.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.83 152.24 29.82 Favored 'General case' 0 C--N 1.382 2.02 0 O-C-N 121.14 -0.975 . . . . 0.0 108.408 158.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.487 ' HA ' ' CG ' ' P' ' 139' ' ' ARG . . . -58.58 -43.78 98.34 Favored Pre-proline 0 CA--C 1.583 2.216 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -161.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -49.82 -43.35 41.11 Favored 'Trans proline' 0 C--N 1.393 2.914 0 N-CA-C 116.954 1.867 . . . . 0.0 116.954 -179.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.649 ' HG3' HD21 ' P' ' 134' ' ' LEU . 7.6 mm-40 -52.79 -62.61 1.54 Allowed 'General case' 0 C--N 1.39 2.353 0 CA-C-O 124.13 1.919 . . . . 0.0 105.984 169.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 1.019 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -68.01 -46.79 70.28 Favored 'General case' 0 C--N 1.388 2.273 0 CA-C-N 109.492 -3.504 . . . . 0.0 108.331 -158.506 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.627 ' O ' ' N ' ' P' ' 144' ' ' SER . 3.3 mt-10 -53.87 -35.71 61.85 Favored 'General case' 0 C--N 1.38 1.893 0 CA-C-O 122.744 1.259 . . . . 0.0 108.003 -177.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -65.96 -36.4 83.24 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.563 -1.653 . . . . 0.0 108.859 -173.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.623 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.0 OUTLIER -65.72 -42.28 91.24 Favored 'General case' 0 C--N 1.382 1.992 0 CA-C-O 123.172 1.463 . . . . 0.0 109.072 168.163 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.624 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.18 -32.66 64.54 Favored 'General case' 0 C--N 1.389 2.308 0 CA-C-N 112.62 -2.082 . . . . 0.0 108.346 172.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.627 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -73.15 -43.63 61.26 Favored 'General case' 0 C--N 1.389 2.302 0 CA-C-N 113.468 -1.696 . . . . 0.0 109.571 -177.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . 0.421 HD11 ' OE1' ' P' ' 123' ' ' GLU . 86.4 mt -69.2 -45.68 69.32 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-O 124.812 2.244 . . . . 0.0 108.262 -164.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.996 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -97.14 -13.28 8.14 Favored 'Isoleucine or valine' 0 C--N 1.39 2.36 0 CA-C-N 110.934 -2.848 . . . . 0.0 108.11 -169.245 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 83.05 34.87 0.06 Allowed 'General case' 0 C--N 1.382 1.995 0 CA-C-O 125.67 2.652 . . . . 0.0 108.249 152.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.991 HD13 ' CD1' ' P' ' 146' ' ' ILE . 9.2 mt -96.89 171.41 8.52 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 111.65 -2.523 . . . . 0.0 109.736 169.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.617 ' O ' ' N ' ' P' ' 152' ' ' GLN . 20.7 p -95.2 143.19 25.68 Favored Pre-proline 0 CA--C 1.588 2.442 0 CA-C-O 122.361 1.077 . . . . 0.0 108.773 168.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.452 ' HG3' ' HA ' ' P' ' 140' ' ' GLU . 77.5 Cg_exo -55.37 -36.45 93.85 Favored 'Trans proline' 0 C--N 1.41 3.787 0 C-N-CA 122.059 1.84 . . . . 0.0 114.475 -165.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.73 -9.26 13.35 Favored 'General case' 0 C--N 1.38 1.93 0 CA-C-N 119.992 1.269 . . . . 0.0 111.687 167.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.617 ' N ' ' O ' ' P' ' 149' ' ' THR . 42.5 mt-30 -88.56 -34.22 17.43 Favored 'General case' 0 C--O 1.285 2.952 0 CA-C-O 117.169 -1.396 . . . . 0.0 108.471 168.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.961 HG11 ' CE2' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -65.0 -70.5 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.941 0 CA-C-N 124.65 3.386 . . . . 0.0 109.731 165.806 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 1.019 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.4 -54.2 0.52 Allowed 'General case' 0 C--N 1.386 2.17 0 C-N-CA 125.796 1.638 . . . . 0.0 108.865 -178.315 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.635 HD12 ' OE1' ' P' ' 158' ' ' GLN . 7.4 mm -56.89 -61.74 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.956 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.95 ' HB3' HD21 ' P' ' 124' ' ' LEU . 3.4 t90 -49.82 -30.19 9.33 Favored 'General case' 0 C--N 1.382 2.019 0 O-C-N 120.2 -1.562 . . . . 0.0 109.187 -178.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.961 ' CE2' HG11 ' P' ' 153' ' ' VAL . 74.1 m-85 -75.51 -43.88 46.65 Favored 'General case' 0 C--O 1.282 2.779 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 170.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.635 ' OE1' HD12 ' P' ' 155' ' ' ILE . 13.6 mt-30 -41.95 -70.94 0.09 Allowed 'General case' 0 C--N 1.378 1.808 0 O-C-N 118.517 -2.614 . . . . 0.0 106.533 161.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -18.92 22.82 Favored 'General case' 0 C--N 1.385 2.15 0 CA-C-O 117.684 -1.151 . . . . 0.0 111.187 -165.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.54 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.1 t60 -74.95 -48.87 22.21 Favored 'General case' 0 C--O 1.281 2.72 0 CA-C-N 120.964 1.711 . . . . 0.0 110.186 177.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.875 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -68.63 -38.66 80.68 Favored 'General case' 0 C--O 1.269 2.079 0 CA-C-N 122.443 2.383 . . . . 0.0 110.59 -159.035 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -69.02 -30.95 69.44 Favored 'General case' 0 C--N 1.38 1.908 0 O-C-N 119.836 -1.79 . . . . 0.0 109.63 171.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -64.99 -37.52 87.91 Favored 'General case' 0 C--N 1.381 1.948 0 O-C-N 121.58 -0.7 . . . . 0.0 109.411 -173.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.875 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -59.0 -57.69 11.94 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-O 124.675 2.179 . . . . 0.0 106.092 -170.655 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.432 ' HA ' ' HG3' ' P' ' 168' ' ' GLN . 17.0 mtpt -58.78 -45.37 89.99 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-N 108.564 -3.926 . . . . 0.0 109.123 -167.096 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -42.55 -51.18 5.19 Favored 'General case' 0 C--N 1.383 2.065 0 CA-C-N 113.339 -1.755 . . . . 0.0 111.278 170.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.64 -33.82 74.61 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-N 111.647 -2.524 . . . . 0.0 108.504 -171.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . 0.432 ' HG3' ' HA ' ' P' ' 165' ' ' LYS . 0.2 OUTLIER -80.15 -23.19 41.28 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 111.862 -2.426 . . . . 0.0 109.479 -174.888 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -54.78 -30.23 56.26 Favored 'General case' 0 C--N 1.384 2.101 0 CA-C-O 122.791 1.281 . . . . 0.0 109.337 169.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -74.33 -35.18 63.6 Favored 'General case' 0 C--N 1.387 2.198 0 CA-C-N 113.044 -1.889 . . . . 0.0 108.211 -164.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 12.0 mttt -85.2 89.62 7.69 Favored 'General case' 0 C--N 1.381 1.957 0 CA-C-N 113.821 -1.536 . . . . 0.0 109.14 -155.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 116.8 -87.51 0.44 Allowed Glycine 0 C--N 1.382 3.139 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 -155.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . 0.546 ' HD1' ' N ' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 155.62 151.08 0.01 OUTLIER 'General case' 0 C--N 1.381 1.953 0 CA-C-N 113.335 -1.433 . . . . 0.0 108.887 171.144 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -165.65 158.14 15.19 Favored 'General case' 0 C--N 1.39 2.333 0 CA-C-N 112.645 -2.07 . . . . 0.0 107.357 156.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 53.75 27.55 36.06 Favored Glycine 0 C--N 1.38 3.008 0 O-C-N 120.479 -1.388 . . . . 0.0 110.305 -160.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -130.1 134.33 25.99 Favored Pre-proline 0 CA--C 1.58 2.116 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 174.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo . . . . . 0 CA--C 1.593 3.465 0 C-N-CA 121.474 1.449 . . . . 0.0 111.604 172.63 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.769 0 O5'-C5'-C4' 114.385 2.989 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.77 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.561 3.314 0 O4'-C4'-C3' 108.144 2.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.77 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.94 0 P-O3'-C3' 122.728 2.524 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.627 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.408 0 P-O3'-C3' 123.295 2.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.555 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.843 0 O4'-C4'-C3' 108.1 2.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.51 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 1 C4'--C3' 1.568 4.018 0 N19-C1'-C2' 118.941 2.963 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.78 " C5'" ' HG2' ' P' ' 113' ' ' ARG . . . . . . . . 0 C4'--C3' 1.562 3.434 1 O4'-C1'-N19 111.569 4.711 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.651 H2'' ' C8 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.412 0 C3'-C2'-C1' 106.284 2.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.651 ' C8 ' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.563 0 O4'-C4'-C3' 108.483 2.883 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.595 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.798 0 P-O3'-C3' 123.997 3.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.464 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.595 0 O4'-C4'-C3' 108.546 2.946 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.489 1 P-O3'-C3' 125.653 4.96 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.504 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 O4'-C4'-C3' 108.426 2.826 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.504 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.696 0 C2'-C3'-O3' 116.659 2.244 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.728 ' C8 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.878 1 O4'-C1'-N19 111.32 4.399 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.728 ' H72' ' C8 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.553 0 P-O3'-C3' 122.227 2.106 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.671 0 O5'-C5'-C4' 115.038 3.456 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.601 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.531 0 O4'-C4'-C3' 108.336 2.736 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.601 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.347 0 P-O3'-C3' 123.121 2.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.489 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.355 0 O4'-C4'-C3' 108.077 2.477 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.662 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.571 4.311 0 N19-C1'-C2' 118.917 2.948 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.662 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.559 0 P-O3'-C3' 123.257 2.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.443 0 C3'-C2'-C1' 107.11 3.15 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.865 0 O4'-C4'-C3' 108.209 2.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.573 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.572 4.374 1 P-O3'-C3' 124.981 4.401 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.539 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.212 0 P-O3'-C3' 124.293 3.828 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.543 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.588 0 P-O3'-C3' 123.744 3.37 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.629 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.483 0 C4'-C3'-C2' 100.667 -2.533 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.629 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.58 0 P-O3'-C3' 123.294 2.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.642 H5'' HH12 ' P' ' 113' ' ' ARG . . . . . . . . 0 C5'--C4' 1.538 3.37 0 O4'-C4'-C3' 107.843 2.243 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.492 H2'' ' C8 ' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.595 0 O4'-C4'-C3' 108.186 2.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . 0.492 ' C8 ' H2'' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.542 3.899 0 O4'-C1'-N19 109.404 2.004 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.502 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.9 t -80.53 -59.49 2.67 Favored 'General case' 0 C--N 1.382 1.983 0 CA-C-N 113.669 -1.605 . . . . 0.0 108.635 175.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 169.65 37.74 0.0 OUTLIER 'General case' 0 C--N 1.396 2.602 0 CA-C-N 113.383 -1.735 . . . . 0.0 109.483 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . 95.28 151.88 28.74 Favored Glycine 0 C--N 1.381 3.063 0 N-CA-C 108.738 -1.745 . . . . 0.0 108.738 161.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.65 HD11 ' HD2' ' P' ' 106' ' ' PRO . 0.1 OUTLIER -157.27 145.59 14.36 Favored Pre-proline 0 CA--C 1.58 2.122 0 CA-C-N 113.679 -1.26 . . . . 0.0 108.775 -165.801 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.65 ' HD2' HD11 ' P' ' 105' ' ' LEU . 0.1 OUTLIER -82.15 45.88 2.06 Favored 'Trans proline' 0 C--N 1.394 2.957 0 C-N-CA 123.142 2.561 . . . . 0.0 110.524 163.863 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -52.69 153.44 3.18 Favored 'General case' 0 C--N 1.382 1.981 0 CA-C-N 113.928 -1.487 . . . . 0.0 109.171 -174.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.6 -165.75 1.1 Allowed 'General case' 0 C--N 1.382 1.998 0 CA-C-N 113.715 -1.584 . . . . 0.0 108.132 -173.096 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.741 ' HE2' ' O ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -69.75 135.21 49.49 Favored 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.705 -1.589 . . . . 0.0 109.093 179.445 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.741 ' O ' ' HE2' ' P' ' 109' ' ' LYS . 1.1 mmt85 -96.03 -145.28 0.28 Allowed 'General case' 0 C--N 1.377 1.793 0 CA-C-O 123.915 1.816 . . . . 0.0 108.151 -169.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' P' ' 112' ' ' ARG . 0.1 OUTLIER -146.77 115.86 6.94 Favored 'General case' 0 C--N 1.39 2.365 0 CA-C-N 111.68 -2.509 . . . . 0.0 107.979 158.706 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . 0.521 ' O ' ' HG3' ' P' ' 111' ' ' LYS . 70.2 mtt85 -62.92 170.96 2.38 Favored 'General case' 0 C--N 1.382 1.979 0 CA-C-N 114.145 -1.389 . . . . 0.0 108.799 160.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.915 ' CD ' HD23 ' P' ' 115' ' ' LEU . 1.2 ttm180 -87.13 117.27 25.75 Favored 'General case' 0 C--N 1.384 2.081 0 CA-C-N 113.569 -1.65 . . . . 0.0 106.917 163.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.556 HG22 " O3'" ' A' ' 7' ' ' ' DA' . 0.1 OUTLIER -105.63 69.2 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.387 2.217 0 CA-C-O 125.107 2.384 . . . . 0.0 108.004 -163.486 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.915 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.62 108.12 9.4 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 111.697 -2.501 . . . . 0.0 109.469 -156.369 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.433 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.5 m-85 -76.81 141.42 40.72 Favored 'General case' 0 C--N 1.389 2.287 0 CA-C-N 112.97 -1.923 . . . . 0.0 108.026 -170.376 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.1 p -67.37 148.08 52.09 Favored 'General case' 0 C--N 1.381 1.967 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -171.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -43.17 -36.17 1.63 Allowed 'General case' 0 C--N 1.382 2.012 0 CA-C-N 113.271 -1.786 . . . . 0.0 109.258 -178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.56 -66.67 0.35 Allowed 'General case' 0 C--N 1.383 2.032 0 CA-C-O 124.172 1.939 . . . . 0.0 109.078 173.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.602 ' O ' HD13 ' P' ' 124' ' ' LEU . 80.9 mt-30 -49.12 -48.24 44.71 Favored 'General case' 0 C--N 1.382 2.005 0 CA-C-N 112.421 -2.172 . . . . 0.0 109.491 177.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.586 ' HA ' HD13 ' P' ' 124' ' ' LEU . 19.9 m -52.38 -55.07 24.15 Favored 'General case' 0 C--N 1.385 2.143 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 170.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.484 ' CE1' ' CZ ' ' P' ' 126' ' ' ARG . 2.3 t80 -53.05 -45.69 68.19 Favored 'General case' 0 C--N 1.383 2.057 0 CA-C-O 122.237 1.018 . . . . 0.0 109.985 -171.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.819 ' HG3' HG23 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.8 -39.64 87.84 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-N 114.321 -1.309 . . . . 0.0 107.834 179.664 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.893 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.3 mt -60.55 -49.49 77.33 Favored 'General case' 0 C--N 1.385 2.111 0 O-C-N 120.532 -1.355 . . . . 0.0 109.599 172.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.565 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.5 mt-10 -55.68 -51.79 66.06 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-O 122.575 1.179 . . . . 0.0 109.639 177.058 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.484 ' CZ ' ' CE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.65 -70.24 0.11 Allowed 'General case' 0 C--N 1.378 1.822 0 CA-C-N 111.851 -2.431 . . . . 0.0 109.022 177.245 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.724 ' HD2' HD23 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -62.82 -31.44 72.43 Favored 'General case' 0 C--N 1.379 1.866 0 CA-C-N 113.702 -1.59 . . . . 0.0 108.244 -171.185 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.815 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 19.9 t80 -70.13 -49.02 54.93 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-N 119.786 1.176 . . . . 0.0 109.971 175.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.565 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.5 mmm180 -62.65 -16.12 55.41 Favored 'General case' 0 C--N 1.38 1.909 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -166.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -105.29 -41.29 5.57 Favored 'General case' 0 C--N 1.378 1.84 0 CA-C-O 124.07 1.891 . . . . 0.0 107.217 -168.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.471 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.7 OUTLIER -152.94 96.67 2.12 Favored 'General case' 0 C--N 1.386 2.175 0 CA-C-N 111.752 -2.477 . . . . 0.0 109.54 -152.012 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . 0.487 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -77.48 -5.85 51.44 Favored 'General case' 0 C--N 1.394 2.52 0 CA-C-N 111.59 -2.55 . . . . 0.0 110.779 -158.406 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.776 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 2.5 m-30 -163.85 113.04 1.23 Allowed 'General case' 0 C--N 1.38 1.923 0 CA-C-N 114.516 -1.22 . . . . 0.0 108.356 -154.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.724 HD23 ' HD2' ' P' ' 127' ' ' ARG . 43.3 mt -120.67 139.6 52.79 Favored 'General case' 0 C--N 1.397 2.664 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -161.064 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.85 157.63 25.63 Favored 'General case' 0 C--N 1.382 2.022 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 160.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.556 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.22 -49.81 90.9 Favored Pre-proline 0 CA--C 1.583 2.222 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.465 -164.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.556 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 50.9 Cg_exo -55.99 -29.73 75.03 Favored 'Trans proline' 0 C--N 1.399 3.187 0 C-N-CA 121.002 1.135 . . . . 0.0 114.649 -173.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.529 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -55.87 -69.45 0.14 Allowed 'General case' 0 C--N 1.385 2.121 0 CA-C-O 124.176 1.941 . . . . 0.0 106.09 165.535 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.664 ' CZ ' ' HG3' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.67 -35.79 75.44 Favored 'General case' 0 C--N 1.391 2.408 0 CA-C-N 109.858 -3.337 . . . . 0.0 108.85 -156.275 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.639 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 4.0 mt-10 -52.25 -44.8 65.08 Favored 'General case' 0 C--N 1.381 1.944 0 CA-C-O 123.628 1.68 . . . . 0.0 107.786 174.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -67.12 -36.3 81.6 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 112.396 -2.184 . . . . 0.0 109.121 -166.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.557 ' O ' HG21 ' P' ' 146' ' ' ILE . 1.0 OUTLIER -65.95 -42.1 90.42 Favored 'General case' 0 C--N 1.382 1.995 0 CA-C-O 123.158 1.456 . . . . 0.0 109.049 169.401 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.639 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.3 -35.69 67.81 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.54 -2.118 . . . . 0.0 108.094 172.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.592 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.5 t -70.9 -43.14 68.92 Favored 'General case' 0 C--N 1.389 2.305 0 CA-C-N 113.231 -1.804 . . . . 0.0 110.592 -178.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.73 -46.96 67.55 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-O 124.863 2.268 . . . . 0.0 108.09 -164.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.97 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.37 -13.16 8.23 Favored 'Isoleucine or valine' 0 C--N 1.39 2.351 0 CA-C-N 110.815 -2.902 . . . . 0.0 108.042 -168.291 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . 0.573 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 7.4 tpt180 82.32 35.28 0.07 Allowed 'General case' 0 C--N 1.382 1.998 0 CA-C-O 125.635 2.636 . . . . 0.0 107.837 153.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.97 HD13 ' CD1' ' P' ' 146' ' ' ILE . 9.8 mt -95.89 172.32 8.09 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 111.473 -2.603 . . . . 0.0 109.145 168.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.477 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.3 p -88.98 146.43 36.54 Favored Pre-proline 0 CA--C 1.587 2.371 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 165.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.601 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 85.0 Cg_exo -50.45 -49.39 16.68 Favored 'Trans proline' 0 C--N 1.408 3.71 0 C-N-CA 123.78 2.986 . . . . 0.0 114.127 -167.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 151' ' ' THR . . . . . 0.425 HG23 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -58.26 -20.66 44.04 Favored 'General case' 0 C--N 1.386 2.194 0 CA-C-N 112.759 -2.019 . . . . 0.0 110.79 173.847 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.4 mt-30 -78.07 -32.48 50.8 Favored 'General case' 0 C--O 1.277 2.522 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 171.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.757 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.7 t -64.27 -75.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.381 1.972 0 CA-C-N 122.967 2.621 . . . . 0.0 109.718 162.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.664 ' HG3' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -40.65 -42.84 1.8 Allowed 'General case' 0 C--N 1.387 2.212 0 C-N-CA 124.881 1.273 . . . . 0.0 109.971 -171.108 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.425 HG12 HG23 ' P' ' 151' ' ' THR . 0.7 OUTLIER -60.3 -63.05 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.956 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 -179.381 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.893 ' HB3' HD21 ' P' ' 124' ' ' LEU . 2.7 t90 -49.5 -29.03 6.08 Favored 'General case' 0 C--N 1.384 2.078 0 O-C-N 121.415 -0.803 . . . . 0.0 109.311 -177.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.815 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 52.1 m-85 -75.19 -43.06 54.17 Favored 'General case' 0 C--O 1.275 2.437 0 O-C-N 121.629 -0.669 . . . . 0.0 112.37 173.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -46.58 -65.32 0.58 Allowed 'General case' 0 C--N 1.376 1.759 0 O-C-N 119.131 -2.231 . . . . 0.0 107.028 165.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -56.0 -19.77 13.93 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-O 117.868 -1.063 . . . . 0.0 111.073 -164.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.551 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.6 OUTLIER -79.19 -46.59 17.59 Favored 'General case' 0 C--O 1.286 3.019 0 CA-C-N 121.055 1.752 . . . . 0.0 111.752 173.499 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.776 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -65.97 -37.48 86.09 Favored 'General case' 0 C--O 1.266 1.939 0 CA-C-N 123.603 2.91 . . . . 0.0 110.192 -163.854 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.483 ' CZ ' ' HB2' ' P' ' 166' ' ' ARG . 86.7 t80 -68.93 -35.2 76.52 Favored 'General case' 0 C--N 1.38 1.934 0 O-C-N 120.035 -1.666 . . . . 0.0 109.621 170.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.47 -37.46 87.61 Favored 'General case' 0 C--N 1.382 2.0 0 O-C-N 121.598 -0.689 . . . . 0.0 109.394 -169.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.702 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.6 OUTLIER -56.69 -61.31 2.51 Favored 'General case' 0 C--N 1.378 1.845 0 CA-C-O 124.828 2.252 . . . . 0.0 106.297 -173.473 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.417 ' HG2' HG21 ' P' ' 164' ' ' THR . 7.5 mmmt -59.19 -48.15 82.67 Favored 'General case' 0 C--N 1.387 2.197 1 CA-C-N 108.184 -4.098 . . . . 0.0 108.121 -160.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . 0.483 ' HB2' ' CZ ' ' P' ' 162' ' ' TYR . 23.8 ttt180 -54.63 -42.42 71.19 Favored 'General case' 0 C--N 1.381 1.97 0 CA-C-N 112.268 -2.242 . . . . 0.0 109.196 -179.233 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . 0.417 ' HB1' ' O ' ' P' ' 164' ' ' THR . . . -60.07 -34.53 73.56 Favored 'General case' 0 C--N 1.384 2.07 0 CA-C-N 113.392 -1.731 . . . . 0.0 108.983 -175.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -80.94 -22.58 39.52 Favored 'General case' 0 C--N 1.389 2.296 0 CA-C-N 112.079 -2.328 . . . . 0.0 109.235 -173.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -56.73 -29.87 62.95 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-O 122.689 1.233 . . . . 0.0 109.981 168.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . 0.469 ' OE2' ' HE1' ' P' ' 173' ' ' TYR . 0.7 OUTLIER -71.18 -34.96 71.4 Favored 'General case' 0 C--N 1.385 2.151 0 CA-C-N 113.565 -1.652 . . . . 0.0 108.085 -167.936 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -89.34 85.13 6.51 Favored 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.922 -1.49 . . . . 0.0 109.231 -157.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 128.2 -64.02 0.6 Allowed Glycine 0 C--N 1.383 3.143 0 N-CA-C 108.829 -1.708 . . . . 0.0 108.829 -166.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . 0.469 ' HE1' ' OE2' ' P' ' 170' ' ' GLU . 18.6 m-85 122.72 160.51 0.0 OUTLIER 'General case' 0 C--N 1.381 1.936 0 CA-C-N 113.18 -1.51 . . . . 0.0 108.964 160.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -82.06 51.4 1.76 Allowed 'General case' 0 C--N 1.379 1.888 0 CA-C-N 112.211 -2.268 . . . . 0.0 110.363 174.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 146.75 -153.48 25.38 Favored Glycine 0 C--N 1.382 3.125 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -163.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . 0.422 ' CD2' ' HD2' ' P' ' 177' ' ' PRO . 19.3 t-80 -150.45 128.7 5.91 Favored Pre-proline 0 CA--C 1.58 2.124 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -174.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . 0.422 ' HD2' ' CD2' ' P' ' 176' ' ' HIS . 88.3 Cg_endo . . . . . 0 CA--C 1.593 3.47 0 C-N-CA 121.533 1.489 . . . . 0.0 111.589 -168.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.813 0 O5'-C5'-C4' 114.362 2.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.441 " C2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.331 1 P-O3'-C3' 126.833 5.944 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.503 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.902 0 C2'-C3'-O3' 117.07 2.396 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.654 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.525 0 P-O3'-C3' 123.369 3.058 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.52 ' C2 ' ' C2 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.739 0 O4'-C4'-C3' 108.13 2.53 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.596 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.569 4.111 0 N19-C1'-C2' 119.679 3.424 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.793 H5'' HD21 ' P' ' 115' ' ' LEU . . . . . . . . 0 C4'--C3' 1.565 3.655 2 P-O3'-C3' 124.903 4.336 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.844 " O4'" ' HE3' ' P' ' 111' ' ' LYS . . . . . . . . 0 C5'--C4' 1.538 3.415 0 P-O5'-C5' 116.541 -2.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.592 ' C5 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.564 0 O4'-C4'-C3' 108.496 2.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.592 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.871 1 P-O3'-C3' 125.402 4.751 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.49 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.453 0 P-O3'-C3' 122.827 2.606 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . 0.516 H2'' ' C5 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.306 0 P-O3'-C3' 122.597 2.414 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.675 ' C5 ' ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.59 0 O4'-C4'-C3' 108.174 2.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.675 ' H72' ' C5 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.634 0 P-O3'-C3' 123.646 3.289 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.666 ' C8 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.927 1 O4'-C1'-N19 111.613 4.767 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.666 ' H72' ' C8 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.517 0 P-O3'-C3' 122.18 2.066 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . 0.438 H2'' H5'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.749 0 O5'-C5'-C4' 115.067 3.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.52 H2'' ' C8 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.649 1 P-O3'-C3' 126.406 5.589 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.52 ' C8 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.326 0 O4'-C4'-C3' 108.175 2.575 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.527 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.321 0 O4'-C4'-C3' 107.845 2.245 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.584 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.571 4.337 0 O4'-C1'-N19 105.249 -3.188 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.584 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.559 4.149 1 P-O3'-C3' 126.539 5.699 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.568 3.983 1 P-O3'-C3' 126.22 5.433 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.604 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.811 0 P-O3'-C3' 124.285 3.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.604 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.891 0 P-O3'-C3' 123.675 3.312 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.517 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C3'--C2' 1.559 4.096 0 N19-C1'-C2' 119.12 3.075 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.632 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.696 0 P-O3'-C3' 123.69 3.325 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.632 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.561 3.343 0 P-O3'-C3' 122.523 2.352 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.654 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.666 0 O4'-C4'-C3' 108.275 2.675 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.506 ' C8 ' H2'' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.378 0 O4'-C4'-C3' 107.867 2.267 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.572 0 O4'-C4'-C3' 108.207 2.607 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.935 0 O4'-C1'-N19 109.392 1.99 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.512 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.5 m -162.5 -45.7 0.04 OUTLIER 'General case' 0 C--N 1.382 2.013 0 CA-C-N 113.664 -1.607 . . . . 0.0 108.612 168.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 169.97 23.29 0.0 OUTLIER 'General case' 0 C--N 1.396 2.595 0 CA-C-N 113.319 -1.764 . . . . 0.0 109.413 173.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . 0.717 ' O ' HD23 ' P' ' 105' ' ' LEU . . . 108.6 -80.73 0.27 Allowed Glycine 0 C--N 1.38 2.974 0 N-CA-C 108.806 -1.718 . . . . 0.0 108.806 -164.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.717 HD23 ' O ' ' P' ' 104' ' ' GLY . 0.2 OUTLIER -177.45 153.14 0.98 Allowed Pre-proline 0 CA--C 1.582 2.182 0 CA-C-N 113.735 -1.232 . . . . 0.0 108.637 -161.697 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.8 92.77 0.02 OUTLIER 'Trans proline' 0 C--N 1.398 3.151 0 C-N-CA 122.883 2.389 . . . . 0.0 110.373 155.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -100.96 -175.22 2.82 Favored 'General case' 0 C--N 1.382 1.998 0 CA-C-O 122.441 1.115 . . . . 0.0 109.159 165.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.799 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.2 OUTLIER -153.58 127.14 8.69 Favored 'General case' 0 C--N 1.382 1.982 0 CA-C-N 113.688 -1.596 . . . . 0.0 108.195 -175.242 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.549 ' HE2' ' OP1' ' A' ' 9' ' ' ' DG' . 0.1 OUTLIER -66.03 162.59 19.11 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-N 113.747 -1.57 . . . . 0.0 109.132 -164.777 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.799 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.8 OUTLIER -126.19 92.74 3.64 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 113.826 -1.533 . . . . 0.0 109.267 -155.277 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.844 ' HE3' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -123.59 108.37 12.53 Favored 'General case' 0 C--N 1.381 1.941 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.666 154.85 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . 0.618 ' O ' HG21 ' P' ' 114' ' ' VAL . 1.9 mtp85 -103.35 -176.45 3.09 Favored 'General case' 0 C--N 1.381 1.961 0 CA-C-N 113.595 -1.639 . . . . 0.0 108.915 166.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 1.054 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.0 OUTLIER -69.57 88.99 0.51 Allowed 'General case' 0 C--N 1.394 2.54 0 N-CA-C 105.112 -2.181 . . . . 0.0 105.112 155.439 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.618 HG21 ' O ' ' P' ' 112' ' ' ARG . 0.1 OUTLIER -98.13 54.46 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.39 2.328 0 CA-C-O 126.0 2.809 . . . . 0.0 107.834 -167.343 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 1.054 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.1 OUTLIER -77.51 107.55 10.04 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 110.453 -3.067 . . . . 0.0 109.524 -155.249 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.617 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.2 m-85 -76.07 140.96 42.14 Favored 'General case' 0 C--N 1.392 2.441 0 CA-C-N 112.315 -2.221 . . . . 0.0 107.905 -163.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.55 147.41 53.46 Favored 'General case' 0 C--N 1.381 1.964 0 N-CA-C 107.543 -1.281 . . . . 0.0 107.543 -166.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 33.7 ttmt -41.72 -36.24 0.95 Allowed 'General case' 0 C--N 1.381 1.957 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.283 -176.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.1 -68.75 0.16 Allowed 'General case' 0 C--N 1.382 2.013 0 CA-C-O 124.329 2.014 . . . . 0.0 109.14 173.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.531 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 78.8 mt-30 -46.79 -50.11 18.81 Favored 'General case' 0 C--N 1.383 2.056 0 CA-C-N 112.356 -2.202 . . . . 0.0 109.855 176.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.527 ' HA ' HD13 ' P' ' 124' ' ' LEU . 18.7 m -51.18 -55.92 15.44 Favored 'General case' 0 C--N 1.383 2.05 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 170.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.609 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.8 t80 -52.99 -46.38 68.29 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-O 122.34 1.067 . . . . 0.0 110.194 -171.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.807 ' HG3' HG23 ' P' ' 146' ' ' ILE . 0.3 OUTLIER -66.42 -39.5 88.99 Favored 'General case' 0 C--N 1.379 1.88 0 CA-C-N 114.455 -1.248 . . . . 0.0 107.759 179.494 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 1.009 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.7 mt -60.84 -49.11 78.8 Favored 'General case' 0 C--N 1.385 2.136 0 O-C-N 120.592 -1.317 . . . . 0.0 109.953 173.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.555 ' O ' ' N ' ' P' ' 129' ' ' ARG . 17.8 mt-10 -53.74 -55.37 26.87 Favored 'General case' 0 C--N 1.38 1.895 0 CA-C-O 122.354 1.073 . . . . 0.0 108.841 175.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.609 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.82 -66.56 0.29 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 111.918 -2.401 . . . . 0.0 108.677 178.785 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.752 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.7 OUTLIER -61.09 -33.31 73.14 Favored 'General case' 0 C--N 1.394 2.503 0 CA-C-N 112.427 -2.17 . . . . 0.0 108.384 -173.416 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.714 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 13.8 t80 -67.5 -50.99 56.34 Favored 'General case' 0 C--N 1.387 2.23 0 O-C-N 121.195 -0.941 . . . . 0.0 110.29 174.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.555 ' N ' ' O ' ' P' ' 125' ' ' GLU . 0.1 OUTLIER -62.58 -12.56 23.59 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-N 112.916 -1.947 . . . . 0.0 108.158 -165.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -108.62 -39.67 5.32 Favored 'General case' 0 C--N 1.38 1.909 0 C-N-CA 126.383 1.873 . . . . 0.0 108.251 -170.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.496 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -151.79 110.24 3.77 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 112.051 -2.34 . . . . 0.0 108.861 -153.237 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -76.78 -20.28 56.63 Favored 'General case' 0 C--N 1.392 2.441 0 CA-C-N 112.23 -2.259 . . . . 0.0 110.738 -168.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.411 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 33.0 m-85 -161.02 114.18 1.97 Allowed 'General case' 0 C--N 1.379 1.887 0 CA-C-N 113.812 -1.54 . . . . 0.0 108.298 -153.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.752 HD12 ' HD3' ' P' ' 127' ' ' ARG . 26.4 mt -124.91 137.04 54.29 Favored 'General case' 0 C--N 1.399 2.753 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -159.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.35 154.84 26.27 Favored 'General case' 0 C--N 1.381 1.95 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 166.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.532 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -59.68 -49.36 92.28 Favored Pre-proline 0 CA--C 1.583 2.242 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.248 -161.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.532 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 82.7 Cg_exo -58.05 -28.89 85.09 Favored 'Trans proline' 0 C--N 1.4 3.286 0 C-N-CA 121.183 1.255 . . . . 0.0 114.956 -174.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.646 ' HG3' HD21 ' P' ' 134' ' ' LEU . 1.4 mm-40 -54.04 -70.78 0.09 Allowed 'General case' 0 C--N 1.379 1.883 0 CA-C-O 124.786 2.231 . . . . 0.0 106.308 160.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.898 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.25 -40.47 81.93 Favored 'General case' 0 C--N 1.39 2.328 0 CA-C-N 109.88 -3.327 . . . . 0.0 108.794 -155.14 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.616 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 5.0 mt-10 -53.24 -38.24 62.8 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-O 123.125 1.441 . . . . 0.0 108.294 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -65.18 -35.6 81.6 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 112.955 -1.93 . . . . 0.0 108.728 -172.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.579 HD12 ' CG ' ' P' ' 127' ' ' ARG . 2.9 tp -64.37 -43.14 95.44 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-O 123.277 1.513 . . . . 0.0 108.976 167.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.616 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.86 -34.61 67.99 Favored 'General case' 0 C--N 1.39 2.351 0 CA-C-N 112.29 -2.232 . . . . 0.0 108.613 176.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.59 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.9 OUTLIER -73.83 -44.04 56.89 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.142 -179.587 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 74.7 mt -65.54 -46.75 78.33 Favored 'General case' 0 C--N 1.379 1.859 0 CA-C-O 124.866 2.27 . . . . 0.0 107.88 -163.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.961 HD13 HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.99 -17.65 6.85 Favored 'Isoleucine or valine' 0 C--N 1.384 2.108 0 CA-C-N 110.435 -3.075 . . . . 0.0 107.664 -171.101 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 80.93 37.44 0.09 Allowed 'General case' 0 C--N 1.385 2.141 0 CA-C-N 111.397 -2.638 . . . . 0.0 108.158 152.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.961 HD13 HD13 ' P' ' 146' ' ' ILE . 6.0 mt -95.05 168.71 10.6 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-N 112.121 -2.308 . . . . 0.0 109.308 168.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.648 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.4 p -88.29 143.48 32.69 Favored Pre-proline 0 CA--C 1.587 2.375 0 CA-C-O 122.862 1.315 . . . . 0.0 108.137 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.426 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 1.0 OUTLIER -59.84 -37.35 86.91 Favored 'Trans proline' 1 C--N 1.414 4.001 0 C-N-CA 122.634 2.223 . . . . 0.0 111.926 -155.743 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' P' P ' 151' ' ' THR . . . . . 0.508 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.2 OUTLIER -56.69 -33.1 66.09 Favored 'General case' 0 C--N 1.386 2.174 0 C-N-CA 119.657 -0.817 . . . . 0.0 110.059 167.644 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.648 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.8 mt-30 -72.8 -26.97 61.7 Favored 'General case' 0 C--N 1.388 2.269 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.516 HG11 ' CD2' ' P' ' 157' ' ' PHE . 0.9 OUTLIER -64.29 -69.78 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.084 0 CA-C-N 121.789 2.086 . . . . 0.0 109.229 164.39 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.898 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -35.55 -60.13 0.52 Allowed 'General case' 0 C--N 1.386 2.153 0 C-N-CA 125.194 1.398 . . . . 0.0 110.462 -176.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.635 HG22 " H5'" ' A' ' 8' ' ' ' DA' . 4.3 mm -58.95 -37.38 66.99 Favored 'Isoleucine or valine' 0 C--N 1.384 2.106 0 CA-C-N 112.889 -1.96 . . . . 0.0 110.841 -174.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 1.009 ' HB3' HD21 ' P' ' 124' ' ' LEU . 5.5 t90 -67.38 -32.17 72.91 Favored 'General case' 0 C--N 1.381 1.959 0 O-C-N 120.369 -1.457 . . . . 0.0 109.21 169.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.714 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 44.0 m-85 -75.51 -43.79 47.18 Favored 'General case' 0 C--O 1.276 2.497 0 O-C-N 120.713 -1.242 . . . . 0.0 111.823 175.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' P' ' 154' ' ' LYS . 46.3 mt-30 -50.68 -58.25 6.33 Favored 'General case' 0 C--N 1.377 1.784 0 O-C-N 118.994 -2.316 . . . . 0.0 107.292 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -54.93 -29.92 57.38 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-O 117.957 -1.02 . . . . 0.0 108.917 -169.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.532 ' HB3' ' CE1' ' P' ' 128' ' ' PHE . 3.4 t60 -77.58 -41.12 39.91 Favored 'General case' 0 C--O 1.285 2.972 0 CA-C-N 121.562 1.983 . . . . 0.0 111.667 -174.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.864 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -65.99 -42.38 89.85 Favored 'General case' 0 C--O 1.266 1.963 0 CA-C-N 122.995 2.634 . . . . 0.0 108.482 -170.715 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.445 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 40.6 t80 -66.47 -28.02 68.25 Favored 'General case' 0 C--N 1.381 1.962 0 O-C-N 119.957 -1.715 . . . . 0.0 110.109 171.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . 0.427 ' HB3' ' HA ' ' P' ' 160' ' ' HIS . 7.7 ttmm -65.63 -34.54 78.45 Favored 'General case' 0 C--N 1.382 1.986 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 -174.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.864 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.4 OUTLIER -70.38 -57.48 4.78 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 125.808 2.718 . . . . 0.0 105.576 -165.917 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.414 ' CD ' ' O ' ' P' ' 161' ' ' ARG . 8.8 mtpt -57.58 -45.42 85.25 Favored 'General case' 0 C--N 1.389 2.312 1 CA-C-N 108.368 -4.015 . . . . 0.0 108.903 -171.14 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.52 -40.59 75.31 Favored 'General case' 0 C--N 1.38 1.892 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.817 -178.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.69 -33.47 74.06 Favored 'General case' 0 C--N 1.384 2.072 0 CA-C-O 124.157 1.932 . . . . 0.0 109.319 -177.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -85.31 -18.33 34.2 Favored 'General case' 0 C--N 1.39 2.357 0 CA-C-N 112.119 -2.31 . . . . 0.0 109.744 -174.297 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -51.51 -32.06 26.25 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 122.98 1.372 . . . . 0.0 109.372 166.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -80.04 -31.65 39.51 Favored 'General case' 0 C--N 1.379 1.885 0 CA-C-N 112.719 -2.037 . . . . 0.0 107.946 -161.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 3.6 mttm -101.38 14.69 31.2 Favored 'General case' 0 C--N 1.38 1.924 0 CA-C-O 125.045 2.355 . . . . 0.0 110.691 -176.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . -151.55 65.39 0.36 Allowed Glycine 0 C--N 1.39 3.542 0 CA-C-N 110.254 -3.157 . . . . 0.0 108.734 152.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -47.34 143.77 3.24 Favored 'General case' 0 C--N 1.384 2.077 0 CA-C-O 124.259 1.981 . . . . 0.0 108.12 -176.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -148.9 97.08 2.66 Favored 'General case' 0 C--N 1.403 2.905 0 CA-C-N 111.188 -2.733 . . . . 0.0 107.586 -158.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -168.77 -99.29 0.13 Allowed Glycine 0 C--N 1.377 2.859 0 CA-C-N 122.833 2.56 . . . . 0.0 109.961 155.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 17.7 t60 -55.78 116.9 13.34 Favored Pre-proline 0 C--N 1.386 2.194 0 CA-C-N 113.12 -1.54 . . . . 0.0 107.252 -156.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo . . . . . 0 CA--C 1.593 3.459 0 C-N-CA 121.736 1.624 . . . . 0.0 111.627 179.746 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.638 0 O5'-C5'-C4' 114.322 2.944 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.834 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.635 0 O4'-C4'-C3' 108.159 2.559 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.834 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.569 4.12 1 P-O3'-C3' 130.652 9.127 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.56 ' C8 ' H2'' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.562 3.363 1 P-O3'-C3' 134.433 12.277 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.515 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.806 0 P-O3'-C3' 123.712 3.344 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.515 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.567 3.918 0 N19-C1'-C2' 118.893 2.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 1.076 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.659 0 O4'-C4'-C3' 108.484 2.884 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 1.076 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.442 0 C4'-C3'-C2' 99.719 -3.481 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.729 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.669 0 C4'-C3'-C2' 99.849 -3.351 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.627 ' H71' ' C8 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.842 1 P-O3'-C3' 125.255 4.629 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.521 H2'' ' C8 ' ' A' ' 12' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.345 0 P-O3'-C3' 122.863 2.636 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . 0.524 H2'' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.332 0 P-O3'-C3' 122.786 2.572 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.624 ' C5 ' ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.525 0 O4'-C4'-C3' 108.293 2.693 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.816 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.597 0 O4'-C4'-C3' 108.369 2.769 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.816 H5'' H2'' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.92 0 O4'-C1'-N19 110.969 3.962 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.815 ' H72' ' C8 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.547 0 P-O3'-C3' 124.452 3.96 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.676 0 O5'-C5'-C4' 115.031 3.451 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.46 H2'' ' C8 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.884 1 P-O3'-C3' 126.486 5.655 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.46 ' C8 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.562 3.419 0 P-O3'-C3' 122.738 2.531 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.517 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.365 0 O4'-C4'-C3' 107.972 2.372 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.867 H2'' H5'' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.572 4.416 0 O4'-C1'-N19 105.093 -3.384 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.867 H5'' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.561 4.28 1 P-O3'-C3' 127.538 6.531 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.592 ' OP2' ' HD1' ' P' ' 162' ' ' TYR . . . . . . . . 0 C5'--C4' 1.538 3.361 0 P-O3'-C3' 123.654 3.295 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.789 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.602 0 O4'-C4'-C3' 108.569 2.969 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.789 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.569 4.116 0 P-O3'-C3' 123.499 3.166 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.523 " C2'" ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.22 0 N19-C1'-C2' 119.354 3.221 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.545 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.649 0 P-O3'-C3' 123.506 3.172 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.545 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.452 0 C4'-C3'-C2' 100.716 -2.484 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.402 ' O2 ' ' N2 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.568 4.009 0 P-O3'-C3' 123.232 2.943 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.601 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.318 0 O4'-C4'-C3' 107.921 2.321 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.601 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.478 0 O4'-C4'-C3' 108.611 3.011 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.852 0 O4'-C1'-N19 109.364 1.955 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.487 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 2.9 p -132.68 162.06 32.36 Favored 'General case' 0 C--N 1.382 2.018 0 CA-C-N 113.675 -1.602 . . . . 0.0 108.653 -174.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 170.27 -38.37 0.0 OUTLIER 'General case' 0 C--N 1.388 2.272 0 CA-C-N 113.542 -1.663 . . . . 0.0 107.976 -171.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -174.09 -143.07 4.2 Favored Glycine 0 C--N 1.381 3.04 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -162.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.794 HD12 ' HD2' ' P' ' 106' ' ' PRO . 0.0 OUTLIER -131.5 174.8 4.27 Favored Pre-proline 0 CA--C 1.582 2.203 0 CA-C-N 113.69 -1.255 . . . . 0.0 108.738 175.328 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.794 ' HD2' HD12 ' P' ' 105' ' ' LEU . 59.1 Cg_exo -48.04 92.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.126 0 C-N-CA 122.986 2.457 . . . . 0.0 110.322 155.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.53 167.52 12.3 Favored 'General case' 0 C--N 1.382 1.981 0 CA-C-O 122.424 1.107 . . . . 0.0 109.13 158.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.595 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -154.6 -48.12 0.09 Allowed 'General case' 0 C--N 1.383 2.031 0 CA-C-N 113.78 -1.554 . . . . 0.0 108.164 -166.666 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.534 ' C ' ' HD3' ' P' ' 110' ' ' ARG . 2.2 tptt -86.68 161.32 18.51 Favored 'General case' 0 C--N 1.379 1.891 0 CA-C-N 113.76 -1.564 . . . . 0.0 109.434 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.595 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.0 OUTLIER -143.43 108.04 4.85 Favored 'General case' 0 C--N 1.382 2.008 0 CA-C-N 113.72 -1.582 . . . . 0.0 108.656 -163.246 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.576 ' HG2' ' O ' ' P' ' 111' ' ' LYS . 0.1 OUTLIER -103.45 97.86 7.84 Favored 'General case' 0 C--N 1.381 1.957 0 CA-C-N 113.651 -1.613 . . . . 0.0 107.771 166.276 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 68.0 mtt85 -52.93 162.78 0.57 Allowed 'General case' 0 C--N 1.384 2.107 0 CA-C-N 113.25 -1.795 . . . . 0.0 108.664 155.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.978 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.6 OUTLIER -84.96 116.47 23.39 Favored 'General case' 0 C--N 1.384 2.104 0 CA-C-N 113.779 -1.555 . . . . 0.0 107.014 161.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.403 HG22 ' OP1' ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -103.4 67.39 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.171 0 CA-C-O 125.555 2.597 . . . . 0.0 107.975 -161.709 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.978 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.08 108.44 8.99 Favored 'General case' 0 C--N 1.391 2.387 0 CA-C-N 111.534 -2.575 . . . . 0.0 109.378 -158.824 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.632 ' HD1' HD23 ' P' ' 148' ' ' LEU . 0.6 OUTLIER -76.57 144.98 39.29 Favored 'General case' 0 C--N 1.391 2.384 0 CA-C-N 112.593 -2.094 . . . . 0.0 107.8 -171.996 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.93 148.97 50.53 Favored 'General case' 0 C--N 1.383 2.024 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 -171.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' P' ' 122' ' ' TYR . 19.8 ttmt -33.21 -50.07 0.28 Allowed 'General case' 0 C--N 1.383 2.063 0 O-C-N 126.883 2.614 . . . . 0.0 108.268 174.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.66 -58.11 5.92 Favored 'General case' 0 C--N 1.385 2.109 0 CA-C-N 111.424 -2.625 . . . . 0.0 109.165 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.573 ' O ' HD13 ' P' ' 124' ' ' LEU . 81.7 mt-30 -59.83 -46.57 88.83 Favored 'General case' 0 C--N 1.381 1.969 0 CA-C-N 112.434 -2.166 . . . . 0.0 109.464 -178.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.467 ' HA ' HD13 ' P' ' 124' ' ' LEU . 3.3 m -47.64 -57.6 5.29 Favored 'General case' 0 C--N 1.386 2.155 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 166.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.669 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.34 -48.52 68.44 Favored 'General case' 0 C--N 1.382 1.997 0 CA-C-O 122.587 1.184 . . . . 0.0 109.904 -167.573 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.885 ' CG ' HG23 ' P' ' 146' ' ' ILE . 0.6 OUTLIER -66.2 -37.95 86.79 Favored 'General case' 0 C--N 1.378 1.83 0 CA-C-N 114.032 -1.44 . . . . 0.0 107.856 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.974 HD21 ' HB3' ' P' ' 156' ' ' TRP . 2.0 mt -60.7 -50.88 71.69 Favored 'General case' 0 C--N 1.384 2.105 0 O-C-N 120.52 -1.362 . . . . 0.0 109.604 171.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.573 ' O ' ' N ' ' P' ' 129' ' ' ARG . 9.3 mt-10 -55.47 -50.18 70.57 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-O 122.418 1.104 . . . . 0.0 109.48 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.669 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.65 -69.79 0.12 Allowed 'General case' 0 C--N 1.378 1.845 0 CA-C-N 111.872 -2.422 . . . . 0.0 108.719 176.211 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.871 ' HD3' HD12 ' P' ' 134' ' ' LEU . 0.5 OUTLIER -59.31 -36.0 74.83 Favored 'General case' 0 C--N 1.391 2.373 0 CA-C-N 112.778 -2.01 . . . . 0.0 108.343 -171.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.835 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 25.7 t80 -70.31 -46.92 63.27 Favored 'General case' 0 C--N 1.381 1.966 0 CA-C-N 119.148 0.886 . . . . 0.0 110.338 178.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.573 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.5 mmp_? -62.51 -15.95 53.15 Favored 'General case' 0 C--N 1.381 1.937 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -168.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -104.51 -39.44 6.41 Favored 'General case' 0 C--N 1.379 1.878 0 C-N-CA 126.592 1.957 . . . . 0.0 107.383 -169.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.494 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -156.21 98.71 1.88 Allowed 'General case' 0 C--N 1.388 2.24 0 CA-C-N 111.759 -2.473 . . . . 0.0 109.223 -153.5 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . 0.519 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 0.4 OUTLIER -77.32 -11.79 59.88 Favored 'General case' 0 C--N 1.388 2.257 0 CA-C-N 111.784 -2.462 . . . . 0.0 110.466 -164.845 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.732 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 3.4 m-30 -154.12 110.81 3.34 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.362 -162.161 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.871 HD12 ' HD3' ' P' ' 127' ' ' ARG . 19.5 mt -121.33 140.01 52.66 Favored 'General case' 0 C--N 1.396 2.63 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -162.413 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.46 160.56 23.95 Favored 'General case' 0 C--N 1.382 1.983 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 164.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.576 ' HB1' ' HD3' ' P' ' 137' ' ' PRO . . . -58.35 -51.63 80.42 Favored Pre-proline 0 CA--C 1.585 2.312 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -166.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.576 ' HD3' ' HB1' ' P' ' 136' ' ' ALA . 71.4 Cg_exo -58.16 -29.99 89.1 Favored 'Trans proline' 0 C--N 1.399 3.229 0 N-CA-C 115.387 1.264 . . . . 0.0 115.387 -172.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.682 ' CG ' HD21 ' P' ' 134' ' ' LEU . 15.7 mp0 -58.72 -66.18 0.54 Allowed 'General case' 0 C--N 1.381 1.942 0 CA-C-O 124.866 2.27 . . . . 0.0 105.468 163.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.748 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -67.64 -41.66 83.53 Favored 'General case' 0 C--N 1.391 2.382 0 CA-C-N 109.659 -3.428 . . . . 0.0 108.71 -153.797 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.579 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 0.7 OUTLIER -53.19 -38.05 62.49 Favored 'General case' 0 C--N 1.381 1.94 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.915 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -65.39 -39.08 91.78 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.226 -1.807 . . . . 0.0 109.051 -172.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.621 HD12 ' HB2' ' P' ' 123' ' ' GLU . 0.5 OUTLIER -55.57 -46.21 77.23 Favored 'General case' 0 C--N 1.387 2.212 0 CA-C-O 123.256 1.503 . . . . 0.0 108.515 167.447 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.652 ' HB1' ' HA ' ' P' ' 150' ' ' PRO . . . -63.44 -35.69 81.27 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 111.738 -2.483 . . . . 0.0 108.967 -178.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.579 ' N ' ' O ' ' P' ' 140' ' ' GLU . 4.0 m -73.37 -37.6 65.98 Favored 'General case' 0 C--N 1.387 2.217 0 CA-C-N 114.087 -1.415 . . . . 0.0 109.651 -176.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 37.7 mt -67.3 -49.05 65.77 Favored 'General case' 0 C--N 1.382 1.995 0 CA-C-O 124.492 2.092 . . . . 0.0 108.694 -167.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 1.009 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.43 -13.54 8.21 Favored 'Isoleucine or valine' 0 C--N 1.389 2.308 0 CA-C-N 110.943 -2.844 . . . . 0.0 108.031 -167.649 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' P' ' 147' ' ' ARG . 0.0 OUTLIER 82.41 35.62 0.07 Allowed 'General case' 0 C--N 1.382 2.019 0 CA-C-O 125.853 2.74 . . . . 0.0 107.668 153.549 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 1.009 HD13 ' CD1' ' P' ' 146' ' ' ILE . 7.6 mt -95.95 172.44 8.01 Favored 'General case' 0 C--N 1.396 2.63 0 CA-C-N 111.472 -2.604 . . . . 0.0 109.352 166.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.565 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -89.09 143.59 31.4 Favored Pre-proline 0 CA--C 1.586 2.333 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 167.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.652 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 72.4 Cg_exo -51.4 -46.05 33.76 Favored 'Trans proline' 0 C--N 1.408 3.689 0 C-N-CA 124.252 3.301 . . . . 0.0 114.673 -165.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 151' ' ' THR . . . . . 0.404 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.2 OUTLIER -52.71 -33.69 48.92 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-N 112.163 -2.29 . . . . 0.0 109.507 170.247 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.565 ' N ' ' O ' ' P' ' 149' ' ' THR . 48.1 mt-30 -72.5 -28.27 62.77 Favored 'General case' 0 C--N 1.392 2.43 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.766 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.2 t -64.61 -71.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.026 0 CA-C-N 121.798 2.09 . . . . 0.0 109.814 163.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.748 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.23 -57.78 0.4 Allowed 'General case' 0 C--N 1.388 2.254 0 C-N-CA 124.466 1.106 . . . . 0.0 110.364 -177.581 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.512 HG22 " H5'" ' A' ' 8' ' ' ' DA' . 9.9 mm -59.89 -40.22 82.21 Favored 'Isoleucine or valine' 0 C--N 1.382 1.995 0 CA-C-N 113.311 -1.768 . . . . 0.0 109.47 -173.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.974 ' HB3' HD21 ' P' ' 124' ' ' LEU . 6.3 t90 -67.45 -31.33 71.43 Favored 'General case' 0 C--N 1.381 1.965 0 O-C-N 121.182 -0.949 . . . . 0.0 109.231 172.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.835 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 66.3 m-85 -74.65 -40.19 61.61 Favored 'General case' 0 C--O 1.273 2.34 0 O-C-N 121.526 -0.734 . . . . 0.0 111.956 173.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.462 ' OE1' HD12 ' P' ' 155' ' ' ILE . 23.8 mt-30 -49.86 -63.62 1.06 Allowed 'General case' 0 C--N 1.378 1.823 0 O-C-N 119.47 -2.018 . . . . 0.0 106.821 167.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -56.7 -19.29 15.84 Favored 'General case' 0 C--N 1.388 2.28 0 CA-C-O 117.907 -1.044 . . . . 0.0 110.446 -164.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.554 ' CE1' HG23 ' P' ' 164' ' ' THR . 14.7 t-80 -76.48 -52.51 9.67 Favored 'General case' 0 C--O 1.279 2.639 0 CA-C-N 120.743 1.61 . . . . 0.0 111.084 171.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.732 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -66.52 -36.31 82.39 Favored 'General case' 0 C--O 1.266 1.921 0 CA-C-N 122.535 2.425 . . . . 0.0 111.06 -158.726 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.592 ' HD1' ' OP2' ' B' ' 23' ' ' ' DA' . 21.9 t80 -68.51 -36.15 78.49 Favored 'General case' 0 C--N 1.38 1.934 0 O-C-N 120.022 -1.674 . . . . 0.0 109.381 174.161 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -65.75 -42.92 90.35 Favored 'General case' 0 C--N 1.381 1.957 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -170.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.582 ' O ' ' HB1' ' P' ' 167' ' ' ALA . 0.5 OUTLIER -57.09 -60.34 3.75 Favored 'General case' 0 C--N 1.379 1.87 0 CA-C-O 124.534 2.112 . . . . 0.0 106.7 -170.142 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . . . . . . . . . 9.1 mmmt -59.45 -49.61 77.12 Favored 'General case' 0 C--N 1.385 2.121 0 CA-C-N 108.499 -3.955 . . . . 0.0 109.256 -165.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . 0.504 ' HB2' ' CE1' ' P' ' 162' ' ' TYR . 0.0 OUTLIER -58.77 -29.26 66.65 Favored 'General case' 0 C--N 1.382 2.007 0 CA-C-N 112.221 -2.263 . . . . 0.0 108.152 -178.749 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . 0.582 ' HB1' ' O ' ' P' ' 164' ' ' THR . . . -67.6 -35.88 79.8 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.079 -176.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.68 -19.86 44.25 Favored 'General case' 0 C--N 1.387 2.224 0 CA-C-N 112.208 -2.269 . . . . 0.0 109.204 -173.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.1 -32.78 71.3 Favored 'General case' 0 C--N 1.382 1.98 0 CA-C-O 122.717 1.246 . . . . 0.0 108.799 169.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -64.09 -35.85 82.1 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.88 -169.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -96.19 93.16 6.76 Favored 'General case' 0 C--N 1.381 1.961 0 CA-C-N 113.638 -1.619 . . . . 0.0 109.388 -162.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 121.05 -49.15 0.9 Allowed Glycine 0 C--N 1.382 3.119 0 N-CA-C 108.737 -1.745 . . . . 0.0 108.737 -161.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 119.04 172.77 0.0 OUTLIER 'General case' 0 C--N 1.382 2.004 0 CA-C-N 113.011 -1.594 . . . . 0.0 108.834 161.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -82.84 67.76 9.04 Favored 'General case' 0 C--N 1.38 1.929 0 CA-C-N 112.343 -2.208 . . . . 0.0 109.015 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 80.08 135.46 1.4 Allowed Glycine 0 C--N 1.384 3.223 0 O-C-N 120.065 -1.647 . . . . 0.0 109.954 155.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 44.4 p-80 -128.55 141.93 43.14 Favored Pre-proline 0 C--N 1.385 2.133 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 -165.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo . . . . . 0 CA--C 1.594 3.496 0 C-N-CA 121.518 1.479 . . . . 0.0 111.535 174.582 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.794 0 O5'-C5'-C4' 114.374 2.982 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.721 ' N1 ' ' N3 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.334 0 O4'-C4'-C3' 108.378 2.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.538 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.861 0 P-O3'-C3' 123.038 2.781 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.72 ' C8 ' ' H71' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.305 0 P-O3'-C3' 123.245 2.954 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.72 ' H71' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.838 0 N19-C1'-C2' 118.359 2.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.533 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.039 0 N19-C1'-C2' 118.729 2.831 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.927 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.552 1 P-O3'-C3' 124.861 4.301 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.927 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.448 0 C4'-C3'-C2' 100.233 -2.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.762 " C5'" H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.405 0 P-O3'-C3' 123.379 3.065 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.591 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.927 1 P-O3'-C3' 127.172 6.226 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.486 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.356 0 P-O3'-C3' 123.204 2.92 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . 0.516 H2'' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.354 0 P-O3'-C3' 122.704 2.503 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.912 ' C6 ' ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.561 0 O4'-C4'-C3' 108.418 2.818 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.912 ' H72' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.565 0 O4'-C4'-C3' 108.209 2.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.676 ' N9 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.926 1 O4'-C1'-N19 111.301 4.376 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.676 ' H72' ' N9 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.516 0 P-O3'-C3' 122.217 2.098 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.764 0 O5'-C5'-C4' 115.045 3.461 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.534 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.595 1 P-O3'-C3' 125.11 4.509 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.534 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.417 0 O4'-C4'-C3' 108.211 2.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.509 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.409 0 O4'-C4'-C3' 108.042 2.442 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.526 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.571 4.336 0 N19-C1'-C2' 119.289 3.181 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.526 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.555 3.714 1 P-O3'-C3' 126.925 6.021 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.486 ' C2 ' ' C2 ' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.528 1 P-O3'-C3' 128.413 7.261 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.686 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.477 0 O4'-C4'-C3' 108.228 2.628 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.686 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.802 0 O4'-C4'-C3' 107.992 2.392 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.631 ' C4 ' ' C2 ' ' B' ' 25' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.558 4.029 0 P-O3'-C3' 124.126 3.689 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.633 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.58 1 P-O3'-C3' 127.689 6.658 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.633 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.562 3.43 0 C4'-C3'-C2' 100.593 -2.607 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.617 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.922 0 O4'-C4'-C3' 108.602 3.002 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.598 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.366 1 P-O3'-C3' 127.822 6.768 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.721 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.587 0 O4'-C4'-C3' 108.218 2.618 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.933 0 O4'-C1'-N19 109.333 1.916 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.528 3.449 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 11.3 p -151.94 138.53 18.71 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 113.647 -1.615 . . . . 0.0 108.605 -170.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 170.64 -38.34 0.0 OUTLIER 'General case' 0 C--N 1.388 2.267 0 CA-C-N 113.531 -1.668 . . . . 0.0 108.037 172.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -121.48 66.77 0.45 Allowed Glycine 0 C--N 1.381 3.073 0 N-CA-C 108.914 -1.674 . . . . 0.0 108.914 -162.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.845 HD23 ' HD3' ' P' ' 106' ' ' PRO . 0.3 OUTLIER -173.84 172.29 1.43 Allowed Pre-proline 0 CA--C 1.583 2.231 0 CA-C-N 113.71 -1.245 . . . . 0.0 108.861 170.078 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.845 ' HD3' HD23 ' P' ' 105' ' ' LEU . 2.4 Cg_endo -83.49 73.06 5.31 Favored 'Trans proline' 0 C--N 1.395 3.008 0 C-N-CA 124.817 3.678 . . . . 0.0 111.2 -153.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 70.51 155.19 0.14 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-N 114.678 -1.147 . . . . 0.0 109.191 -170.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.419 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -117.88 68.04 0.76 Allowed 'General case' 0 C--N 1.382 2.01 0 CA-C-N 113.692 -1.594 . . . . 0.0 108.135 175.657 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.609 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 11.4 tttt -65.93 150.51 48.51 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-N 113.685 -1.598 . . . . 0.0 109.92 -171.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.609 ' HD3' ' O ' ' P' ' 109' ' ' LYS . 2.0 mmt85 -144.57 67.88 1.25 Allowed 'General case' 0 C--N 1.384 2.099 0 CA-C-N 113.666 -1.606 . . . . 0.0 109.555 -170.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.918 ' HD2' " H1'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -80.5 87.86 5.68 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-O 123.587 1.66 . . . . 0.0 108.073 163.365 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -81.32 -175.93 5.73 Favored 'General case' 0 C--N 1.39 2.361 0 CA-C-N 111.789 -2.46 . . . . 0.0 108.814 159.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 1.16 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.0 OUTLIER -76.07 108.01 8.67 Favored 'General case' 0 C--N 1.389 2.319 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 156.021 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.856 HG13 " H5'" ' A' ' 7' ' ' ' DA' . 0.8 OUTLIER -96.73 42.37 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.384 2.074 0 CA-C-O 126.649 3.119 . . . . 0.0 109.234 -159.072 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 1.16 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.1 OUTLIER -79.69 118.28 21.37 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 111.891 -2.413 . . . . 0.0 109.651 -155.52 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.638 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 3.2 m-85 -93.37 143.57 26.15 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-N 113.754 -1.566 . . . . 0.0 107.986 -173.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.24 148.11 52.32 Favored 'General case' 0 C--N 1.383 2.035 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 -171.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -42.71 -36.09 1.33 Allowed 'General case' 0 C--N 1.382 2.003 0 CA-C-N 113.923 -1.489 . . . . 0.0 109.446 -177.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.87 -67.8 0.23 Allowed 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.148 -1.842 . . . . 0.0 109.161 173.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.538 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 80.2 mt-30 -49.9 -50.77 44.83 Favored 'General case' 0 C--N 1.382 1.986 0 CA-C-N 112.437 -2.165 . . . . 0.0 109.399 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.666 ' HA ' HD13 ' P' ' 124' ' ' LEU . 21.5 m -49.75 -56.86 8.68 Favored 'General case' 0 C--N 1.382 1.994 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 170.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.544 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 1.0 OUTLIER -53.23 -45.51 68.74 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 122.29 1.043 . . . . 0.0 109.74 -170.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 1.034 ' CD ' HG23 ' P' ' 146' ' ' ILE . 6.9 mt-10 -66.9 -38.56 86.48 Favored 'General case' 0 C--N 1.379 1.853 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.607 178.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.948 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.4 mt -60.71 -50.01 75.22 Favored 'General case' 0 C--N 1.382 2.005 0 O-C-N 119.62 -1.925 . . . . 0.0 109.9 171.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' P' ' 129' ' ' ARG . 20.1 mt-10 -55.75 -52.18 64.8 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-O 122.613 1.197 . . . . 0.0 109.55 177.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.544 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.38 -60.18 1.15 Allowed 'General case' 0 C--N 1.38 1.898 0 CA-C-N 112.128 -2.305 . . . . 0.0 109.362 176.032 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.835 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -70.5 -32.04 69.38 Favored 'General case' 0 C--N 1.397 2.638 0 CA-C-N 112.274 -2.239 . . . . 0.0 108.343 -167.097 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.764 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.3 t80 -67.94 -53.04 29.36 Favored 'General case' 0 C--N 1.384 2.072 0 CA-C-O 121.832 0.825 . . . . 0.0 109.397 170.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' P' ' 125' ' ' GLU . 19.6 mmm180 -62.72 -17.77 61.35 Favored 'General case' 0 C--N 1.379 1.888 0 CA-C-N 113.213 -1.812 . . . . 0.0 108.239 -163.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -88.22 -51.68 5.63 Favored 'General case' 0 C--N 1.379 1.882 0 CA-C-O 123.811 1.767 . . . . 0.0 106.482 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.31 125.5 4.43 Favored 'General case' 0 C--N 1.394 2.522 0 CA-C-N 112.19 -2.277 . . . . 0.0 110.843 -168.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . 0.691 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 3.7 ptt-85 -80.02 -6.52 57.74 Favored 'General case' 0 C--N 1.393 2.47 0 CA-C-N 111.774 -2.467 . . . . 0.0 111.318 -160.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.818 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 3.0 m-30 -148.27 115.01 6.03 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 125.297 2.475 . . . . 0.0 109.768 -161.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.587 HD21 ' HG3' ' P' ' 138' ' ' GLU . 67.2 mt -125.3 133.91 52.45 Favored 'General case' 0 C--N 1.415 3.425 0 O-C-N 119.851 -1.781 . . . . 0.0 108.826 -162.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.33 158.2 21.24 Favored 'General case' 0 C--N 1.381 1.978 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 168.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.596 ' HB2' ' HD3' ' P' ' 137' ' ' PRO . . . -59.15 -50.36 88.17 Favored Pre-proline 0 CA--C 1.584 2.285 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -161.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 77.7 Cg_exo -58.66 -28.86 87.61 Favored 'Trans proline' 0 C--N 1.401 3.338 0 N-CA-C 115.185 1.186 . . . . 0.0 115.185 -175.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.587 ' HG3' HD21 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -53.45 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.379 1.864 0 CA-C-O 124.295 1.997 . . . . 0.0 106.483 159.895 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 1.023 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.51 -34.87 74.93 Favored 'General case' 0 C--N 1.387 2.226 0 CA-C-N 109.919 -3.31 . . . . 0.0 109.159 -155.124 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.624 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 2.7 mt-10 -52.42 -42.94 64.52 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-O 123.493 1.616 . . . . 0.0 108.137 175.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -64.76 -35.67 81.82 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 112.501 -2.136 . . . . 0.0 108.97 -169.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.835 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.1 tp -65.91 -43.03 89.36 Favored 'General case' 0 C--N 1.382 1.998 0 CA-C-O 123.201 1.477 . . . . 0.0 109.163 168.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.624 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -55.34 -35.82 65.62 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.036 174.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.581 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.7 OUTLIER -72.43 -43.17 64.2 Favored 'General case' 0 C--N 1.389 2.29 0 CA-C-N 113.762 -1.563 . . . . 0.0 110.407 -178.113 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 81.3 mt -66.11 -44.87 83.05 Favored 'General case' 0 C--N 1.379 1.89 0 CA-C-O 124.838 2.256 . . . . 0.0 108.301 -164.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 1.034 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -98.83 -13.42 8.09 Favored 'Isoleucine or valine' 0 C--N 1.39 2.344 0 CA-C-N 110.905 -2.861 . . . . 0.0 108.064 -166.249 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 81.8 34.98 0.08 Allowed 'General case' 0 C--N 1.381 1.975 0 CA-C-O 125.586 2.612 . . . . 0.0 107.946 153.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.977 HD13 ' CD1' ' P' ' 146' ' ' ILE . 8.6 mt -95.63 172.36 8.1 Favored 'General case' 0 C--N 1.396 2.593 0 CA-C-N 111.47 -2.605 . . . . 0.0 109.078 167.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.586 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.1 p -91.27 141.53 26.29 Favored Pre-proline 0 CA--C 1.589 2.454 0 CA-C-O 122.795 1.283 . . . . 0.0 108.264 166.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.602 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 0.3 OUTLIER -48.21 -46.99 20.94 Favored 'Trans proline' 0 C--N 1.403 3.429 0 C-N-CA 124.934 3.756 . . . . 0.0 115.404 -167.289 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 151' ' ' THR . . . . . 0.541 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -52.85 -30.55 34.39 Favored 'General case' 0 C--N 1.383 2.065 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.112 169.278 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.586 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.3 mt-30 -73.87 -30.58 62.72 Favored 'General case' 0 C--N 1.391 2.401 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 179.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.739 HG11 ' CD2' ' P' ' 157' ' ' PHE . 0.9 OUTLIER -64.07 -67.05 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.382 2.018 0 CA-C-N 122.011 2.187 . . . . 0.0 109.743 165.803 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 1.023 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -32.93 -60.08 0.33 Allowed 'General case' 0 C--N 1.387 2.201 0 C-N-CA 124.615 1.166 . . . . 0.0 110.845 -177.254 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.697 HG22 " C5'" ' A' ' 8' ' ' ' DA' . 37.5 mm -64.78 -34.94 73.5 Favored 'Isoleucine or valine' 0 C--N 1.382 2.01 0 CA-C-N 112.794 -2.003 . . . . 0.0 108.756 -169.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.948 ' HB3' HD21 ' P' ' 124' ' ' LEU . 6.1 t90 -67.47 -33.07 74.37 Favored 'General case' 0 C--N 1.384 2.109 0 O-C-N 121.691 -0.631 . . . . 0.0 109.353 168.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.764 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 39.2 m-85 -74.89 -41.71 59.24 Favored 'General case' 0 C--O 1.272 2.272 0 O-C-N 120.966 -1.084 . . . . 0.0 111.94 174.599 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' P' ' 154' ' ' LYS . 77.3 mt-30 -50.98 -59.8 3.77 Favored 'General case' 0 C--N 1.377 1.77 0 O-C-N 119.785 -1.822 . . . . 0.0 106.703 170.016 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -56.5 -20.28 19.57 Favored 'General case' 0 C--N 1.389 2.314 0 CA-C-O 117.409 -1.281 . . . . 0.0 110.333 -168.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.554 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.5 OUTLIER -76.39 -50.35 14.42 Favored 'General case' 0 C--O 1.282 2.816 0 CA-C-N 121.2 1.818 . . . . 0.0 110.313 174.666 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.818 ' HD3' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -67.5 -34.13 76.5 Favored 'General case' 0 C--O 1.267 2.019 0 CA-C-N 122.784 2.538 . . . . 0.0 111.166 -158.431 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -69.02 -40.21 78.79 Favored 'General case' 0 C--N 1.381 1.935 0 O-C-N 119.89 -1.756 . . . . 0.0 109.104 171.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -37.98 89.41 Favored 'General case' 0 C--N 1.382 1.997 0 O-C-N 121.322 -0.862 . . . . 0.0 109.016 -166.051 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.653 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -51.59 -61.74 2.06 Favored 'General case' 0 C--N 1.379 1.86 0 CA-C-O 124.699 2.19 . . . . 0.0 106.729 -175.715 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.488 ' HG2' HG21 ' P' ' 164' ' ' THR . 6.0 mmmt -59.15 -47.62 84.61 Favored 'General case' 0 C--N 1.385 2.143 1 CA-C-N 108.361 -4.018 . . . . 0.0 108.085 -159.322 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -54.67 -42.55 71.51 Favored 'General case' 0 C--N 1.381 1.938 0 CA-C-N 112.475 -2.148 . . . . 0.0 109.336 -178.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.41 -30.66 71.75 Favored 'General case' 0 C--N 1.384 2.068 0 CA-C-O 124.464 2.078 . . . . 0.0 109.322 -175.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.81 -21.91 31.97 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.344 -2.207 . . . . 0.0 110.074 -176.395 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -52.93 -32.53 46.17 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-O 123.944 1.831 . . . . 0.0 109.94 167.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -78.97 -33.68 44.94 Favored 'General case' 0 C--N 1.381 1.939 0 CA-C-N 112.141 -2.3 . . . . 0.0 107.466 -155.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.31 87.37 0.83 Allowed 'General case' 0 C--N 1.382 1.984 0 CA-C-N 113.506 -1.679 . . . . 0.0 108.916 -160.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . 0.463 ' C ' ' CG ' ' P' ' 173' ' ' TYR . . . 110.14 -93.2 0.73 Allowed Glycine 0 C--N 1.382 3.094 0 N-CA-C 108.607 -1.797 . . . . 0.0 108.607 -154.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . 0.463 ' CG ' ' C ' ' P' ' 172' ' ' GLY . 0.0 OUTLIER 176.89 144.1 0.09 Allowed 'General case' 0 C--N 1.382 2.001 0 CA-C-N 113.464 -1.368 . . . . 0.0 109.289 -177.555 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -166.29 157.96 13.57 Favored 'General case' 0 C--N 1.386 2.163 0 CA-C-N 113.282 -1.781 . . . . 0.0 107.299 155.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 122.47 -98.51 0.63 Allowed Glycine 0 C--N 1.381 3.051 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 -154.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.99 160.63 0.47 Allowed Pre-proline 0 CA--C 1.58 2.12 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 178.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_exo . . . . . 0 CA--C 1.594 3.516 0 C-N-CA 121.512 1.475 . . . . 0.0 111.59 175.444 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . 0.767 ' H73' ' O6 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.561 3.328 0 O5'-C5'-C4' 115.303 3.645 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.767 ' O6 ' ' H73' ' A' ' 1' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.546 4.426 0 O5'-C5'-C4' 115.434 3.739 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.645 ' H72' " C2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.568 4.04 0 O5'-C5'-C4' 114.508 3.077 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.638 ' N2 ' ' O2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.548 4.644 0 O5'-C5'-C4' 115.157 3.54 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.444 H2'' ' C6 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.543 4.056 0 P-O3'-C3' 123.878 3.482 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.579 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.543 3.994 0 C3'-C2'-C1' 107.278 3.27 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.579 ' C6 ' ' C5 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 2 C5'--C4' 1.547 4.456 0 P-O3'-C3' 123.918 3.515 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.819 " H4'" ' HD2' ' P' ' 111' ' ' LYS . . . . . . . . 1 C5'--C4' 1.55 4.826 1 P-O3'-C3' 124.768 4.223 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.597 ' C2 ' ' C2 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.549 4.743 0 O5'-C5'-C4' 115.734 3.953 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.597 ' C2 ' ' C2 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 2 C5'--C4' 1.544 4.066 0 P-O3'-C3' 123.622 3.268 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.509 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.549 4.794 2 P-O3'-C3' 129.151 7.876 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.547 4.544 0 O5'-C5'-C4' 115.441 3.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.501 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.546 4.39 0 O5'-C5'-C4' 114.5 3.071 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.501 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 2 C5'--C4' 1.545 4.246 0 C4'-C3'-C2' 100.322 -2.878 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.81 ' C5 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.554 5.317 1 O4'-C1'-N19 112.369 5.712 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.81 ' H72' ' C5 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.572 4.355 0 P-O3'-C3' 124.25 3.792 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . 0.441 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.807 1 O5'-C5'-C4' 115.875 4.054 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.538 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.547 4.5 0 O4'-C4'-C3' 108.66 3.06 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.538 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.547 4.521 0 O5'-C5'-C4' 114.74 3.243 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.515 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.547 4.512 0 O5'-C5'-C4' 115.379 3.699 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.651 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.57 4.163 0 O5'-C5'-C4' 115.444 3.746 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.651 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.547 4.463 0 O5'-C5'-C4' 114.417 3.012 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.596 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.546 4.392 0 O5'-C5'-C4' 115.289 3.635 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.783 ' C5 ' ' H73' ' B' ' 25' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.548 4.63 0 O5'-C5'-C4' 114.676 3.197 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.783 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.216 0 O5'-C5'-C4' 115.786 3.99 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.513 ' C4 ' ' C6 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.569 4.097 0 O5'-C5'-C4' 114.738 3.242 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.603 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.546 4.355 0 O5'-C5'-C4' 115.429 3.735 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.603 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.547 4.497 0 C4'-C3'-C2' 99.618 -3.582 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.638 ' O2 ' ' N2 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 2 C5'--C4' 1.546 4.431 0 P-O3'-C3' 123.637 3.28 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.565 ' N6 ' ' O4 ' ' A' ' 3' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.547 4.529 0 O5'-C5'-C4' 114.83 3.307 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.502 ' N3 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.547 4.542 0 O4'-C4'-C3' 108.657 3.057 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.371 0 O4'-C1'-N19 110.551 3.439 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.511 -0.555 0 CA-C-O 121.779 0.8 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.92 167.17 13.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.733 0.777 . . . . 0.0 110.957 -173.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 9.9 p30 168.36 -22.45 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.11 -171.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . 0.485 ' O ' HD12 ' P' ' 105' ' ' LEU . . . -88.9 -59.9 1.55 Allowed Glycine 0 N--CA 1.464 0.536 0 N-CA-C 110.83 -0.908 . . . . 0.0 110.83 171.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.485 HD12 ' O ' ' P' ' 104' ' ' GLY . 1.2 mm? -143.27 148.48 44.63 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-O 122.168 0.985 . . . . 0.0 111.06 -173.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -86.02 50.92 2.62 Favored 'Trans proline' 0 N--CA 1.526 3.44 1 C-N-CA 127.7 5.6 . . . . 0.0 115.26 178.197 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . 0.537 ' O ' ' HG3' ' P' ' 108' ' ' LYS . 0.0 OUTLIER 53.96 -169.38 0.06 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.836 0.827 . . . . 0.0 110.98 -179.558 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.813 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -158.31 36.91 0.24 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.676 0.751 . . . . 0.0 111.157 179.419 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.695 ' HG3' ' N ' ' P' ' 110' ' ' ARG . 3.5 tptm -67.72 160.85 27.25 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.667 0.746 . . . . 0.0 111.86 171.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.813 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.3 OUTLIER -129.97 -149.93 0.42 Allowed 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 122.333 1.063 . . . . 0.0 109.088 -171.733 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.819 ' HD2' " H4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -105.21 87.66 2.68 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.557 -177.047 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . 0.451 ' NH1' ' CD ' ' P' ' 109' ' ' LYS . 56.4 mtt85 -68.83 -158.33 0.02 OUTLIER 'General case' 0 C--O 1.245 0.852 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.175 169.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.972 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.1 OUTLIER -105.72 116.5 32.05 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.039 0.923 . . . . 0.0 110.396 170.148 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.434 HG21 ' P ' ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -97.85 82.46 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 122.725 1.25 . . . . 0.0 110.105 -175.608 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.972 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -88.74 112.42 23.14 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.663 -169.448 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.663 ' CD1' HD21 ' P' ' 148' ' ' LEU . 0.9 OUTLIER -78.92 150.85 32.0 Favored 'General case' 0 C--O 1.272 2.268 0 CA-C-O 118.215 -0.898 . . . . 0.0 109.71 -171.59 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -69.81 155.48 40.49 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 122.831 2.56 . . . . 0.0 110.006 -172.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . 0.513 ' HB2' ' HE3' ' P' ' 118' ' ' LYS . 0.2 OUTLIER -43.92 -37.12 2.71 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 122.329 1.062 . . . . 0.0 111.223 176.515 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.21 -58.31 9.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 122.953 1.359 . . . . 0.0 110.206 172.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.547 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 78.6 mt-30 -55.51 -47.9 75.5 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.775 177.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.575 ' HA ' HD11 ' P' ' 124' ' ' LEU . 3.2 m -53.03 -44.93 67.72 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.348 -0.845 . . . . 0.0 110.242 170.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.508 ' CE2' ' NH1' ' P' ' 126' ' ' ARG . 11.1 t80 -65.43 -40.24 93.07 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 121.714 -0.616 . . . . 0.0 111.088 -171.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.714 ' HB2' HG23 ' P' ' 146' ' ' ILE . 0.0 OUTLIER -71.46 -26.71 62.83 Favored 'General case' 0 C--O 1.265 1.878 0 O-C-N 120.83 -1.169 . . . . 0.0 111.303 169.606 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.697 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.4 mt -73.67 -40.65 63.53 Favored 'General case' 0 C--O 1.247 0.931 0 O-C-N 119.026 -2.296 . . . . 0.0 110.739 172.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -61.5 -45.68 93.2 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 123.152 1.453 . . . . 0.0 111.442 171.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.508 ' NH1' ' CE2' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -45.92 -65.1 0.59 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.941 172.451 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.844 ' HG3' HD12 ' P' ' 142' ' ' LEU . 0.7 OUTLIER -65.22 -31.32 72.43 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 118.652 -0.69 . . . . 0.0 109.911 -172.463 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.64 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 26.1 t80 -75.78 -44.69 40.17 Favored 'General case' 0 C--O 1.264 1.831 0 CA-C-N 120.685 1.584 . . . . 0.0 112.974 171.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . . . . . . . . . 5.8 mtp180 -67.23 -13.58 62.11 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 119.12 -2.237 . . . . 0.0 110.502 -173.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -106.0 -33.62 7.85 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 126.369 1.867 . . . . 0.0 111.559 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.524 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -151.8 108.58 3.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 123.862 1.791 . . . . 0.0 112.665 -167.762 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . 0.444 ' HB3' ' CE2' ' P' ' 133' ' ' TYR . 4.2 mtt85 -77.79 -9.14 58.87 Favored 'General case' 0 C--O 1.244 0.779 0 O-C-N 120.444 -1.41 . . . . 0.0 113.649 -171.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.444 ' CE2' ' HB3' ' P' ' 132' ' ' ARG . 98.2 m-85 -152.74 116.78 4.86 Favored 'General case' 0 C--O 1.26 1.647 0 C-N-CA 123.712 0.805 . . . . 0.0 109.765 -168.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.731 HD13 ' HD3' ' P' ' 127' ' ' ARG . 23.7 mt -123.11 143.34 50.05 Favored 'General case' 0 C--O 1.276 2.483 0 O-C-N 119.362 -2.086 . . . . 0.0 111.336 -166.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.58 162.7 19.71 Favored 'General case' 0 C--O 1.26 1.647 0 CA-C-N 124.492 3.315 . . . . 0.0 110.137 168.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.876 ' HB2' ' HD3' ' P' ' 137' ' ' PRO . . . -50.77 -60.49 5.38 Favored Pre-proline 0 C--O 1.253 1.274 0 O-C-N 119.974 -1.704 . . . . 0.0 111.585 -170.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.876 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 85.3 Cg_exo -50.67 -31.23 31.52 Favored 'Trans proline' 1 N--CA 1.538 4.128 1 C-N-CA 125.321 4.014 . . . . 0.0 115.57 -177.392 . . . . . . . . 4 3 . 1 . 017 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.673 ' HB3' HD21 ' P' ' 134' ' ' LEU . 2.3 mm-40 -65.54 -61.15 2.26 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 126.101 2.857 . . . . 0.0 108.638 167.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.665 ' NE ' ' HG3' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -74.99 -22.82 58.3 Favored 'General case' 0 C--O 1.276 2.464 0 CA-C-N 112.273 -2.24 . . . . 0.0 113.102 -166.582 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.651 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 3.5 mt-10 -68.78 -39.4 80.2 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 123.844 3.02 . . . . 0.0 111.297 169.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -59.99 -33.72 72.34 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.633 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.844 HD12 ' HG3' ' P' ' 127' ' ' ARG . 0.9 OUTLIER -68.85 -37.14 78.91 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.058 0.932 . . . . 0.0 109.552 169.954 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.651 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.68 -36.68 69.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.219 172.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 1.6 t -72.09 -42.54 66.04 Favored 'General case' 0 C--O 1.266 1.952 0 N-CA-C 113.971 1.101 . . . . 0.0 113.971 176.118 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . 0.6 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 87.1 mt -66.99 -46.0 75.91 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 125.586 2.612 . . . . 0.0 108.674 -168.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 1.08 HD13 HD11 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -94.13 -15.36 7.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-N 112.311 -2.222 . . . . 0.0 110.381 -175.499 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . 0.6 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.1 OUTLIER 76.75 43.65 0.13 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 123.844 1.783 . . . . 0.0 112.122 165.399 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 1.08 HD11 HD13 ' P' ' 146' ' ' ILE . 5.6 mt -103.7 164.91 11.37 Favored 'General case' 0 C--O 1.253 1.273 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.212 168.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.427 ' HB ' ' HD2' ' P' ' 150' ' ' PRO . 7.1 p -77.42 153.95 81.71 Favored Pre-proline 0 C--N 1.321 -0.662 0 O-C-N 120.452 -1.405 . . . . 0.0 109.263 169.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.437 ' HB2' ' NH1' ' P' ' 139' ' ' ARG . 9.0 Cg_endo -60.0 -45.14 25.48 Favored 'Trans proline' 0 N--CA 1.533 3.825 0 C-N-CA 124.418 3.412 . . . . 0.0 114.184 -171.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 1.1 m -60.48 -20.08 58.87 Favored 'General case' 0 C--O 1.27 2.18 0 CA-C-N 122.274 2.306 . . . . 0.0 112.61 166.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.526 ' HB3' ' CE1' ' P' ' 116' ' ' PHE . 40.2 mt-30 -74.35 -28.4 61.12 Favored 'General case' 0 C--O 1.276 2.452 0 CA-C-N 123.853 3.024 . . . . 0.0 108.442 169.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.561 ' O ' ' HD1' ' P' ' 157' ' ' PHE . 1.2 t -72.41 -63.17 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 CA-C-N 124.585 3.357 . . . . 0.0 111.465 168.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.665 ' HG3' ' NE ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -42.47 -50.04 5.24 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.13 0.972 . . . . 0.0 111.934 -179.51 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -56.67 -52.91 48.12 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 O-C-N 121.539 -0.726 . . . . 0.0 110.9 177.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.697 ' HB3' HD21 ' P' ' 124' ' ' LEU . 4.1 t90 -57.56 -29.98 64.86 Favored 'General case' 0 C--O 1.245 0.865 0 O-C-N 121.265 -0.897 . . . . 0.0 110.0 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.64 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 10.3 m-85 -76.71 -41.38 45.46 Favored 'General case' 0 C--O 1.288 3.113 0 O-C-N 120.227 -1.545 . . . . 0.0 112.999 171.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -51.5 -65.97 0.47 Allowed 'General case' 0 C--N 1.314 -0.957 0 O-C-N 116.624 -3.798 . . . . 0.0 110.863 165.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -58.38 -21.24 49.54 Favored 'General case' 0 C--O 1.276 2.463 0 CA-C-O 115.698 -2.096 . . . . 0.0 111.405 -171.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.676 ' CE1' ' CZ2' ' P' ' 156' ' ' TRP . 0.2 OUTLIER -73.25 -56.87 4.51 Favored 'General case' 0 C--O 1.28 2.696 0 CA-C-N 124.924 3.511 . . . . 0.0 112.93 169.929 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.473 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -62.12 -37.03 83.57 Favored 'General case' 0 C--O 1.27 2.182 0 O-C-N 117.962 -2.961 . . . . 0.0 113.651 -170.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -67.17 -31.65 72.21 Favored 'General case' 0 C--O 1.258 1.511 0 CA-C-N 123.167 2.712 . . . . 0.0 111.33 171.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -68.41 -37.67 80.53 Favored 'General case' 0 C--O 1.256 1.437 0 CA-C-N 121.12 1.782 . . . . 0.0 112.582 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.645 ' O ' ' HB2' ' P' ' 167' ' ' ALA . 0.5 OUTLIER -64.76 -48.97 72.59 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 124.519 2.104 . . . . 0.0 108.823 -172.31 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.505 ' HG2' HG21 ' P' ' 164' ' ' THR . 12.2 mmmt -70.79 -42.76 69.93 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 112.967 -1.924 . . . . 0.0 111.227 -169.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.88 -16.32 63.06 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 124.271 1.029 . . . . 0.0 110.72 170.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . 0.645 ' HB2' ' O ' ' P' ' 164' ' ' THR . . . -76.49 -33.87 58.66 Favored 'General case' 0 C--N 1.323 -0.573 0 O-C-N 121.16 -0.962 . . . . 0.0 111.815 171.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . 0.454 ' HG3' ' HA ' ' P' ' 165' ' ' LYS . 0.1 OUTLIER -80.65 -12.92 59.42 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.516 -179.096 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.2 -28.01 69.45 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 123.157 1.456 . . . . 0.0 109.604 166.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -23.04 50.42 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -170.111 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . 0.427 ' HG3' ' HA ' ' P' ' 168' ' ' GLN . 0.1 OUTLIER -70.89 -121.87 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 -171.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . 0.413 ' O ' ' CB ' ' P' ' 173' ' ' TYR . . . -22.54 -40.98 0.01 OUTLIER Glycine 0 C--N 1.314 -0.65 0 CA-C-O 121.913 0.729 . . . . 0.0 112.315 166.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . 0.413 ' CB ' ' O ' ' P' ' 172' ' ' GLY . 57.8 m-85 101.62 145.21 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 126.507 1.923 . . . . 0.0 110.615 166.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -163.31 171.89 15.46 Favored 'General case' 0 C--O 1.269 2.125 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.479 172.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 60.79 157.51 0.05 OUTLIER Glycine 0 N--CA 1.483 1.778 0 O-C-N 118.949 -2.345 . . . . 0.0 110.632 -169.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . 0.514 ' CG ' ' HD2' ' P' ' 177' ' ' PRO . 6.1 t60 -165.68 147.67 6.3 Favored Pre-proline 0 CA--C 1.51 -0.59 0 O-C-N 121.511 -0.993 . . . . 0.0 110.953 -171.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . 0.514 ' HD2' ' CG ' ' P' ' 176' ' ' HIS . 66.6 Cg_endo . . . . . 0 N--CA 1.527 3.497 1 C-N-CA 126.438 4.759 . . . . 0.0 114.315 176.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.565 3.689 0 O5'-C5'-C4' 114.384 2.989 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.82 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.403 0 P-O3'-C3' 124.116 3.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.82 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.948 0 P-O3'-C3' 122.926 2.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.641 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.524 0 P-O3'-C3' 123.668 3.307 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.522 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.738 0 N19-C1'-C2' 118.212 2.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.509 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.841 0 N19-C1'-C2' 120.174 3.734 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.936 H2'' " H5'" ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.738 1 P-O3'-C3' 125.263 4.636 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.936 " H5'" H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.604 0 P-O3'-C3' 124.395 3.913 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.617 ' C8 ' ' H71' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.409 0 O4'-C4'-C3' 108.161 2.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.617 ' H71' ' C8 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.862 0 P-O3'-C3' 122.854 2.628 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.518 ' C8 ' H2'' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.394 0 P-O3'-C3' 122.778 2.565 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . 0.453 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.537 3.293 0 P-O3'-C3' 122.472 2.31 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.504 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.552 0 O4'-C4'-C3' 108.433 2.833 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.727 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.688 0 C2'-C3'-O3' 116.627 2.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.727 H5'' H2'' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.89 1 O4'-C1'-N19 111.39 4.488 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.567 ' H72' ' C8 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.514 0 P-O3'-C3' 122.147 2.039 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . 0.422 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.751 0 O5'-C5'-C4' 115.008 3.434 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.5 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.006 0 O4'-C4'-C3' 108.128 2.528 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.5 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.418 0 O4'-C4'-C3' 108.211 2.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.37 0 O4'-C4'-C3' 108.266 2.666 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.555 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.57 4.197 0 N19-C1'-C2' 119.312 3.195 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.555 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.562 4.417 1 P-O3'-C3' 127.101 6.168 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.602 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.239 2 P-O3'-C3' 132.32 10.516 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.602 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.717 0 P-O3'-C3' 123.094 2.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.51 H2'' ' C6 ' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.746 0 O4'-C4'-C3' 108.604 3.004 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.52 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C3'--C2' 1.558 4.024 0 N19-C1'-C2' 118.88 2.925 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.54 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.599 0 P-O3'-C3' 123.631 3.276 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.629 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.399 0 C4'-C3'-C2' 100.891 -2.309 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.641 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 O4'-C4'-C3' 108.373 2.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.602 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.424 0 O4'-C4'-C3' 108.18 2.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.695 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.695 1 P-O3'-C3' 124.72 4.184 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . 0.437 " H5'" " H1'" ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.543 3.953 1 P-O3'-C3' 129.421 8.101 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.483 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -163.02 132.62 4.25 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.64 -1.618 . . . . 0.0 108.65 -178.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 169.37 23.29 0.0 OUTLIER 'General case' 0 C--N 1.395 2.58 0 CA-C-N 113.376 -1.738 . . . . 0.0 109.469 -174.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . 0.552 ' O ' HD22 ' P' ' 105' ' ' LEU . . . -171.05 -104.01 0.17 Allowed Glycine 0 C--N 1.379 2.966 0 N-CA-C 108.831 -1.708 . . . . 0.0 108.831 -161.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.924 HD11 ' HD2' ' P' ' 106' ' ' PRO . 0.1 OUTLIER -172.08 155.12 3.56 Favored Pre-proline 0 CA--C 1.581 2.142 0 CA-C-N 113.704 -1.248 . . . . 0.0 108.677 -174.872 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.924 ' HD2' HD11 ' P' ' 105' ' ' LEU . 65.7 Cg_exo -48.92 92.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.116 0 C-N-CA 122.94 2.427 . . . . 0.0 110.346 155.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -106.37 169.66 8.38 Favored 'General case' 0 C--N 1.381 1.975 0 CA-C-O 122.478 1.132 . . . . 0.0 109.098 158.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.401 ' C ' ' HD3' ' P' ' 110' ' ' ARG . 9.8 tttp -129.04 -54.33 1.2 Allowed 'General case' 0 C--N 1.382 2.01 0 CA-C-N 113.673 -1.603 . . . . 0.0 108.108 -163.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.447 ' C ' ' HD3' ' P' ' 110' ' ' ARG . 2.7 tttt -67.7 135.2 52.37 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 113.675 -1.602 . . . . 0.0 109.56 169.228 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.447 ' HD3' ' C ' ' P' ' 109' ' ' LYS . 1.6 mmt85 -135.1 61.4 1.67 Allowed 'General case' 0 C--N 1.385 2.139 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.218 -169.021 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.686 ' HD3' " O4'" ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -178.91 134.65 0.13 Allowed 'General case' 0 C--N 1.381 1.96 0 CA-C-N 114.487 -1.233 . . . . 0.0 108.02 155.121 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . 0.593 ' O ' ' HG3' ' P' ' 111' ' ' LYS . 2.4 mtp85 -91.81 170.32 9.98 Favored 'General case' 0 C--N 1.38 1.933 0 CA-C-N 114.803 -1.089 . . . . 0.0 108.488 153.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.966 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.4 OUTLIER -80.2 112.99 18.05 Favored 'General case' 0 C--N 1.387 2.203 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 155.256 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.35 63.04 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.186 0 CA-C-O 125.921 2.772 . . . . 0.0 107.675 -156.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.966 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -75.59 106.09 6.96 Favored 'General case' 0 C--N 1.394 2.53 0 CA-C-N 110.87 -2.877 . . . . 0.0 109.215 -155.727 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.607 ' HD1' HD23 ' P' ' 148' ' ' LEU . 0.7 OUTLIER -76.75 143.54 39.85 Favored 'General case' 0 C--N 1.391 2.405 0 CA-C-N 112.354 -2.203 . . . . 0.0 107.742 -169.323 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 117' ' ' THR . . . . . 0.404 ' O ' ' N ' ' P' ' 120' ' ' GLN . 1.3 p -65.25 150.03 48.93 Favored 'General case' 0 C--N 1.382 2.02 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 -168.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -45.06 -35.92 3.28 Favored 'General case' 0 C--N 1.382 1.98 0 CA-C-N 114.5 -1.227 . . . . 0.0 109.212 -178.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.2 -59.7 4.23 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-O 124.361 2.029 . . . . 0.0 109.49 174.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.545 ' HG2' ' HB ' ' P' ' 146' ' ' ILE . 79.6 mt-30 -60.24 -48.09 83.2 Favored 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.332 2.253 . . . . 0.0 109.949 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.523 ' HA ' HD13 ' P' ' 124' ' ' LEU . 4.2 m -47.47 -55.94 8.03 Favored 'General case' 0 C--N 1.385 2.139 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 167.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.568 ' HE2' ' CZ ' ' P' ' 126' ' ' ARG . 0.0 OUTLIER -52.85 -51.37 61.29 Favored 'General case' 0 C--N 1.38 1.912 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.023 -168.498 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.975 ' CD ' HG23 ' P' ' 146' ' ' ILE . 7.8 mt-10 -65.34 -36.37 83.81 Favored 'General case' 0 C--N 1.379 1.869 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.764 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.788 HD21 ' HB3' ' P' ' 156' ' ' TRP . 3.3 mt -60.01 -51.87 67.83 Favored 'General case' 0 C--N 1.383 2.062 0 O-C-N 120.885 -1.135 . . . . 0.0 109.735 170.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.574 ' O ' ' N ' ' P' ' 129' ' ' ARG . 19.1 mt-10 -55.89 -49.49 73.25 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-O 122.638 1.208 . . . . 0.0 109.738 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.568 ' CZ ' ' HE2' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -42.39 -70.41 0.11 Allowed 'General case' 0 C--N 1.378 1.826 0 CA-C-N 111.896 -2.411 . . . . 0.0 108.717 176.464 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.661 ' CG ' HD12 ' P' ' 142' ' ' LEU . 0.3 OUTLIER -58.7 -36.59 74.49 Favored 'General case' 0 C--N 1.393 2.484 0 CA-C-N 112.641 -2.072 . . . . 0.0 108.393 -171.179 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.821 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 25.9 t80 -70.42 -47.23 61.73 Favored 'General case' 0 C--N 1.38 1.924 0 CA-C-O 121.638 0.732 . . . . 0.0 110.346 179.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.574 ' N ' ' O ' ' P' ' 125' ' ' GLU . 0.0 OUTLIER -62.52 -20.62 64.82 Favored 'General case' 0 C--N 1.381 1.949 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -168.585 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -94.06 -44.15 8.17 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-O 123.886 1.803 . . . . 0.0 106.576 -169.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.31 127.34 5.62 Favored 'General case' 0 C--N 1.394 2.51 0 CA-C-N 112.005 -2.361 . . . . 0.0 109.957 -163.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.03 -20.14 49.7 Favored 'General case' 0 C--N 1.397 2.673 0 CA-C-N 111.366 -2.652 . . . . 0.0 110.616 -158.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.693 ' HD1' ' CZ ' ' P' ' 161' ' ' ARG . 18.0 m-85 -153.0 115.57 4.48 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-O 124.946 2.307 . . . . 0.0 109.094 -154.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.552 HD21 ' HG3' ' P' ' 138' ' ' GLU . 35.8 mt -113.27 139.41 48.84 Favored 'General case' 0 C--N 1.417 3.534 0 O-C-N 119.65 -1.906 . . . . 0.0 108.724 -166.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.25 154.52 29.12 Favored 'General case' 0 C--N 1.384 2.106 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 158.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.465 ' HA ' ' HG3' ' P' ' 139' ' ' ARG . . . -58.29 -42.94 97.46 Favored Pre-proline 0 CA--C 1.583 2.224 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.455 -162.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -48.28 -48.48 16.76 Favored 'Trans proline' 0 C--N 1.394 2.942 0 C-N-CA 121.706 1.604 . . . . 0.0 115.903 -178.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.552 ' HG3' HD21 ' P' ' 134' ' ' LEU . 5.0 mm-40 -52.85 -60.79 2.83 Favored 'General case' 0 C--N 1.394 2.506 0 CA-C-O 123.89 1.805 . . . . 0.0 106.183 175.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.62 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -70.03 -33.58 72.16 Favored 'General case' 0 C--O 1.27 2.171 0 CA-C-N 109.662 -3.426 . . . . 0.0 109.494 -161.726 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.648 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 6.8 mt-10 -52.76 -47.84 67.18 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-N 121.434 1.925 . . . . 0.0 107.783 169.12 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -68.08 -36.67 80.2 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-N 112.241 -2.254 . . . . 0.0 109.033 -164.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.661 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.0 OUTLIER -65.96 -42.07 90.39 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-O 123.177 1.465 . . . . 0.0 109.073 168.768 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.648 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -55.71 -36.69 67.46 Favored 'General case' 0 C--N 1.389 2.319 0 CA-C-N 112.646 -2.07 . . . . 0.0 108.413 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.599 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.6 t -72.8 -41.18 65.22 Favored 'General case' 0 C--N 1.388 2.261 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.545 -178.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 77.8 mt -66.76 -50.9 61.24 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-O 124.882 2.277 . . . . 0.0 108.048 -165.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.988 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -90.7 -17.94 7.69 Favored 'Isoleucine or valine' 0 C--N 1.387 2.229 0 CA-C-N 110.406 -3.088 . . . . 0.0 107.949 -172.883 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 81.84 38.35 0.06 Allowed 'General case' 0 C--N 1.386 2.161 0 CA-C-N 111.414 -2.63 . . . . 0.0 107.981 153.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.988 HD13 ' CD1' ' P' ' 146' ' ' ILE . 6.0 mt -94.92 172.84 7.91 Favored 'General case' 0 C--N 1.39 2.356 0 CA-C-N 112.018 -2.356 . . . . 0.0 109.165 166.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.528 ' O ' ' N ' ' P' ' 152' ' ' GLN . 16.8 p -87.84 145.29 36.4 Favored Pre-proline 0 CA--C 1.585 2.304 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 168.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.585 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 65.9 Cg_exo -49.56 -48.28 19.58 Favored 'Trans proline' 0 C--N 1.408 3.701 0 C-N-CA 124.078 3.185 . . . . 0.0 113.909 -167.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 151' ' ' THR . . . . . 0.452 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -56.52 -26.27 54.12 Favored 'General case' 0 C--N 1.388 2.255 0 CA-C-N 112.174 -2.285 . . . . 0.0 110.339 173.188 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' P' ' 149' ' ' THR . 47.3 mt-30 -77.58 -28.44 51.67 Favored 'General case' 0 C--N 1.392 2.42 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 174.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.642 HG11 ' CD1' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -64.19 -70.5 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.954 0 CA-C-N 122.326 2.33 . . . . 0.0 109.545 163.395 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.62 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.0 -59.21 0.43 Allowed 'General case' 0 C--N 1.385 2.149 0 C-N-CA 124.869 1.267 . . . . 0.0 110.338 -176.818 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' P' ' 155' ' ' ILE . 9.4 mm -64.03 -34.5 68.98 Favored 'Isoleucine or valine' 0 C--N 1.385 2.12 0 CA-C-N 112.898 -1.955 . . . . 0.0 110.163 -171.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.788 ' HB3' HD21 ' P' ' 124' ' ' LEU . 5.7 t90 -67.45 -31.55 71.79 Favored 'General case' 0 C--N 1.381 1.95 0 O-C-N 121.305 -0.872 . . . . 0.0 109.472 168.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.821 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 65.0 m-85 -74.62 -40.24 61.64 Favored 'General case' 0 C--O 1.273 2.338 0 O-C-N 121.436 -0.79 . . . . 0.0 111.975 172.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.519 ' N ' ' O ' ' P' ' 154' ' ' LYS . 39.3 mt-30 -54.25 -59.67 4.36 Favored 'General case' 0 C--N 1.378 1.823 0 O-C-N 119.592 -1.943 . . . . 0.0 106.244 170.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -57.11 -24.74 56.27 Favored 'General case' 0 C--N 1.389 2.32 0 CA-C-O 117.509 -1.234 . . . . 0.0 109.935 -169.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.535 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 3.1 t60 -79.08 -41.84 27.79 Favored 'General case' 0 C--O 1.284 2.92 0 CA-C-N 121.779 2.082 . . . . 0.0 111.323 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.783 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -67.66 -38.06 83.26 Favored 'General case' 0 C--O 1.264 1.818 0 CA-C-N 122.946 2.612 . . . . 0.0 109.955 -176.718 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -60.42 -43.87 96.31 Favored 'General case' 0 C--N 1.38 1.908 0 O-C-N 120.659 -1.276 . . . . 0.0 108.101 170.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . 0.43 ' HB2' ' HA ' ' P' ' 160' ' ' HIS . 0.5 OUTLIER -66.27 -23.71 66.44 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.951 -164.998 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.783 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -73.79 -56.85 4.47 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 125.654 2.645 . . . . 0.0 105.905 -167.289 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . . . . . . . . . 9.3 mtpt -58.78 -44.93 90.82 Favored 'General case' 0 C--N 1.392 2.444 1 CA-C-N 107.632 -4.349 . . . . 0.0 108.829 -169.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 11.8 ttt-85 -60.23 -38.92 84.89 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-N 112.662 -2.063 . . . . 0.0 108.763 -177.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . 0.594 ' HB1' ' O ' ' P' ' 164' ' ' THR . . . -48.95 -42.34 37.06 Favored 'General case' 0 C--N 1.385 2.109 0 CA-C-N 113.541 -1.663 . . . . 0.0 108.538 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -81.54 -24.14 36.8 Favored 'General case' 0 C--N 1.388 2.269 0 CA-C-N 111.763 -2.471 . . . . 0.0 110.361 -166.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.67 -29.68 53.33 Favored 'General case' 0 C--N 1.387 2.22 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.99 170.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -74.61 -40.01 61.82 Favored 'General case' 0 C--N 1.387 2.203 0 CA-C-N 113.059 -1.882 . . . . 0.0 107.993 -165.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -92.63 85.55 5.3 Favored 'General case' 0 C--N 1.382 2.001 0 CA-C-N 113.679 -1.601 . . . . 0.0 109.197 -158.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 125.4 -49.87 0.89 Allowed Glycine 0 C--N 1.382 3.116 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -164.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 102.1 150.37 0.01 OUTLIER 'General case' 0 C--N 1.388 2.279 0 CA-C-N 112.62 -1.79 . . . . 0.0 108.564 172.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -158.57 -179.96 8.56 Favored 'General case' 0 C--N 1.392 2.431 0 CA-C-N 112.969 -1.923 . . . . 0.0 107.942 156.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 144.2 -97.07 0.19 Allowed Glycine 0 C--N 1.382 3.089 0 N-CA-C 109.106 -1.597 . . . . 0.0 109.106 167.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -47.1 137.51 8.1 Favored Pre-proline 0 CA--C 1.58 2.131 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 159.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo . . . . . 0 CA--C 1.594 3.523 0 C-N-CA 121.532 1.488 . . . . 0.0 111.59 -179.737 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . 0.843 ' H73' ' O6 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.811 0 O5'-C5'-C4' 114.393 2.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.843 ' O6 ' ' H73' ' A' ' 1' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.554 1 P-O3'-C3' 125.918 5.182 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.825 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.892 1 P-O3'-C3' 131.115 9.512 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.598 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.436 0 P-O3'-C3' 123.717 3.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.523 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.891 0 P-O3'-C3' 123.149 2.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.523 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.567 3.898 0 C3'-C2'-C1' 106.494 2.71 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.718 " H4'" ' HG2' ' P' ' 113' ' ' ARG . . . . . . . . 0 C4'--C3' 1.565 3.677 0 C2'-C3'-O3' 118.071 2.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.797 " H4'" ' HD2' ' P' ' 111' ' ' LYS . . . . . . . . 1 C5'--C4' 1.548 4.623 0 O4'-C1'-N19 110.817 3.771 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.606 ' C5 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.492 0 O4'-C4'-C3' 108.465 2.865 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.606 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.816 0 N19-C1'-C2' 117.819 2.262 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.467 ' C8 ' H2'' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.415 0 O4'-C4'-C3' 108.186 2.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . 0.479 H2'' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.368 0 P-O3'-C3' 122.482 2.318 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.898 ' C6 ' ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.586 0 O4'-C4'-C3' 108.443 2.843 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.898 ' H72' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.705 1 P-O3'-C3' 125.988 5.24 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.688 ' C8 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.9 1 O4'-C1'-N19 111.186 4.233 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.688 ' H72' ' C8 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.584 0 O4'-C1'-N19 109.552 2.19 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . 0.436 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.629 0 O5'-C5'-C4' 115.056 3.468 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.456 H2'' ' C8 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.915 0 O4'-C4'-C3' 108.08 2.48 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.456 ' C8 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.373 0 O4'-C4'-C3' 108.22 2.62 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.522 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.331 0 P-O3'-C3' 123.792 3.41 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.596 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.572 4.382 0 N19-C1'-C2' 119.123 3.077 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.596 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.486 0 P-O3'-C3' 124.294 3.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.612 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.481 0 C3'-C2'-C1' 106.943 3.031 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.612 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.624 0 O4'-C4'-C3' 108.38 2.78 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.618 ' C2 ' ' C4 ' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.749 0 P-O3'-C3' 123.798 3.415 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.618 ' C4 ' ' C2 ' ' B' ' 25' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.56 4.211 0 P-O3'-C3' 123.935 3.529 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.562 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.576 0 P-O3'-C3' 123.343 3.036 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.562 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.443 0 P-O3'-C3' 122.288 2.156 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.598 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.726 0 P-O3'-C3' 123.038 2.781 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.348 0 O4'-C4'-C3' 108.051 2.451 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.592 0 O4'-C4'-C3' 108.424 2.824 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . 0.5 ' C8 ' H2'' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.542 3.906 0 O4'-C1'-N19 109.463 2.078 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.475 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 5.8 t -103.19 -67.2 0.89 Allowed 'General case' 0 C--N 1.382 2.0 0 CA-C-N 113.656 -1.611 . . . . 0.0 108.687 173.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 170.04 37.69 0.0 OUTLIER 'General case' 0 C--N 1.396 2.604 0 CA-C-N 113.357 -1.747 . . . . 0.0 109.484 175.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . 0.674 ' O ' HD12 ' P' ' 105' ' ' LEU . . . -172.19 -102.47 0.16 Allowed Glycine 0 C--N 1.381 3.029 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 160.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.674 HD12 ' O ' ' P' ' 104' ' ' GLY . 0.3 OUTLIER -171.35 153.17 3.53 Favored Pre-proline 0 CA--C 1.582 2.198 0 CA-C-N 113.713 -1.243 . . . . 0.0 108.508 176.353 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -50.75 78.29 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.083 0 C-N-CA 123.046 2.497 . . . . 0.0 110.608 155.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 70.01 -167.8 0.17 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 122.453 1.121 . . . . 0.0 109.176 -173.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . 0.61 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -154.55 46.54 0.56 Allowed 'General case' 0 C--N 1.383 2.033 0 CA-C-N 113.681 -1.6 . . . . 0.0 108.048 179.481 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . . . . . . . . . 1.7 ttpt -96.8 140.23 31.68 Favored 'General case' 0 C--N 1.379 1.86 0 CA-C-N 113.627 -1.624 . . . . 0.0 109.772 175.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.61 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.0 OUTLIER -127.61 92.46 3.49 Favored 'General case' 0 C--N 1.382 2.015 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.867 -155.564 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.797 ' HD2' " H4'" ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -12.45 88.25 0.0 OUTLIER 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.411 -1.722 . . . . 0.0 110.341 159.518 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . 0.433 ' HA ' " H4'" ' B' ' 28' ' ' ' DA' . 4.3 mtm180 -89.68 166.38 13.63 Favored 'General case' 0 C--N 1.39 2.333 0 CA-C-N 112.441 -2.163 . . . . 0.0 108.785 157.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 1.017 ' CD ' HD23 ' P' ' 115' ' ' LEU . 1.2 ttm180 -83.54 116.99 22.83 Favored 'General case' 0 C--N 1.383 2.059 0 CA-C-N 113.522 -1.672 . . . . 0.0 107.021 -170.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.697 HG22 " O3'" ' A' ' 7' ' ' ' DA' . 0.1 OUTLIER -100.05 70.44 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.388 2.27 0 CA-C-O 124.913 2.292 . . . . 0.0 107.968 -164.497 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 1.017 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.1 OUTLIER -76.56 108.87 9.86 Favored 'General case' 0 C--N 1.387 2.227 0 CA-C-N 111.842 -2.436 . . . . 0.0 109.456 -161.122 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.561 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.0 m-85 -75.62 141.38 42.85 Favored 'General case' 0 C--N 1.389 2.287 0 CA-C-N 112.872 -1.967 . . . . 0.0 108.152 -170.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.82 148.05 52.44 Favored 'General case' 0 C--N 1.382 1.994 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 -170.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -43.24 -36.37 1.76 Allowed 'General case' 0 C--N 1.382 1.979 0 CA-C-N 113.425 -1.716 . . . . 0.0 109.218 -177.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.68 -66.78 0.33 Allowed 'General case' 0 C--N 1.382 1.978 0 CA-C-O 124.178 1.942 . . . . 0.0 109.14 174.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.597 ' O ' HD13 ' P' ' 124' ' ' LEU . 81.0 mt-30 -48.52 -49.35 36.44 Favored 'General case' 0 C--N 1.382 2.001 0 CA-C-N 112.448 -2.16 . . . . 0.0 109.527 177.298 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.596 ' HA ' HD13 ' P' ' 124' ' ' LEU . 19.5 m -51.6 -54.27 29.51 Favored 'General case' 0 C--N 1.384 2.101 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 171.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.668 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.9 OUTLIER -52.96 -46.5 68.23 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 122.428 1.109 . . . . 0.0 110.095 -172.085 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.814 ' HG3' HG23 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.89 -38.74 86.83 Favored 'General case' 0 C--N 1.379 1.871 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.87 179.84 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.879 HD21 ' HB3' ' P' ' 156' ' ' TRP . 1.3 mt -60.56 -50.23 74.36 Favored 'General case' 0 C--N 1.385 2.112 0 O-C-N 120.305 -1.497 . . . . 0.0 109.525 172.404 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.562 ' O ' ' N ' ' P' ' 129' ' ' ARG . 23.4 mt-10 -55.81 -50.35 70.77 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-O 122.626 1.203 . . . . 0.0 109.653 177.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.668 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.46 -68.38 0.19 Allowed 'General case' 0 C--N 1.378 1.808 0 CA-C-N 112.09 -2.323 . . . . 0.0 108.844 175.184 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.846 ' HD3' HD12 ' P' ' 134' ' ' LEU . 1.1 mmt85 -60.56 -36.19 77.89 Favored 'General case' 0 C--N 1.386 2.165 0 CA-C-N 113.06 -1.882 . . . . 0.0 108.418 -170.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.751 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 13.7 t80 -70.2 -48.09 58.67 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-N 119.066 0.848 . . . . 0.0 110.123 176.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.562 ' N ' ' O ' ' P' ' 125' ' ' GLU . 14.7 mtm180 -62.5 -18.88 62.88 Favored 'General case' 0 C--N 1.381 1.945 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 -168.132 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -95.35 -41.04 9.21 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 123.975 1.845 . . . . 0.0 107.059 -173.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -156.46 123.59 5.3 Favored 'General case' 0 C--N 1.393 2.487 0 CA-C-N 111.888 -2.414 . . . . 0.0 108.982 -156.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . 0.447 ' NH1' ' HG3' ' P' ' 132' ' ' ARG . 0.0 OUTLIER -77.73 -16.54 58.37 Favored 'General case' 0 C--N 1.384 2.08 0 CA-C-N 111.805 -2.452 . . . . 0.0 110.249 -172.021 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.418 ' HD1' ' HA ' ' P' ' 133' ' ' TYR . 0.2 OUTLIER -155.27 123.84 6.02 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-O 124.886 2.279 . . . . 0.0 109.308 -154.255 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.846 HD12 ' HD3' ' P' ' 127' ' ' ARG . 30.9 mt -136.05 136.93 40.63 Favored 'General case' 0 C--N 1.404 2.954 0 O-C-N 119.884 -1.76 . . . . 0.0 109.359 -164.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.45 151.71 26.44 Favored 'General case' 0 C--N 1.383 2.05 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 172.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.441 ' HA ' ' HG3' ' P' ' 139' ' ' ARG . . . -57.68 -39.49 76.98 Favored Pre-proline 0 CA--C 1.588 2.406 0 O-C-N 121.405 -0.81 . . . . 0.0 109.259 -165.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -42.56 66.24 Favored 'Trans proline' 0 C--N 1.396 3.033 0 N-CA-C 119.2 2.731 . . . . 0.0 119.2 175.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -49.32 -71.28 0.07 Allowed 'General case' 0 C--N 1.379 1.855 0 CA-C-O 124.626 2.155 . . . . 0.0 107.548 162.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.819 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.26 -37.07 77.75 Favored 'General case' 0 C--N 1.391 2.376 0 CA-C-N 109.563 -3.471 . . . . 0.0 108.492 -157.37 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.636 ' O ' ' N ' ' P' ' 144' ' ' SER . 2.4 mt-10 -53.29 -40.3 64.63 Favored 'General case' 0 C--N 1.381 1.952 0 CA-C-O 123.103 1.43 . . . . 0.0 108.023 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -63.3 -36.0 82.23 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-N 112.937 -1.938 . . . . 0.0 108.445 -171.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.8 HD12 ' CG ' ' P' ' 127' ' ' ARG . 1.7 tp -66.02 -43.19 88.39 Favored 'General case' 0 C--N 1.383 2.024 0 CA-C-O 123.037 1.399 . . . . 0.0 109.16 168.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.592 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -56.07 -33.17 64.78 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 112.75 -2.023 . . . . 0.0 108.28 173.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.636 ' N ' ' O ' ' P' ' 140' ' ' GLU . 7.4 t -73.5 -44.26 58.2 Favored 'General case' 0 C--N 1.387 2.228 0 CA-C-N 113.631 -1.622 . . . . 0.0 109.698 -177.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 83.0 mt -68.04 -44.22 76.9 Favored 'General case' 0 C--N 1.38 1.933 0 CA-C-O 124.793 2.235 . . . . 0.0 108.255 -163.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.972 ' CD1' HD13 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -100.2 -13.08 8.31 Favored 'Isoleucine or valine' 0 C--N 1.39 2.34 0 CA-C-N 110.931 -2.85 . . . . 0.0 107.916 -167.696 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 82.37 34.74 0.07 Allowed 'General case' 0 C--N 1.382 1.993 0 CA-C-O 125.508 2.575 . . . . 0.0 107.942 152.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.972 HD13 ' CD1' ' P' ' 146' ' ' ILE . 9.3 mt -96.26 169.59 9.83 Favored 'General case' 0 C--N 1.397 2.637 0 CA-C-N 111.573 -2.558 . . . . 0.0 109.516 170.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.648 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.5 p -91.56 139.81 25.17 Favored Pre-proline 0 CA--C 1.593 2.597 0 CA-C-O 122.661 1.22 . . . . 0.0 108.543 170.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.486 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 15.0 Cg_exo -56.07 -35.31 94.67 Favored 'Trans proline' 1 C--N 1.415 4.047 0 C-N-CA 122.688 2.259 . . . . 0.0 112.92 -159.674 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 1.3 m -59.65 -28.5 67.3 Favored 'General case' 0 C--N 1.384 2.071 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.866 167.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.648 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -72.8 -30.83 64.39 Favored 'General case' 0 C--O 1.271 2.197 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.632 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.4 t -64.35 -74.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 122.094 2.224 . . . . 0.0 109.326 164.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.819 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -38.22 -45.71 0.99 Allowed 'General case' 0 C--N 1.385 2.128 0 C-N-CA 125.452 1.501 . . . . 0.0 110.873 -173.069 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . 0.458 HD12 ' HA ' ' P' ' 155' ' ' ILE . 0.7 OUTLIER -59.28 -64.72 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.382 2.015 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 -179.445 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.879 ' HB3' HD21 ' P' ' 124' ' ' LEU . 2.1 t90 -49.6 -30.9 9.53 Favored 'General case' 0 C--N 1.385 2.126 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -176.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.751 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 45.9 m-85 -74.57 -44.93 48.54 Favored 'General case' 0 C--O 1.278 2.598 0 O-C-N 121.252 -0.905 . . . . 0.0 112.228 171.215 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.419 ' OE1' HD12 ' P' ' 155' ' ' ILE . 46.8 mt-30 -46.05 -64.31 0.78 Allowed 'General case' 0 C--N 1.378 1.815 0 O-C-N 119.0 -2.312 . . . . 0.0 107.005 167.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . 0.435 ' O ' ' HB2' ' P' ' 163' ' ' LYS . 1.4 m120 -55.97 -21.54 21.62 Favored 'General case' 0 C--N 1.386 2.193 0 CA-C-O 117.431 -1.271 . . . . 0.0 110.551 -164.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.544 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 1.0 OUTLIER -80.69 -41.58 23.44 Favored 'General case' 0 C--O 1.292 3.31 0 CA-C-N 121.621 2.01 . . . . 0.0 112.436 176.73 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.829 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -66.26 -39.27 89.36 Favored 'General case' 0 C--O 1.267 1.984 0 CA-C-N 123.825 3.011 . . . . 0.0 109.116 -167.505 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.414 ' HA ' ' HD3' ' P' ' 165' ' ' LYS . 39.0 t80 -66.16 -31.25 71.99 Favored 'General case' 0 C--N 1.381 1.963 0 O-C-N 120.076 -1.64 . . . . 0.0 109.669 169.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' P' ' 159' ' ' ASN . 6.1 ttmm -65.05 -32.05 73.57 Favored 'General case' 0 C--N 1.381 1.971 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 -171.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.829 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.3 OUTLIER -69.13 -57.1 5.85 Favored 'General case' 0 CA--C 1.572 1.826 0 CA-C-O 125.732 2.682 . . . . 0.0 105.246 -166.054 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.414 ' HD3' ' HA ' ' P' ' 162' ' ' TYR . 8.2 mtpt -58.11 -50.44 73.47 Favored 'General case' 0 C--N 1.39 2.346 1 CA-C-N 107.929 -4.214 . . . . 0.0 108.787 -168.316 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 8.9 ttt85 -53.97 -39.61 66.14 Favored 'General case' 0 C--N 1.381 1.961 0 CA-C-N 112.561 -2.109 . . . . 0.0 108.991 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . 0.415 ' HB1' ' O ' ' P' ' 164' ' ' THR . . . -64.75 -31.36 72.55 Favored 'General case' 0 C--N 1.382 2.013 0 CA-C-O 124.387 2.041 . . . . 0.0 109.384 -172.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.95 -22.67 31.39 Favored 'General case' 0 C--N 1.392 2.443 0 CA-C-N 112.39 -2.186 . . . . 0.0 109.982 -176.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -54.04 -32.29 54.04 Favored 'General case' 0 C--N 1.38 1.908 0 CA-C-O 123.874 1.797 . . . . 0.0 110.092 168.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -75.95 -33.2 59.81 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-N 112.284 -2.235 . . . . 0.0 107.762 -154.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -77.82 91.7 4.15 Favored 'General case' 0 C--N 1.382 2.011 0 CA-C-N 113.438 -1.71 . . . . 0.0 109.062 -159.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 116.06 -86.77 0.42 Allowed Glycine 0 C--N 1.384 3.197 0 N-CA-C 108.739 -1.744 . . . . 0.0 108.739 -155.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . 0.417 ' N ' ' CD1' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 148.83 170.95 0.0 OUTLIER 'General case' 0 C--N 1.382 1.982 0 CA-C-N 113.196 -1.502 . . . . 0.0 109.634 170.997 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.86 54.37 2.69 Favored 'General case' 0 C--N 1.388 2.246 0 CA-C-N 111.868 -2.424 . . . . 0.0 109.686 173.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -65.42 103.52 0.82 Allowed Glycine 0 C--N 1.38 3.0 0 N-CA-C 109.379 -1.489 . . . . 0.0 109.379 -157.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . 0.405 ' CG ' ' HD2' ' P' ' 177' ' ' PRO . 0.4 OUTLIER -156.81 165.83 17.92 Favored Pre-proline 0 CA--C 1.579 2.094 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -176.713 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . 0.405 ' HD2' ' CG ' ' P' ' 176' ' ' HIS . 68.3 Cg_exo . . . . . 0 CA--C 1.593 3.461 0 C-N-CA 121.516 1.477 . . . . 0.0 111.587 170.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.567 3.856 0 O5'-C5'-C4' 114.351 2.965 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ' DG' . . . . . 0.862 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.3 0 O4'-C4'-C3' 108.138 2.538 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . 0.862 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.856 0 P-O3'-C3' 122.553 2.378 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.661 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.731 0 P-O3'-C3' 123.445 3.121 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ' DT' . . . . . 0.554 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.864 1 P-O3'-C3' 126.54 5.7 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . 0.591 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.956 1 P-O3'-C3' 126.295 5.496 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ' DA' . . . . . 0.833 H5'' ' HG2' ' P' ' 113' ' ' ARG . . . . . . . . 0 C5'--C4' 1.538 3.383 1 P-O3'-C3' 124.532 4.027 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ' DA' . . . . . 0.902 H2'' H5'' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.445 0 C4'-C3'-C2' 100.818 -2.382 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ' DG' . . . . . 0.902 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.353 0 P-O3'-C3' 123.031 2.776 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ' DT' . . . . . 0.652 ' H71' ' C8 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.815 0 P-O3'-C3' 122.726 2.522 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.518 ' C8 ' H2'' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.475 0 O4'-C4'-C3' 108.002 2.402 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.561 3.347 0 P-O3'-C3' 122.518 2.348 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ' DC' . . . . . 0.506 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.624 0 O4'-C4'-C3' 108.288 2.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.669 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.793 0 C2'-C3'-O3' 116.673 2.249 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ' DG' . . . . . 0.785 " H2'" ' H73' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.543 3.941 1 O4'-C1'-N19 111.241 4.302 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ' DT' . . . . . 0.785 ' H73' " H2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.563 0 P-O3'-C3' 123.894 3.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.727 0 O5'-C5'-C4' 115.08 3.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' ' DC' . . . . . 0.472 ' C4 ' ' N6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.538 1 P-O3'-C3' 126.838 5.948 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' ' DA' . . . . . 0.472 ' N6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.508 0 O4'-C4'-C3' 108.253 2.653 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' ' DG' . . . . . 0.51 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.29 0 P-O3'-C3' 124.147 3.706 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.655 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.571 4.27 0 N19-C1'-C2' 119.009 3.006 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' ' DC' . . . . . 0.655 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.556 3.76 0 N19-C1'-C2' 118.365 2.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' ' DA' . . . . . 0.632 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.564 1 P-O3'-C3' 130.654 9.128 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' ' DC' . . . . . 0.632 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.543 0 O4'-C4'-C3' 108.619 3.019 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' ' DT' . . . . . 0.486 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.901 0 C2'-C3'-O3' 116.634 2.235 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' ' DT' . . . . . 0.455 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.558 3.958 0 N19-C1'-C2' 119.252 3.157 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . 0.595 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.671 0 P-O3'-C3' 122.856 2.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.599 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.349 0 P-O3'-C3' 122.511 2.343 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' ' DC' . . . . . 0.661 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.672 0 O4'-C4'-C3' 108.261 2.661 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . 0.577 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.358 0 O4'-C4'-C3' 107.979 2.379 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' ' DC' . . . . . 0.577 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.617 0 O4'-C4'-C3' 108.302 2.702 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.92 0 P-O3'-C3' 121.98 1.9 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.494 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.8 m -146.51 101.46 3.47 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 113.678 -1.601 . . . . 0.0 108.656 -177.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 169.86 -26.11 0.0 OUTLIER 'General case' 0 C--N 1.389 2.311 0 CA-C-N 113.503 -1.68 . . . . 0.0 108.131 -175.083 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.16 163.06 27.83 Favored Glycine 0 C--N 1.381 3.056 0 N-CA-C 108.892 -1.683 . . . . 0.0 108.892 170.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 105' ' ' LEU . . . . . 0.814 HD11 ' HD2' ' P' ' 106' ' ' PRO . 0.0 OUTLIER -95.19 170.12 8.35 Favored Pre-proline 0 CA--C 1.581 2.138 0 CA-C-N 113.689 -1.255 . . . . 0.0 108.723 171.264 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.814 ' HD2' HD11 ' P' ' 105' ' ' LEU . 46.6 Cg_exo -46.17 93.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.127 0 C-N-CA 122.983 2.455 . . . . 0.0 110.363 155.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -139.18 146.17 40.22 Favored 'General case' 0 C--N 1.382 1.991 0 CA-C-O 122.452 1.12 . . . . 0.0 109.126 161.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.31 112.65 25.43 Favored 'General case' 0 C--N 1.383 2.027 0 CA-C-N 113.725 -1.58 . . . . 0.0 108.151 176.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 109' ' ' LYS . . . . . 0.739 ' HE3' ' H ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -64.55 165.26 10.33 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 113.704 -1.589 . . . . 0.0 109.05 -169.636 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 110' ' ' ARG . . . . . 0.739 ' H ' ' HE3' ' P' ' 109' ' ' LYS . 0.8 OUTLIER -123.03 57.08 1.14 Allowed 'General case' 0 C--N 1.382 1.986 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.039 -155.425 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 111' ' ' LYS . . . . . 0.488 ' HD2' " O3'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -82.17 87.46 6.52 Favored 'General case' 0 C--N 1.382 2.012 0 CA-C-O 123.725 1.726 . . . . 0.0 108.363 174.723 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 23.3 mtt-85 -64.28 175.84 1.2 Allowed 'General case' 0 C--N 1.39 2.353 0 CA-C-N 111.801 -2.454 . . . . 0.0 108.848 155.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 113' ' ' ARG . . . . . 0.927 ' CD ' HD23 ' P' ' 115' ' ' LEU . 0.8 OUTLIER -91.24 118.44 30.48 Favored 'General case' 0 C--N 1.383 2.029 0 CA-C-N 113.686 -1.597 . . . . 0.0 107.171 160.753 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 114' ' ' VAL . . . . . 0.534 HG22 ' P ' ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -103.42 67.27 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.179 0 CA-C-O 125.349 2.499 . . . . 0.0 108.053 -162.022 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 115' ' ' LEU . . . . . 0.927 HD23 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.75 108.99 10.16 Favored 'General case' 0 C--N 1.39 2.341 0 CA-C-N 111.633 -2.53 . . . . 0.0 109.405 -158.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 116' ' ' PHE . . . . . 0.497 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 -75.66 142.67 42.5 Favored 'General case' 0 C--N 1.389 2.294 0 CA-C-N 112.667 -2.06 . . . . 0.0 108.208 -170.424 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.1 p -66.01 149.48 50.17 Favored 'General case' 0 C--N 1.383 2.026 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 -171.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -45.06 -36.9 3.81 Favored 'General case' 0 C--N 1.381 1.973 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.067 -177.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.5 -57.91 9.02 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 113.136 -1.847 . . . . 0.0 109.655 175.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 120' ' ' GLN . . . . . 0.543 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.7 mt-30 -60.9 -48.66 80.77 Favored 'General case' 0 C--N 1.382 2.01 0 C-N-CA 126.728 2.011 . . . . 0.0 109.694 179.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 121' ' ' THR . . . . . 0.589 ' HA ' HD13 ' P' ' 124' ' ' LEU . 5.7 m -47.6 -54.68 11.15 Favored 'General case' 0 C--N 1.383 2.062 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 169.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 122' ' ' TYR . . . . . 0.524 ' CZ ' ' HG3' ' P' ' 126' ' ' ARG . 0.0 OUTLIER -52.3 -51.17 60.1 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.09 -170.361 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 123' ' ' GLU . . . . . 0.985 ' CD ' HG23 ' P' ' 146' ' ' ILE . 7.8 mt-10 -64.89 -37.38 87.45 Favored 'General case' 0 C--N 1.379 1.89 0 CA-C-N 113.964 -1.471 . . . . 0.0 107.601 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 124' ' ' LEU . . . . . 0.782 HD21 ' HB3' ' P' ' 156' ' ' TRP . 3.3 mt -60.82 -49.67 76.56 Favored 'General case' 0 C--N 1.384 2.097 0 O-C-N 120.967 -1.083 . . . . 0.0 110.28 171.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 125' ' ' GLU . . . . . 0.578 ' O ' ' N ' ' P' ' 129' ' ' ARG . 27.2 mt-10 -53.97 -55.39 27.53 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-O 122.347 1.07 . . . . 0.0 108.394 176.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 126' ' ' ARG . . . . . 0.524 ' HG3' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.08 -68.38 0.17 Allowed 'General case' 0 C--N 1.379 1.861 0 CA-C-N 111.935 -2.393 . . . . 0.0 108.882 179.697 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 127' ' ' ARG . . . . . 0.931 ' HG2' HD12 ' P' ' 142' ' ' LEU . 0.0 OUTLIER -58.54 -34.47 71.05 Favored 'General case' 0 C--N 1.394 2.536 0 CA-C-N 112.673 -2.058 . . . . 0.0 108.469 -174.831 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 128' ' ' PHE . . . . . 0.724 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 9.0 t80 -67.73 -50.94 54.72 Favored 'General case' 0 C--N 1.388 2.264 0 O-C-N 121.213 -0.93 . . . . 0.0 110.382 176.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 129' ' ' ARG . . . . . 0.578 ' N ' ' O ' ' P' ' 125' ' ' GLU . 3.2 mmm180 -62.56 -13.15 27.79 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 112.894 -1.957 . . . . 0.0 108.073 -165.353 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -107.88 -39.74 5.46 Favored 'General case' 0 C--N 1.379 1.886 0 C-N-CA 126.319 1.848 . . . . 0.0 107.444 -169.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 131' ' ' GLN . . . . . 0.523 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.4 OUTLIER -153.99 109.08 3.13 Favored 'General case' 0 C--N 1.386 2.164 0 CA-C-N 112.003 -2.362 . . . . 0.0 109.34 -152.914 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -77.04 -18.09 58.33 Favored 'General case' 0 C--N 1.393 2.479 0 CA-C-N 112.45 -2.159 . . . . 0.0 110.556 -167.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 133' ' ' TYR . . . . . 0.44 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 20.0 m-85 -156.81 112.51 2.92 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-N 114.212 -1.358 . . . . 0.0 108.065 -154.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 134' ' ' LEU . . . . . 0.603 HD12 ' HB3' ' P' ' 127' ' ' ARG . 20.4 mt -127.88 130.63 48.85 Favored 'General case' 0 C--N 1.398 2.701 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 -154.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.19 156.79 20.17 Favored 'General case' 0 C--N 1.382 1.987 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 136' ' ' ALA . . . . . 0.473 ' HA ' ' HG3' ' P' ' 139' ' ' ARG . . . -58.36 -43.3 98.03 Favored Pre-proline 0 CA--C 1.585 2.319 0 O-C-N 121.452 -0.78 . . . . 0.0 109.377 -158.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 137' ' ' PRO . . . . . 0.462 ' HD3' ' HB2' ' P' ' 136' ' ' ALA . 0.2 OUTLIER -56.5 -40.17 86.35 Favored 'Trans proline' 0 C--N 1.395 3.001 0 N-CA-C 119.056 2.675 . . . . 0.0 119.056 176.694 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 138' ' ' GLU . . . . . 0.457 ' HB3' HD21 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -49.79 -73.7 0.04 OUTLIER 'General case' 0 C--N 1.38 1.902 0 CA-C-O 124.049 1.88 . . . . 0.0 107.497 161.721 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 139' ' ' ARG . . . . . 0.927 ' CZ ' ' HG3' ' P' ' 154' ' ' LYS . 2.1 ptt180 -69.79 -33.53 72.51 Favored 'General case' 0 C--N 1.391 2.386 0 CA-C-N 109.722 -3.399 . . . . 0.0 108.774 -156.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 140' ' ' GLU . . . . . 0.652 ' O ' ' HB2' ' P' ' 143' ' ' ALA . 1.7 mt-10 -53.1 -45.99 68.49 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-O 123.578 1.656 . . . . 0.0 108.127 174.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -66.99 -35.49 80.07 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 112.439 -2.164 . . . . 0.0 109.417 -164.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 142' ' ' LEU . . . . . 0.931 HD12 ' HG2' ' P' ' 127' ' ' ARG . 1.1 tp -65.31 -41.79 93.67 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-O 123.369 1.557 . . . . 0.0 108.981 169.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 143' ' ' ALA . . . . . 0.652 ' HB2' ' O ' ' P' ' 140' ' ' GLU . . . -57.04 -36.41 70.46 Favored 'General case' 0 C--N 1.39 2.36 0 CA-C-N 112.224 -2.262 . . . . 0.0 107.971 173.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 144' ' ' SER . . . . . 0.502 ' N ' ' O ' ' P' ' 140' ' ' GLU . 2.1 t -69.76 -43.07 72.98 Favored 'General case' 0 C--N 1.388 2.275 0 CA-C-N 113.22 -1.809 . . . . 0.0 111.083 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 145' ' ' LEU . . . . . 0.42 HD11 ' OE1' ' P' ' 123' ' ' GLU . 82.5 mt -69.04 -48.14 63.63 Favored 'General case' 0 C--N 1.38 1.891 0 CA-C-O 124.851 2.263 . . . . 0.0 108.205 -163.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 146' ' ' ILE . . . . . 0.985 HG23 ' CD ' ' P' ' 123' ' ' GLU . 0.0 OUTLIER -92.02 -13.89 8.69 Favored 'Isoleucine or valine' 0 C--N 1.389 2.325 0 CA-C-N 110.675 -2.966 . . . . 0.0 107.958 -169.407 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 82.27 36.13 0.07 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 125.761 2.696 . . . . 0.0 107.66 152.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 148' ' ' LEU . . . . . 0.98 HD13 ' CD1' ' P' ' 146' ' ' ILE . 8.3 mt -95.18 173.82 7.37 Favored 'General case' 0 C--N 1.396 2.594 0 CA-C-N 111.353 -2.658 . . . . 0.0 109.083 166.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 149' ' ' THR . . . . . 0.472 ' O ' ' N ' ' P' ' 152' ' ' GLN . 16.6 p -89.16 148.22 40.32 Favored Pre-proline 0 CA--C 1.586 2.349 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 164.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 150' ' ' PRO . . . . . 0.599 ' HA ' ' HB1' ' P' ' 143' ' ' ALA . 86.6 Cg_exo -50.36 -51.99 9.89 Favored 'Trans proline' 0 C--N 1.408 3.69 0 C-N-CA 123.48 2.787 . . . . 0.0 113.543 -169.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -11.59 3.6 Favored 'General case' 0 C--N 1.388 2.252 0 CA-C-N 113.341 -1.754 . . . . 0.0 110.782 175.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 152' ' ' GLN . . . . . 0.495 ' HB2' ' HB3' ' P' ' 148' ' ' LEU . 43.6 mt-30 -86.31 -30.55 22.17 Favored 'General case' 0 C--O 1.279 2.656 0 CA-C-N 120.0 1.273 . . . . 0.0 108.443 167.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 153' ' ' VAL . . . . . 0.752 HG11 ' CD2' ' P' ' 157' ' ' PHE . 1.4 t -63.52 -72.93 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.38 1.919 0 CA-C-N 123.534 2.879 . . . . 0.0 109.779 163.159 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 154' ' ' LYS . . . . . 0.927 ' HG3' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -32.43 -56.11 0.34 Allowed 'General case' 0 C--N 1.385 2.117 0 C-N-CA 124.358 1.063 . . . . 0.0 110.822 -176.68 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.81 -45.13 95.12 Favored 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 113.549 -1.66 . . . . 0.0 108.937 -171.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 156' ' ' TRP . . . . . 0.782 ' HB3' HD21 ' P' ' 124' ' ' LEU . 2.7 t90 -62.97 -31.54 72.67 Favored 'General case' 0 C--N 1.381 1.947 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.06 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 157' ' ' PHE . . . . . 0.752 ' CD2' HG11 ' P' ' 153' ' ' VAL . 66.0 m-85 -74.87 -35.57 62.32 Favored 'General case' 0 C--O 1.279 2.623 0 O-C-N 121.275 -0.89 . . . . 0.0 111.819 170.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 158' ' ' GLN . . . . . 0.549 ' N ' ' O ' ' P' ' 154' ' ' LYS . 33.0 mt-30 -56.96 -62.76 1.52 Allowed 'General case' 0 C--N 1.378 1.817 0 O-C-N 119.047 -2.283 . . . . 0.0 106.802 169.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -56.65 -24.91 51.71 Favored 'General case' 0 C--N 1.393 2.46 0 CA-C-O 117.062 -1.447 . . . . 0.0 109.525 -166.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 160' ' ' HIS . . . . . 0.545 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.1 t60 -74.38 -49.19 23.67 Favored 'General case' 0 C--O 1.283 2.835 0 CA-C-N 121.463 1.938 . . . . 0.0 109.914 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 161' ' ' ARG . . . . . 0.827 ' O ' HG21 ' P' ' 164' ' ' THR . 0.0 OUTLIER -68.18 -41.88 80.81 Favored 'General case' 0 C--O 1.267 2.003 0 CA-C-N 122.19 2.268 . . . . 0.0 109.527 -160.651 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 162' ' ' TYR . . . . . 0.521 ' CZ ' ' HD2' ' P' ' 166' ' ' ARG . 40.5 t80 -66.91 -31.08 71.43 Favored 'General case' 0 C--N 1.381 1.948 0 O-C-N 119.952 -1.717 . . . . 0.0 109.514 171.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -32.25 73.69 Favored 'General case' 0 C--N 1.381 1.936 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -171.532 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 164' ' ' THR . . . . . 0.827 HG21 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -68.24 -57.05 6.6 Favored 'General case' 0 CA--C 1.573 1.847 0 CA-C-O 124.831 2.253 . . . . 0.0 105.384 -166.415 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 165' ' ' LYS . . . . . 0.429 ' HD3' ' HA ' ' P' ' 162' ' ' TYR . 8.1 mtpt -58.13 -45.79 86.71 Favored 'General case' 0 C--N 1.386 2.165 0 CA-C-N 108.428 -3.987 . . . . 0.0 109.358 -169.206 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 166' ' ' ARG . . . . . 0.521 ' HD2' ' CZ ' ' P' ' 162' ' ' TYR . 0.0 OUTLIER -42.04 -54.96 3.36 Favored 'General case' 0 C--N 1.382 1.984 0 CA-C-N 112.992 -1.913 . . . . 0.0 111.468 170.113 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' P' P ' 167' ' ' ALA . . . . . 0.569 ' HB1' ' O ' ' P' ' 164' ' ' THR . . . -45.61 -42.52 11.36 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 111.763 -2.471 . . . . 0.0 108.849 -178.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -81.7 -24.5 36.14 Favored 'General case' 0 C--N 1.385 2.128 0 CA-C-N 112.086 -2.324 . . . . 0.0 111.06 -166.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -51.95 -33.44 37.65 Favored 'General case' 0 C--N 1.388 2.245 0 CA-C-N 113.544 -1.662 . . . . 0.0 109.484 167.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -72.82 -27.41 61.94 Favored 'General case' 0 C--N 1.385 2.131 0 CA-C-N 112.62 -2.082 . . . . 0.0 109.156 -165.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 26.9 mttm -88.7 104.42 16.86 Favored 'General case' 0 C--N 1.379 1.866 0 CA-C-N 113.502 -1.681 . . . . 0.0 107.794 -163.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 47.19 75.46 0.18 Allowed Glycine 0 CA--C 1.564 3.149 0 N-CA-C 108.276 -1.93 . . . . 0.0 108.276 -152.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -32.53 146.9 0.01 OUTLIER 'General case' 0 C--N 1.389 2.293 0 CA-C-O 123.724 1.726 . . . . 0.0 109.125 169.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.0 54.12 2.65 Favored 'General case' 0 C--N 1.391 2.376 0 CA-C-N 111.009 -2.814 . . . . 0.0 109.493 175.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -59.89 -23.09 58.64 Favored Glycine 0 C--N 1.38 2.976 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -154.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -90.89 131.08 38.38 Favored Pre-proline 0 CA--C 1.581 2.144 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 -164.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo . . . . . 0 CA--C 1.594 3.481 0 C-N-CA 121.565 1.51 . . . . 0.0 111.588 -156.93 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.513 ' CE2' ' HB2' ' P' ' 156' ' ' TRP . 1.0 OUTLIER . . . . . 0 C--O 1.254 1.331 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -68.14 147.53 52.17 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -174.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' P' ' 122' ' ' TYR . 34.7 ttmt -43.96 -37.16 2.77 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 112.824 -1.989 . . . . 0.0 109.165 -177.052 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 119' ' ' ALA . . . . . 0.411 ' O ' ' HB3' ' P' ' 122' ' ' TYR . . . -53.5 -65.26 0.6 Allowed 'General case' 0 C--N 1.383 2.024 0 CA-C-O 124.071 1.891 . . . . 0.0 109.279 174.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.566 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.6 mt-30 -48.24 -49.58 32.7 Favored 'General case' 0 C--N 1.382 1.991 0 CA-C-N 112.56 -2.109 . . . . 0.0 109.394 175.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.616 ' HA ' HD12 ' P' ' 124' ' ' LEU . 22.6 m -49.07 -55.76 11.14 Favored 'General case' 0 C--N 1.382 1.987 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 170.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.686 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.19 -46.1 68.85 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-O 122.504 1.145 . . . . 0.0 110.224 -169.47 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.664 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.1 OUTLIER -66.16 -40.05 90.23 Favored 'General case' 0 C--N 1.379 1.883 0 CA-C-N 113.983 -1.462 . . . . 0.0 107.927 179.102 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.839 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -61.02 -48.68 80.65 Favored 'General case' 0 C--N 1.385 2.139 0 O-C-N 120.484 -1.385 . . . . 0.0 110.226 172.743 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.404 ' O ' ' N ' ' P' ' 129' ' ' ARG . 26.0 mt-10 -53.17 -56.12 18.86 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 122.191 0.996 . . . . 0.0 108.598 175.104 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.686 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.53 -62.0 0.74 Allowed 'General case' 0 C--N 1.379 1.855 0 CA-C-N 112.172 -2.285 . . . . 0.0 108.705 179.113 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.536 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.4 OUTLIER -66.85 -30.51 70.71 Favored 'General case' 0 C--N 1.395 2.571 0 CA-C-N 112.233 -2.258 . . . . 0.0 108.282 -170.63 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.824 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.4 t80 -69.74 -50.82 39.77 Favored 'General case' 0 C--N 1.387 2.232 0 O-C-N 121.067 -1.021 . . . . 0.0 110.96 171.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.448 ' HA ' ' NE ' ' P' ' 129' ' ' ARG . 0.4 OUTLIER -62.26 -12.01 18.13 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-N 113.338 -1.755 . . . . 0.0 108.177 -167.218 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -102.66 -43.33 5.63 Favored 'General case' 0 C--N 1.381 1.945 0 CA-C-O 123.985 1.85 . . . . 0.0 107.258 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.425 ' HG2' ' CD2' ' P' ' 134' ' ' LEU . 2.8 tp-100 -151.69 128.74 11.08 Favored 'General case' 0 C--N 1.387 2.209 0 CA-C-N 111.608 -2.542 . . . . 0.0 110.822 -154.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -79.33 -27.94 42.08 Favored 'General case' 0 C--N 1.389 2.29 0 CA-C-N 112.003 -2.362 . . . . 0.0 111.46 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.495 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 9.2 m-85 -158.66 114.48 2.65 Favored 'General case' 0 C--N 1.377 1.79 0 CA-C-O 122.679 1.228 . . . . 0.0 109.009 -150.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.676 HD22 ' HG3' ' P' ' 138' ' ' GLU . 36.6 mt -122.92 136.08 54.73 Favored 'General case' 0 C--N 1.404 2.957 0 CA-C-N 114.393 -1.276 . . . . 0.0 108.267 -160.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.11 155.79 26.09 Favored 'General case' 0 C--N 1.383 2.025 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 166.28 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.539 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.34 -49.86 90.43 Favored Pre-proline 0 CA--C 1.584 2.269 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -161.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 84.1 Cg_exo -57.87 -28.89 84.38 Favored 'Trans proline' 0 C--N 1.4 3.277 0 C-N-CA 121.122 1.215 . . . . 0.0 114.932 -174.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.676 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -53.92 -71.36 0.08 Allowed 'General case' 0 C--N 1.38 1.9 0 CA-C-O 124.606 2.146 . . . . 0.0 106.44 160.782 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.904 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.96 -38.69 79.57 Favored 'General case' 0 C--N 1.39 2.334 0 CA-C-N 109.828 -3.351 . . . . 0.0 108.785 -155.33 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.643 ' O ' ' N ' ' P' ' 144' ' ' SER . 5.6 mt-10 -52.84 -39.58 62.63 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 122.849 1.309 . . . . 0.0 108.183 177.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -64.83 -36.47 84.44 Favored 'General case' 0 C--N 1.379 1.879 0 CA-C-N 112.926 -1.943 . . . . 0.0 108.562 -170.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.656 ' O ' HG23 ' P' ' 146' ' ' ILE . 3.2 tp -64.84 -43.2 93.83 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-O 123.104 1.431 . . . . 0.0 109.116 167.69 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.635 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -57.31 -32.43 66.67 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 112.597 -2.092 . . . . 0.0 108.45 175.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.643 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.4 OUTLIER -73.71 -44.91 55.17 Favored 'General case' 0 C--N 1.386 2.158 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.552 -178.07 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 78.5 mt -67.26 -42.84 83.24 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-O 124.598 2.142 . . . . 0.0 108.349 -163.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.994 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -101.82 -13.01 8.55 Favored 'Isoleucine or valine' 0 C--N 1.389 2.292 0 CA-C-N 111.05 -2.796 . . . . 0.0 107.817 -167.081 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 82.13 34.7 0.08 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-O 125.597 2.618 . . . . 0.0 107.98 152.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.994 HD12 HD11 ' P' ' 146' ' ' ILE . 8.4 mt -96.28 170.04 9.52 Favored 'General case' 0 C--N 1.397 2.633 0 CA-C-N 111.556 -2.565 . . . . 0.0 109.468 170.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.651 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.4 p -91.21 139.71 25.61 Favored Pre-proline 0 CA--C 1.592 2.58 0 CA-C-O 122.729 1.252 . . . . 0.0 108.718 169.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.434 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 16.2 Cg_exo -56.03 -33.9 90.89 Favored 'Trans proline' 1 C--N 1.415 4.075 0 C-N-CA 122.727 2.284 . . . . 0.0 113.114 -159.829 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -37.57 72.62 Favored 'General case' 0 C--N 1.383 2.045 0 C-N-CA 119.534 -0.866 . . . . 0.0 109.807 166.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.651 ' N ' ' O ' ' P' ' 149' ' ' THR . 49.0 mt-30 -68.51 -28.48 67.04 Favored 'General case' 0 C--N 1.387 2.225 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 -175.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.595 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.1 t -64.53 -70.31 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.193 0 CA-C-N 121.183 1.811 . . . . 0.0 109.517 165.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.904 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.95 -58.59 0.44 Allowed 'General case' 0 C--N 1.384 2.106 0 C-N-CA 125.013 1.325 . . . . 0.0 110.959 -178.143 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.497 HD13 ' OE1' ' P' ' 158' ' ' GLN . 33.4 mm -60.19 -39.33 80.29 Favored 'Isoleucine or valine' 0 C--N 1.382 1.989 0 CA-C-N 113.106 -1.861 . . . . 0.0 109.114 -172.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.839 ' HB3' HD22 ' P' ' 124' ' ' LEU . 3.8 t90 -67.21 -32.08 72.9 Favored 'General case' 0 C--N 1.382 2.003 0 O-C-N 121.373 -0.829 . . . . 0.0 109.088 172.17 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.824 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 49.2 m-85 -74.66 -40.72 61.28 Favored 'General case' 0 C--O 1.273 2.337 0 O-C-N 120.927 -1.108 . . . . 0.0 111.972 173.495 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.497 ' OE1' HD13 ' P' ' 155' ' ' ILE . 77.8 mt-30 -52.37 -58.14 7.63 Favored 'General case' 0 C--N 1.377 1.778 0 O-C-N 119.771 -1.831 . . . . 0.0 106.765 170.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -55.84 -25.62 42.85 Favored 'General case' 0 C--N 1.388 2.27 0 CA-C-O 117.709 -1.138 . . . . 0.0 109.659 -168.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.575 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.4 OUTLIER -79.75 -42.89 23.61 Favored 'General case' 0 C--O 1.286 2.992 0 CA-C-N 121.526 1.967 . . . . 0.0 111.878 -178.622 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.495 ' HD2' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.003 0 CA-C-N 123.57 2.896 . . . . 0.0 110.785 -167.35 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 116' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 . . . . . 0 C--O 1.253 1.276 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.03 148.1 51.48 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -174.256 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' P' ' 122' ' ' TYR . 38.4 ttmt -44.02 -37.19 2.84 Favored 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.084 -1.871 . . . . 0.0 109.187 -178.041 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.58 -62.15 1.84 Allowed 'General case' 0 C--N 1.382 2.011 0 CA-C-O 124.036 1.874 . . . . 0.0 109.394 175.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.566 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.6 mt-30 -52.96 -48.16 67.58 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-N 112.617 -2.083 . . . . 0.0 109.587 177.067 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.645 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.0 m -49.33 -55.81 11.61 Favored 'General case' 0 C--N 1.384 2.093 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 169.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.546 ' CE1' ' CZ ' ' P' ' 126' ' ' ARG . 2.9 t80 -53.11 -48.11 68.08 Favored 'General case' 0 C--N 1.382 2.018 0 CA-C-O 122.628 1.204 . . . . 0.0 109.949 -169.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.971 ' CD ' HG22 ' P' ' 146' ' ' ILE . 4.2 mt-10 -66.02 -38.11 87.6 Favored 'General case' 0 C--N 1.378 1.807 0 CA-C-N 113.979 -1.464 . . . . 0.0 107.604 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.717 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.1 mt -60.76 -50.3 74.03 Favored 'General case' 0 C--N 1.385 2.114 0 O-C-N 120.658 -1.276 . . . . 0.0 110.062 171.331 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.474 ' O ' ' N ' ' P' ' 129' ' ' ARG . 15.5 mt-10 -54.3 -53.65 50.89 Favored 'General case' 0 C--N 1.379 1.887 0 CA-C-O 122.477 1.132 . . . . 0.0 109.014 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.578 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -39.94 -65.04 0.43 Allowed 'General case' 0 C--N 1.379 1.886 0 CA-C-N 111.96 -2.382 . . . . 0.0 108.76 177.46 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.878 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -63.78 -32.7 74.29 Favored 'General case' 0 C--N 1.394 2.519 0 CA-C-N 112.405 -2.18 . . . . 0.0 108.34 -170.794 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.765 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 7.3 t80 -68.76 -51.01 45.77 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-O 121.973 0.892 . . . . 0.0 110.373 173.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' P' ' 125' ' ' GLU . 8.9 mmm180 -62.36 -12.21 19.94 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.306 -1.77 . . . . 0.0 108.198 -165.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -107.75 -40.97 5.13 Favored 'General case' 0 C--N 1.379 1.878 0 C-N-CA 126.234 1.814 . . . . 0.0 107.626 -172.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.502 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.4 OUTLIER -156.11 97.89 1.83 Allowed 'General case' 0 C--N 1.387 2.22 0 CA-C-N 111.952 -2.385 . . . . 0.0 110.263 -153.164 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' P' P ' 132' ' ' ARG . . . . . 0.541 ' HG2' ' CD2' ' P' ' 133' ' ' TYR . 0.1 OUTLIER -76.98 -6.91 54.47 Favored 'General case' 0 C--N 1.394 2.501 0 CA-C-N 112.035 -2.348 . . . . 0.0 110.97 -163.968 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.563 ' CD1' ' CZ ' ' P' ' 161' ' ' ARG . 4.0 m-85 -161.6 112.42 1.68 Allowed 'General case' 0 C--N 1.381 1.946 0 CA-C-N 114.671 -1.15 . . . . 0.0 108.511 -154.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.611 HD22 ' HG3' ' P' ' 138' ' ' GLU . 30.3 mt -130.64 136.02 48.43 Favored 'General case' 0 C--N 1.396 2.599 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -156.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.52 156.11 25.43 Favored 'General case' 0 C--N 1.381 1.959 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 167.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.537 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.36 -50.2 88.65 Favored Pre-proline 0 CA--C 1.582 2.185 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -162.016 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.537 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 89.3 Cg_exo -57.23 -29.83 85.15 Favored 'Trans proline' 0 C--N 1.401 3.323 0 C-N-CA 120.836 1.024 . . . . 0.0 114.624 -174.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.611 ' HG3' HD22 ' P' ' 134' ' ' LEU . 1.6 mm-40 -54.29 -71.41 0.08 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-O 124.26 1.981 . . . . 0.0 106.48 161.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.933 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.56 -34.52 74.31 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 110.008 -3.269 . . . . 0.0 109.026 -155.35 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.626 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 7.4 mt-10 -52.3 -43.77 64.67 Favored 'General case' 0 C--N 1.38 1.908 0 CA-C-O 123.356 1.551 . . . . 0.0 108.03 174.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -63.27 -36.3 83.2 Favored 'General case' 0 C--N 1.38 1.911 0 CA-C-N 112.406 -2.179 . . . . 0.0 108.738 -168.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.878 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.1 tp -66.24 -42.8 88.09 Favored 'General case' 0 C--N 1.383 2.063 0 CA-C-O 122.987 1.375 . . . . 0.0 109.167 170.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.52 -34.58 67.16 Favored 'General case' 0 C--N 1.387 2.224 0 CA-C-N 112.742 -2.026 . . . . 0.0 108.183 172.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.607 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -71.38 -42.61 68.2 Favored 'General case' 0 C--N 1.388 2.263 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.395 -178.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 80.9 mt -68.63 -46.54 68.94 Favored 'General case' 0 C--N 1.38 1.917 0 CA-C-O 124.682 2.182 . . . . 0.0 108.226 -163.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.99 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.53 -13.01 8.27 Favored 'Isoleucine or valine' 0 C--N 1.389 2.302 0 CA-C-N 110.926 -2.852 . . . . 0.0 107.967 -168.366 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 82.18 35.5 0.07 Allowed 'General case' 0 C--N 1.381 1.956 0 CA-C-O 125.721 2.677 . . . . 0.0 107.652 152.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.99 HD12 HD11 ' P' ' 146' ' ' ILE . 8.6 mt -95.61 172.72 7.88 Favored 'General case' 0 C--N 1.397 2.635 0 CA-C-N 111.45 -2.614 . . . . 0.0 109.133 168.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.588 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.0 p -90.61 141.47 27.15 Favored Pre-proline 0 CA--C 1.589 2.462 0 CA-C-O 122.797 1.284 . . . . 0.0 108.267 166.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.545 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 0.4 OUTLIER -48.29 -47.0 21.13 Favored 'Trans proline' 0 C--N 1.405 3.502 0 C-N-CA 124.954 3.769 . . . . 0.0 115.424 -167.533 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' P' P ' 151' ' ' THR . . . . . 0.401 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -52.86 -31.03 37.13 Favored 'General case' 0 C--N 1.384 2.073 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.07 169.327 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.588 ' N ' ' O ' ' P' ' 149' ' ' THR . 46.8 mt-30 -74.66 -27.94 60.64 Favored 'General case' 0 C--N 1.392 2.42 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.709 HG13 ' CD2' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -64.15 -70.94 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.024 0 CA-C-N 122.116 2.235 . . . . 0.0 109.513 162.76 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.933 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.77 -59.57 0.4 Allowed 'General case' 0 C--N 1.387 2.199 0 CA-C-O 122.728 1.251 . . . . 0.0 110.583 -176.497 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 13.4 mm -56.2 -43.03 75.19 Favored 'Isoleucine or valine' 0 C--N 1.383 2.029 0 CA-C-N 112.995 -1.911 . . . . 0.0 109.112 -174.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.717 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.6 t90 -67.23 -31.58 72.04 Favored 'General case' 0 C--N 1.383 2.033 0 O-C-N 120.876 -1.14 . . . . 0.0 109.324 174.107 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.765 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 44.6 m-85 -75.55 -41.98 53.5 Favored 'General case' 0 C--O 1.275 2.406 0 O-C-N 121.053 -1.029 . . . . 0.0 111.888 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.443 ' N ' ' O ' ' P' ' 154' ' ' LYS . 51.4 mt-30 -49.5 -59.67 3.54 Favored 'General case' 0 C--N 1.378 1.826 0 O-C-N 119.296 -2.127 . . . . 0.0 107.005 169.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -55.83 -25.0 39.74 Favored 'General case' 0 C--N 1.389 2.295 0 CA-C-O 117.713 -1.137 . . . . 0.0 109.386 -166.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.535 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.1 t-160 -76.5 -46.84 24.97 Favored 'General case' 0 C--O 1.282 2.801 0 CA-C-N 121.213 1.824 . . . . 0.0 111.286 175.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.563 ' CZ ' ' CD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.378 1.841 0 CA-C-N 122.985 2.629 . . . . 0.0 110.543 -161.654 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.59 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.31 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -65.95 147.53 53.21 Favored 'General case' 0 C--N 1.382 2.011 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 -172.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.457 ' O ' ' N ' ' P' ' 122' ' ' TYR . 33.4 ttmt -42.65 -35.94 1.26 Allowed 'General case' 0 C--N 1.382 1.99 0 CA-C-N 113.547 -1.66 . . . . 0.0 109.594 -176.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.08 -68.12 0.21 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 124.078 1.894 . . . . 0.0 109.146 173.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.55 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.1 mt-30 -46.45 -50.58 16.62 Favored 'General case' 0 C--N 1.382 1.999 0 C-N-CA 127.166 2.186 . . . . 0.0 109.966 175.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.684 ' HA ' HD12 ' P' ' 124' ' ' LEU . 20.2 m -50.78 -57.26 8.82 Favored 'General case' 0 C--N 1.384 2.068 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 170.141 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.563 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.18 -46.25 68.87 Favored 'General case' 0 C--N 1.383 2.047 0 CA-C-O 122.329 1.061 . . . . 0.0 109.818 -170.217 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.959 ' CD ' HG22 ' P' ' 146' ' ' ILE . 6.5 mt-10 -66.86 -37.11 83.81 Favored 'General case' 0 C--N 1.379 1.872 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.496 178.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.759 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.2 mt -60.4 -51.24 70.34 Favored 'General case' 0 C--N 1.382 2.009 0 O-C-N 119.89 -1.756 . . . . 0.0 110.401 169.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.443 ' O ' ' N ' ' P' ' 129' ' ' ARG . 16.2 mt-10 -54.63 -52.88 60.89 Favored 'General case' 0 C--N 1.379 1.859 0 CA-C-O 122.434 1.111 . . . . 0.0 109.267 177.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.563 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -38.96 -67.62 0.2 Allowed 'General case' 0 C--N 1.379 1.891 0 CA-C-N 111.823 -2.444 . . . . 0.0 108.717 176.04 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.74 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.3 OUTLIER -62.28 -32.64 73.39 Favored 'General case' 0 C--N 1.393 2.462 0 CA-C-N 112.484 -2.144 . . . . 0.0 108.289 -170.117 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.804 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 12.6 t80 -68.8 -50.48 49.82 Favored 'General case' 0 C--N 1.388 2.247 0 CA-C-O 122.073 0.939 . . . . 0.0 110.77 174.353 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' P' ' 125' ' ' GLU . 8.6 mmm180 -62.33 -11.81 17.48 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.083 -1.871 . . . . 0.0 108.128 -167.059 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 130' ' ' GLN . . . . . 0.484 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 33.6 mt-30 -107.99 -40.46 5.23 Favored 'General case' 0 C--N 1.379 1.886 0 C-N-CA 126.378 1.871 . . . . 0.0 107.772 -172.091 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.5 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -155.19 102.48 2.3 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 111.943 -2.39 . . . . 0.0 109.501 -153.442 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' P' P ' 132' ' ' ARG . . . . . 0.644 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -77.15 -15.79 59.39 Favored 'General case' 0 C--N 1.387 2.205 0 CA-C-N 112.323 -2.217 . . . . 0.0 110.335 -165.629 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.775 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 2.6 m-30 -154.84 115.69 3.95 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.999 -1.455 . . . . 0.0 108.544 -158.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.504 HD22 ' HB3' ' P' ' 138' ' ' GLU . 21.1 mt -130.08 134.18 47.19 Favored 'General case' 0 C--N 1.398 2.717 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -157.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.2 154.11 25.62 Favored 'General case' 0 C--N 1.381 1.959 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 171.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.492 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.86 -45.89 99.58 Favored Pre-proline 0 CA--C 1.584 2.251 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -158.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 0.1 OUTLIER -52.55 -41.1 70.34 Favored 'Trans proline' 0 C--N 1.396 3.05 0 C-N-CA 122.631 2.22 . . . . 0.0 117.647 179.337 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.504 ' HB3' HD22 ' P' ' 134' ' ' LEU . 1.6 mm-40 -50.2 -69.45 0.11 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-O 123.509 1.623 . . . . 0.0 107.135 166.021 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.577 ' HB2' HG11 ' P' ' 153' ' ' VAL . 1.0 OUTLIER -69.12 -35.56 76.55 Favored 'General case' 0 C--N 1.389 2.291 0 CA-C-N 110.072 -3.24 . . . . 0.0 108.494 -158.339 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.63 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.2 mt-10 -53.29 -41.05 65.21 Favored 'General case' 0 C--N 1.38 1.926 0 CA-C-O 123.112 1.434 . . . . 0.0 108.539 176.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -64.67 -35.8 82.2 Favored 'General case' 0 C--N 1.38 1.921 0 CA-C-N 112.81 -1.996 . . . . 0.0 108.804 -169.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.74 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.3 tp -65.64 -42.99 90.84 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-O 123.211 1.482 . . . . 0.0 109.198 168.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.9 -33.89 67.38 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.429 -2.169 . . . . 0.0 108.227 174.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.629 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.7 m -73.28 -42.72 62.12 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 113.699 -1.591 . . . . 0.0 109.752 -178.197 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 78.7 mt -66.62 -48.02 70.79 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 124.659 2.171 . . . . 0.0 108.318 -165.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.986 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.56 -12.84 8.31 Favored 'Isoleucine or valine' 0 C--N 1.389 2.322 0 CA-C-N 110.821 -2.9 . . . . 0.0 107.933 -167.11 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 82.44 35.03 0.07 Allowed 'General case' 0 C--N 1.381 1.939 0 CA-C-O 125.755 2.693 . . . . 0.0 107.865 152.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.986 HD12 HD11 ' P' ' 146' ' ' ILE . 8.8 mt -96.17 170.81 9.0 Favored 'General case' 0 C--N 1.397 2.659 0 CA-C-N 111.571 -2.559 . . . . 0.0 109.382 169.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.643 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.2 p -92.46 140.15 24.04 Favored Pre-proline 0 CA--C 1.592 2.566 0 CA-C-O 122.738 1.256 . . . . 0.0 108.752 170.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.448 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 21.4 Cg_exo -55.08 -33.48 83.79 Favored 'Trans proline' 1 C--N 1.415 4.036 0 C-N-CA 122.902 2.401 . . . . 0.0 113.815 -160.234 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.21 -38.26 73.46 Favored 'General case' 0 C--N 1.382 2.003 0 C-N-CA 119.084 -1.046 . . . . 0.0 109.442 166.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.643 ' N ' ' O ' ' P' ' 149' ' ' THR . 49.1 mt-30 -69.36 -28.4 66.17 Favored 'General case' 0 C--N 1.387 2.214 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 -174.222 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.627 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.1 t -64.2 -71.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.186 0 CA-C-N 121.394 1.906 . . . . 0.0 109.259 164.259 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.627 ' N ' HG12 ' P' ' 153' ' ' VAL . 0.0 OUTLIER -34.69 -58.46 0.5 Allowed 'General case' 0 C--N 1.384 2.093 0 C-N-CA 125.012 1.325 . . . . 0.0 110.54 -176.175 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 28.8 mm -60.65 -38.85 79.69 Favored 'Isoleucine or valine' 0 C--N 1.381 1.969 0 CA-C-N 113.328 -1.76 . . . . 0.0 108.859 -172.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.759 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.1 t90 -67.66 -31.88 72.17 Favored 'General case' 0 C--N 1.384 2.07 0 O-C-N 121.168 -0.957 . . . . 0.0 109.451 172.209 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.804 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 62.9 m-85 -75.18 -40.14 59.63 Favored 'General case' 0 C--O 1.274 2.358 0 O-C-N 121.231 -0.918 . . . . 0.0 112.115 173.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.431 ' N ' ' O ' ' P' ' 154' ' ' LYS . 77.1 mt-30 -51.72 -61.76 2.05 Favored 'General case' 0 C--N 1.376 1.754 0 O-C-N 119.709 -1.869 . . . . 0.0 106.479 168.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -56.43 -24.19 43.62 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-O 117.446 -1.264 . . . . 0.0 109.448 -167.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.507 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.5 OUTLIER -78.33 -39.66 38.91 Favored 'General case' 0 C--O 1.282 2.785 0 CA-C-N 121.606 2.003 . . . . 0.0 111.489 177.425 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.775 ' HD3' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.265 1.903 0 CA-C-N 122.668 2.485 . . . . 0.0 111.137 -177.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.547 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.8 m-85 . . . . . 0 C--O 1.258 1.515 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' P' P ' 117' ' ' THR . . . . . 0.409 ' O ' ' N ' ' P' ' 121' ' ' THR . 1.2 p -65.88 147.64 53.05 Favored 'General case' 0 C--N 1.382 2.006 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -169.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -42.85 -36.56 1.53 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-N 113.843 -1.526 . . . . 0.0 109.286 -176.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.89 -65.54 0.55 Allowed 'General case' 0 C--N 1.382 2.014 0 CA-C-O 124.172 1.939 . . . . 0.0 109.261 174.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.566 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.0 mt-30 -50.96 -47.39 61.29 Favored 'General case' 0 C--N 1.381 1.967 0 CA-C-N 112.426 -2.17 . . . . 0.0 110.073 177.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.635 ' HA ' HD12 ' P' ' 124' ' ' LEU . 11.3 m -50.02 -57.83 6.76 Favored 'General case' 0 C--N 1.383 2.03 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 168.43 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.583 ' CE1' ' HG2' ' P' ' 126' ' ' ARG . 0.9 OUTLIER -52.86 -47.79 67.55 Favored 'General case' 0 C--N 1.383 2.038 0 CA-C-O 122.377 1.084 . . . . 0.0 110.017 -169.097 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.95 ' CD ' HG22 ' P' ' 146' ' ' ILE . 7.1 mt-10 -66.94 -35.86 80.93 Favored 'General case' 0 C--N 1.379 1.862 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.875 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.8 mt -60.43 -52.4 65.37 Favored 'General case' 0 C--N 1.383 2.043 0 O-C-N 120.044 -1.66 . . . . 0.0 110.592 168.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' P' ' 129' ' ' ARG . 15.8 mt-10 -53.77 -53.65 49.35 Favored 'General case' 0 C--N 1.379 1.854 0 CA-C-O 122.248 1.023 . . . . 0.0 108.874 177.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.583 ' HG2' ' CE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -38.05 -67.25 0.21 Allowed 'General case' 0 C--N 1.38 1.926 0 CA-C-N 111.683 -2.508 . . . . 0.0 108.679 176.403 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.725 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -64.14 -29.94 71.04 Favored 'General case' 0 C--N 1.394 2.501 0 CA-C-N 112.287 -2.233 . . . . 0.0 108.23 -169.897 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.8 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 12.3 t80 -69.44 -50.73 42.91 Favored 'General case' 0 C--N 1.389 2.29 0 O-C-N 121.134 -0.979 . . . . 0.0 110.956 172.368 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.45 ' N ' ' O ' ' P' ' 125' ' ' GLU . 10.1 mmm180 -62.28 -11.87 17.5 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.083 -1.872 . . . . 0.0 108.093 -166.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 130' ' ' GLN . . . . . 0.506 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 34.2 mt-30 -109.19 -39.74 5.16 Favored 'General case' 0 C--N 1.38 1.892 0 C-N-CA 126.355 1.862 . . . . 0.0 108.044 -171.546 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.505 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -153.15 109.36 3.35 Favored 'General case' 0 C--N 1.389 2.295 0 CA-C-N 112.24 -2.255 . . . . 0.0 109.217 -153.579 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -77.05 -19.77 56.73 Favored 'General case' 0 C--N 1.394 2.519 0 CA-C-N 112.171 -2.286 . . . . 0.0 110.806 -168.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.54 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 15.4 m-85 -159.82 114.34 2.31 Favored 'General case' 0 C--N 1.38 1.9 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.373 -153.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.614 HD22 ' HG3' ' P' ' 138' ' ' GLU . 27.1 mt -126.66 136.97 53.19 Favored 'General case' 0 C--N 1.399 2.754 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -158.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 155.16 25.93 Favored 'General case' 0 C--N 1.382 1.998 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 166.25 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.507 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.57 -49.62 91.2 Favored Pre-proline 0 CA--C 1.582 2.209 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.355 -161.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.507 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 81.3 Cg_exo -58.2 -28.69 84.99 Favored 'Trans proline' 0 C--N 1.401 3.297 0 C-N-CA 121.048 1.165 . . . . 0.0 114.894 -174.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.614 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.1 OUTLIER -54.03 -71.06 0.08 Allowed 'General case' 0 C--N 1.38 1.9 0 CA-C-O 124.704 2.192 . . . . 0.0 106.334 160.393 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.832 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.1 -40.14 82.66 Favored 'General case' 0 C--N 1.389 2.303 0 CA-C-N 109.965 -3.289 . . . . 0.0 108.885 -154.927 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.647 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 3.9 mt-10 -53.35 -39.17 63.93 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 123.163 1.459 . . . . 0.0 108.304 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -64.28 -35.46 80.91 Favored 'General case' 0 C--N 1.38 1.918 0 CA-C-N 112.945 -1.934 . . . . 0.0 108.732 -171.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.725 HD13 ' CG ' ' P' ' 127' ' ' ARG . 2.3 tp -65.47 -42.77 91.9 Favored 'General case' 0 C--N 1.383 2.023 0 CA-C-O 123.223 1.487 . . . . 0.0 109.038 168.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -57.04 -34.71 68.5 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-N 112.38 -2.191 . . . . 0.0 108.592 174.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.617 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 0.9 OUTLIER -73.51 -43.22 60.56 Favored 'General case' 0 C--N 1.387 2.225 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.19 -179.443 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' P' P ' 145' ' ' LEU . . . . . 0.725 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 75.0 mt -66.19 -48.06 71.9 Favored 'General case' 0 C--N 1.379 1.888 0 CA-C-O 124.743 2.211 . . . . 0.0 107.954 -164.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.987 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -94.68 -17.03 7.26 Favored 'Isoleucine or valine' 0 C--N 1.385 2.145 0 CA-C-N 110.544 -3.025 . . . . 0.0 107.84 -172.104 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' P' P ' 147' ' ' ARG . . . . . 0.725 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.0 OUTLIER 81.19 37.21 0.08 Allowed 'General case' 0 C--N 1.385 2.126 0 CA-C-N 111.494 -2.594 . . . . 0.0 108.112 152.777 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.987 HD12 HD11 ' P' ' 146' ' ' ILE . 6.1 mt -95.24 168.08 10.96 Favored 'General case' 0 C--N 1.39 2.35 0 CA-C-N 112.13 -2.305 . . . . 0.0 109.416 168.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.643 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.0 p -88.12 143.97 33.73 Favored Pre-proline 0 CA--C 1.587 2.392 0 CA-C-O 122.986 1.374 . . . . 0.0 108.273 172.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.402 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 1.3 Cg_endo -59.73 -38.44 80.85 Favored 'Trans proline' 1 C--N 1.415 4.031 0 C-N-CA 122.715 2.277 . . . . 0.0 112.073 -155.568 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' P' P ' 151' ' ' THR . . . . . 0.518 HG22 HG12 ' P' ' 155' ' ' ILE . 0.4 OUTLIER -57.81 -29.47 64.93 Favored 'General case' 0 C--N 1.385 2.129 0 CA-C-O 118.081 -0.961 . . . . 0.0 110.343 167.754 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.643 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -73.64 -28.04 61.58 Favored 'General case' 0 C--N 1.388 2.258 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.618 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.3 t -64.38 -72.53 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 122.019 2.19 . . . . 0.0 109.439 164.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.832 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.27 -57.44 0.49 Allowed 'General case' 0 C--N 1.385 2.148 0 C-N-CA 125.188 1.395 . . . . 0.0 111.017 -177.698 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.518 HG12 HG22 ' P' ' 151' ' ' THR . 0.7 OUTLIER -53.04 -47.81 53.71 Favored 'Isoleucine or valine' 0 C--N 1.386 2.17 0 CA-C-N 112.86 -1.973 . . . . 0.0 108.967 -176.45 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.875 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.4 t90 -66.19 -31.06 71.67 Favored 'General case' 0 C--N 1.382 1.98 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.8 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 69.0 m-85 -74.82 -39.87 61.4 Favored 'General case' 0 C--O 1.274 2.373 0 O-C-N 121.257 -0.902 . . . . 0.0 112.057 174.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' P' ' 154' ' ' LYS . 24.7 mt-30 -49.71 -63.87 0.98 Allowed 'General case' 0 C--N 1.377 1.762 0 O-C-N 119.558 -1.964 . . . . 0.0 106.953 167.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -57.48 -13.55 3.79 Favored 'General case' 0 C--N 1.388 2.253 0 CA-C-O 118.129 -0.938 . . . . 0.0 111.024 -165.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.559 ' ND1' ' CE2' ' P' ' 128' ' ' PHE . 31.5 t-80 -78.44 -56.45 4.43 Favored 'General case' 0 C--O 1.279 2.655 0 CA-C-N 120.46 1.482 . . . . 0.0 110.92 167.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.54 ' HD2' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.016 0 O-C-N 118.639 -2.538 . . . . 0.0 110.587 -155.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.495 ' CE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 . . . . . 0 C--O 1.257 1.487 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' P' P ' 117' ' ' THR . . . . . 0.402 ' O ' ' N ' ' P' ' 121' ' ' THR . 1.3 p -65.62 147.56 53.2 Favored 'General case' 0 C--N 1.382 1.98 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -166.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' P' ' 122' ' ' TYR . 36.6 ttmt -42.62 -36.0 1.26 Allowed 'General case' 0 C--N 1.381 1.963 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.489 -176.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.04 -67.78 0.23 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 123.995 1.855 . . . . 0.0 109.207 173.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.569 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.6 mt-30 -47.68 -50.56 24.49 Favored 'General case' 0 C--N 1.382 2.014 0 CA-C-N 112.47 -2.15 . . . . 0.0 110.217 176.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.592 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.1 m -49.44 -58.73 4.61 Favored 'General case' 0 C--N 1.383 2.026 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 169.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.575 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 1.2 t80 -52.97 -47.2 68.33 Favored 'General case' 0 C--N 1.384 2.071 0 CA-C-O 122.435 1.112 . . . . 0.0 109.825 -169.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.977 ' CD ' HG22 ' P' ' 146' ' ' ILE . 3.2 mt-10 -66.81 -36.7 82.99 Favored 'General case' 0 C--O 1.265 1.91 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.063 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.794 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.7 mt -60.56 -52.19 66.21 Favored 'General case' 0 C--N 1.382 1.984 0 O-C-N 119.521 -1.987 . . . . 0.0 109.88 169.033 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.47 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.2 mt-10 -53.77 -51.35 63.71 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-O 122.245 1.021 . . . . 0.0 109.213 178.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.575 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.6 -69.68 0.12 Allowed 'General case' 0 C--N 1.379 1.874 0 CA-C-N 111.767 -2.47 . . . . 0.0 108.69 175.045 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.657 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.4 OUTLIER -58.2 -38.09 76.07 Favored 'General case' 0 C--N 1.391 2.398 0 CA-C-N 112.999 -1.91 . . . . 0.0 108.288 -171.768 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.83 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 20.8 t80 -69.71 -45.5 68.1 Favored 'General case' 0 C--N 1.381 1.958 0 O-C-N 121.559 -0.713 . . . . 0.0 110.817 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' P' ' 125' ' ' GLU . 13.8 mmm180 -62.33 -15.98 51.41 Favored 'General case' 0 C--N 1.38 1.915 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 -170.263 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 130' ' ' GLN . . . . . 0.425 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 37.0 mt-30 -104.41 -37.9 7.02 Favored 'General case' 0 C--N 1.38 1.908 0 C-N-CA 126.776 2.031 . . . . 0.0 107.503 -168.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.527 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -155.34 107.75 2.69 Favored 'General case' 0 C--N 1.387 2.232 0 CA-C-N 111.914 -2.403 . . . . 0.0 108.84 -153.86 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.86 -21.12 60.22 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 112.218 -2.265 . . . . 0.0 110.873 -167.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.536 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 33.8 m-85 -159.33 112.84 2.28 Favored 'General case' 0 C--N 1.38 1.901 0 CA-C-N 113.305 -1.77 . . . . 0.0 108.14 -153.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.657 HD11 ' CD ' ' P' ' 127' ' ' ARG . 18.6 mt -124.63 135.83 53.42 Favored 'General case' 0 C--N 1.396 2.611 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 -158.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.12 155.05 26.44 Favored 'General case' 0 C--N 1.381 1.973 0 O-C-N 120.612 -1.305 . . . . 0.0 107.498 167.22 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.513 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.42 -49.62 91.51 Favored Pre-proline 0 CA--C 1.583 2.22 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 -160.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.513 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 79.7 Cg_exo -58.15 -30.03 89.21 Favored 'Trans proline' 0 C--N 1.402 3.342 0 N-CA-C 114.87 1.065 . . . . 0.0 114.87 -175.089 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.586 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.3 OUTLIER -54.37 -69.46 0.13 Allowed 'General case' 0 C--N 1.38 1.912 0 CA-C-O 124.54 2.114 . . . . 0.0 106.378 161.164 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.93 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.08 -39.5 82.91 Favored 'General case' 0 C--N 1.392 2.428 0 CA-C-N 109.942 -3.299 . . . . 0.0 108.657 -154.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.633 ' O ' ' N ' ' P' ' 144' ' ' SER . 4.0 mt-10 -53.13 -38.03 62.31 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-O 122.498 1.142 . . . . 0.0 108.568 178.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -64.22 -37.03 86.03 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-N 113.142 -1.845 . . . . 0.0 109.347 -174.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.63 ' O ' HG23 ' P' ' 146' ' ' ILE . 0.4 OUTLIER -57.86 -47.33 83.02 Favored 'General case' 0 C--N 1.385 2.151 0 CA-C-O 123.125 1.44 . . . . 0.0 108.719 164.804 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -62.73 -31.71 72.69 Favored 'General case' 0 C--N 1.387 2.208 0 CA-C-N 112.104 -2.316 . . . . 0.0 109.087 -179.376 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.633 ' N ' ' O ' ' P' ' 140' ' ' GLU . 5.9 t -74.45 -41.95 59.94 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-N 114.243 -1.344 . . . . 0.0 109.037 -178.256 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 145' ' ' LEU . . . . . 0.462 HD13 ' OE1' ' P' ' 123' ' ' GLU . 39.5 mt -63.86 -46.62 84.18 Favored 'General case' 0 C--N 1.381 1.962 0 CA-C-O 124.52 2.105 . . . . 0.0 108.269 -167.043 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 1.022 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -101.41 -12.67 8.55 Favored 'Isoleucine or valine' 0 C--N 1.388 2.25 0 CA-C-N 110.739 -2.937 . . . . 0.0 108.155 -165.437 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 82.08 34.42 0.08 Allowed 'General case' 0 C--N 1.383 2.047 0 CA-C-O 125.547 2.594 . . . . 0.0 108.147 153.294 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 1.022 HD12 HD11 ' P' ' 146' ' ' ILE . 7.6 mt -96.49 169.47 9.88 Favored 'General case' 0 C--N 1.397 2.637 0 CA-C-N 111.652 -2.522 . . . . 0.0 109.475 169.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.613 ' O ' ' N ' ' P' ' 152' ' ' GLN . 21.5 p -91.31 145.29 31.17 Favored Pre-proline 0 CA--C 1.588 2.435 0 CA-C-O 122.91 1.338 . . . . 0.0 108.735 171.144 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.426 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 2.2 Cg_endo -62.07 -37.43 64.1 Favored 'Trans proline' 1 C--N 1.414 4.021 0 C-N-CA 122.682 2.255 . . . . 0.0 113.128 -155.864 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.92 -35.62 61.86 Favored 'General case' 0 C--N 1.384 2.066 0 C-N-CA 119.676 -0.81 . . . . 0.0 109.671 165.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.613 ' N ' ' O ' ' P' ' 149' ' ' THR . 44.3 mt-30 -70.48 -27.42 64.2 Favored 'General case' 0 C--N 1.389 2.296 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 -177.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.612 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.3 t -64.68 -71.84 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.105 0 CA-C-N 121.487 1.949 . . . . 0.0 109.666 163.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.93 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.8 -59.61 0.4 Allowed 'General case' 0 C--N 1.386 2.188 0 CA-C-O 122.668 1.223 . . . . 0.0 110.656 -178.163 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 10.2 mm -56.25 -41.89 71.85 Favored 'Isoleucine or valine' 0 C--N 1.381 1.948 0 CA-C-N 113.114 -1.857 . . . . 0.0 108.984 -174.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.794 ' HB3' HD22 ' P' ' 124' ' ' LEU . 7.4 t90 -68.24 -32.24 72.3 Favored 'General case' 0 C--N 1.382 1.98 0 O-C-N 120.962 -1.086 . . . . 0.0 109.637 173.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.83 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 59.6 m-85 -74.81 -40.48 61.07 Favored 'General case' 0 C--O 1.276 2.484 0 O-C-N 120.932 -1.105 . . . . 0.0 112.074 174.342 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' P' ' 154' ' ' LYS . 25.3 mt-30 -48.94 -64.19 0.88 Allowed 'General case' 0 C--N 1.377 1.795 0 O-C-N 119.543 -1.973 . . . . 0.0 106.674 167.097 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -55.94 -23.34 31.37 Favored 'General case' 0 C--N 1.389 2.285 0 CA-C-O 117.579 -1.2 . . . . 0.0 109.706 -163.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.527 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 3.6 t-160 -76.34 -47.64 22.78 Favored 'General case' 0 C--O 1.281 2.758 0 CA-C-N 121.239 1.836 . . . . 0.0 110.949 177.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.536 ' CD ' ' CE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.933 0 CA-C-N 122.815 2.552 . . . . 0.0 110.619 -161.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.668 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 1.1 m-85 . . . . . 0 C--O 1.255 1.388 0 N-CA-C 107.832 -1.174 . . . . 0.0 107.832 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.41 148.03 52.42 Favored 'General case' 0 C--N 1.382 1.99 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -168.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' P' ' 122' ' ' TYR . 37.2 ttmt -42.15 -36.02 1.08 Allowed 'General case' 0 C--N 1.381 1.966 0 CA-C-N 114.037 -1.438 . . . . 0.0 109.29 -177.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.93 -67.72 0.24 Allowed 'General case' 0 C--N 1.382 1.982 0 CA-C-O 124.217 1.961 . . . . 0.0 109.104 173.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.541 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.7 mt-30 -48.56 -48.05 39.02 Favored 'General case' 0 C--N 1.382 2.008 0 CA-C-N 112.419 -2.173 . . . . 0.0 110.052 177.188 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.666 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.9 m -52.05 -56.37 14.78 Favored 'General case' 0 C--N 1.383 2.027 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 169.42 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.663 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.2 t80 -53.16 -46.68 68.99 Favored 'General case' 0 C--N 1.383 2.023 0 CA-C-O 122.325 1.059 . . . . 0.0 110.15 -170.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.648 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.1 OUTLIER -66.29 -39.17 89.19 Favored 'General case' 0 C--N 1.38 1.894 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.219 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.805 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -60.16 -49.74 76.42 Favored 'General case' 0 C--N 1.385 2.142 0 O-C-N 120.691 -1.255 . . . . 0.0 109.727 172.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.54 ' O ' ' N ' ' P' ' 129' ' ' ARG . 13.3 mt-10 -55.17 -53.3 57.78 Favored 'General case' 0 C--N 1.38 1.909 0 CA-C-O 122.509 1.147 . . . . 0.0 109.461 176.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.663 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.9 -69.23 0.14 Allowed 'General case' 0 C--N 1.378 1.825 0 CA-C-N 111.897 -2.41 . . . . 0.0 108.665 177.862 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.848 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -57.49 -37.25 72.62 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 112.686 -2.052 . . . . 0.0 108.342 -173.334 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.827 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 24.7 t80 -70.0 -45.98 66.13 Favored 'General case' 0 C--N 1.38 1.927 0 CA-C-O 121.58 0.705 . . . . 0.0 110.752 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.54 ' N ' ' O ' ' P' ' 125' ' ' GLU . 7.6 mmm180 -62.54 -14.45 42.16 Favored 'General case' 0 C--N 1.381 1.941 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -169.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 130' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' P' ' 126' ' ' ARG . 39.4 mt-30 -107.67 -37.84 6.04 Favored 'General case' 0 C--N 1.38 1.91 0 C-N-CA 126.607 1.963 . . . . 0.0 107.687 -167.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.493 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -154.2 105.78 2.73 Favored 'General case' 0 C--N 1.388 2.273 0 CA-C-N 112.018 -2.355 . . . . 0.0 108.83 -153.552 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' P' P ' 132' ' ' ARG . . . . . 0.745 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 3.2 mtt85 -77.36 -18.31 57.48 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 111.841 -2.436 . . . . 0.0 110.474 -169.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.745 ' HD1' ' O ' ' P' ' 132' ' ' ARG . 4.1 m-30 -154.66 111.25 3.28 Favored 'General case' 0 C--N 1.38 1.921 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.3 -154.198 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.614 HD22 ' HG3' ' P' ' 138' ' ' GLU . 31.5 mt -126.13 136.66 53.15 Favored 'General case' 0 C--N 1.397 2.65 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -161.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.54 155.31 25.8 Favored 'General case' 0 C--N 1.382 1.989 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 166.009 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.509 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.59 -49.43 92.09 Favored Pre-proline 0 CA--C 1.583 2.228 0 C-N-CA 120.049 -0.661 . . . . 0.0 109.347 -161.628 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 82.9 Cg_exo -58.15 -28.64 84.62 Favored 'Trans proline' 0 C--N 1.401 3.31 0 C-N-CA 121.001 1.134 . . . . 0.0 114.969 -175.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.614 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -53.85 -71.06 0.08 Allowed 'General case' 0 C--N 1.38 1.933 0 CA-C-O 124.524 2.107 . . . . 0.0 106.44 160.201 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.91 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.33 -39.66 81.87 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 109.969 -3.287 . . . . 0.0 108.79 -154.928 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.653 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.5 mt-10 -53.28 -39.3 63.82 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-O 123.177 1.465 . . . . 0.0 108.42 177.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -63.67 -35.29 80.04 Favored 'General case' 0 C--N 1.379 1.885 0 CA-C-N 112.846 -1.979 . . . . 0.0 108.633 -171.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.848 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.4 tp -65.95 -42.7 89.65 Favored 'General case' 0 C--N 1.383 2.056 0 CA-C-O 123.333 1.54 . . . . 0.0 109.186 169.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.76 -34.33 67.47 Favored 'General case' 0 C--N 1.39 2.334 0 CA-C-N 112.287 -2.233 . . . . 0.0 108.378 174.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.578 ' N ' ' O ' ' P' ' 140' ' ' GLU . 2.6 t -73.35 -43.6 60.4 Favored 'General case' 0 C--N 1.387 2.237 0 CA-C-N 114.242 -1.344 . . . . 0.0 110.296 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.99 -47.72 73.59 Favored 'General case' 0 C--N 1.378 1.847 0 CA-C-O 124.895 2.283 . . . . 0.0 107.922 -163.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.985 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.66 -16.83 7.17 Favored 'Isoleucine or valine' 0 C--N 1.385 2.125 0 CA-C-N 110.482 -3.054 . . . . 0.0 107.761 -171.767 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 6.4 mmt180 81.31 37.36 0.08 Allowed 'General case' 0 C--N 1.384 2.095 0 CA-C-N 111.566 -2.561 . . . . 0.0 108.111 152.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.985 HD12 HD11 ' P' ' 146' ' ' ILE . 6.4 mt -95.27 167.99 11.01 Favored 'General case' 0 C--N 1.391 2.391 0 CA-C-N 112.179 -2.282 . . . . 0.0 109.46 168.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.647 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -88.51 144.07 33.15 Favored Pre-proline 0 CA--C 1.588 2.404 0 CA-C-O 122.95 1.357 . . . . 0.0 108.299 173.139 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.409 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 1.8 Cg_endo -60.28 -38.38 75.93 Favored 'Trans proline' 1 C--N 1.414 4.02 0 C-N-CA 122.736 2.291 . . . . 0.0 112.416 -155.436 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' P' P ' 151' ' ' THR . . . . . 0.504 HG22 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -57.05 -29.37 63.35 Favored 'General case' 0 C--N 1.384 2.103 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.203 167.255 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.647 ' N ' ' O ' ' P' ' 149' ' ' THR . 43.9 mt-30 -74.08 -28.36 61.35 Favored 'General case' 0 C--N 1.388 2.28 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.628 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.1 t -64.29 -71.44 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.077 0 CA-C-N 122.074 2.215 . . . . 0.0 109.399 164.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.91 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.36 -59.35 0.45 Allowed 'General case' 0 C--N 1.386 2.154 0 CA-C-O 122.969 1.366 . . . . 0.0 110.853 -177.518 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.504 HG12 HG22 ' P' ' 151' ' ' THR . 0.5 OUTLIER -52.43 -47.19 47.49 Favored 'Isoleucine or valine' 0 C--N 1.389 2.309 0 CA-C-N 112.653 -2.067 . . . . 0.0 108.7 -176.121 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.805 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.2 t90 -66.58 -32.13 73.28 Favored 'General case' 0 C--N 1.382 2.013 0 O-C-N 121.432 -0.792 . . . . 0.0 109.144 177.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.827 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 63.7 m-85 -75.57 -40.04 57.26 Favored 'General case' 0 C--O 1.275 2.419 0 O-C-N 120.962 -1.086 . . . . 0.0 112.275 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -46.91 -66.62 0.38 Allowed 'General case' 0 C--N 1.376 1.737 0 O-C-N 119.44 -2.038 . . . . 0.0 107.171 165.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -56.01 -23.81 35.26 Favored 'General case' 0 C--N 1.391 2.403 0 CA-C-N 113.994 -1.457 . . . . 0.0 109.324 -161.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.557 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.9 OUTLIER -78.87 -40.11 33.38 Favored 'General case' 0 C--O 1.288 3.116 0 CA-C-N 121.249 1.84 . . . . 0.0 111.78 174.377 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.686 ' CD ' ' HE1' ' P' ' 133' ' ' TYR 0.278 40.0 mtm180 . . . . . 0 C--O 1.271 2.213 0 CA-C-N 123.588 2.904 . . . . 0.0 110.531 -176.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.518 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.5 OUTLIER . . . . . 0 C--O 1.253 1.24 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.16 149.07 51.0 Favored 'General case' 0 C--N 1.383 2.06 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 -175.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.43 ' O ' ' N ' ' P' ' 122' ' ' TYR . 35.4 ttmt -44.85 -36.35 3.23 Favored 'General case' 0 C--N 1.382 1.981 0 CA-C-N 113.165 -1.834 . . . . 0.0 109.219 -178.295 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.0 -63.78 1.03 Allowed 'General case' 0 C--N 1.382 2.008 0 CA-C-O 124.266 1.984 . . . . 0.0 109.22 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.56 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.0 mt-30 -52.33 -43.17 64.42 Favored 'General case' 0 C--N 1.382 1.989 0 CA-C-N 112.407 -2.179 . . . . 0.0 109.734 177.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.592 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.9 m -54.39 -55.49 28.09 Favored 'General case' 0 C--N 1.381 1.965 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 169.408 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.672 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.6 OUTLIER -53.04 -47.57 68.28 Favored 'General case' 0 C--N 1.383 2.045 0 CA-C-O 122.622 1.201 . . . . 0.0 110.003 -169.805 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.715 ' HB2' HD11 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -66.52 -38.38 87.08 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 113.864 -1.516 . . . . 0.0 108.004 179.936 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.795 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.1 mt -61.05 -50.56 72.82 Favored 'General case' 0 C--N 1.385 2.12 0 O-C-N 120.169 -1.582 . . . . 0.0 109.544 171.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.546 ' O ' ' N ' ' P' ' 129' ' ' ARG . 13.4 mt-10 -55.14 -44.65 75.29 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 122.756 1.265 . . . . 0.0 109.4 178.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.672 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -49.23 -66.77 0.34 Allowed 'General case' 0 C--N 1.377 1.795 0 CA-C-N 112.08 -2.327 . . . . 0.0 108.405 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.673 ' HB3' HD11 ' P' ' 134' ' ' LEU . 4.0 mmt85 -58.47 -36.01 73.07 Favored 'General case' 0 C--N 1.381 1.97 0 CA-C-N 113.29 -1.777 . . . . 0.0 109.61 -177.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.688 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 11.5 t80 -67.44 -51.81 47.12 Favored 'General case' 0 C--N 1.385 2.141 0 CA-C-N 119.627 1.103 . . . . 0.0 110.266 174.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' P' ' 125' ' ' GLU . 0.2 OUTLIER -62.79 -14.82 49.71 Favored 'General case' 0 C--N 1.379 1.889 0 CA-C-N 112.815 -1.993 . . . . 0.0 108.203 -164.466 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -104.61 -40.09 6.14 Favored 'General case' 0 C--N 1.378 1.846 0 C-N-CA 126.327 1.851 . . . . 0.0 106.966 -171.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.519 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.5 OUTLIER -155.74 98.73 1.95 Allowed 'General case' 0 C--N 1.385 2.145 0 CA-C-N 111.952 -2.385 . . . . 0.0 110.003 -153.2 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' P' P ' 132' ' ' ARG . . . . . 0.5 ' HG2' ' CD2' ' P' ' 133' ' ' TYR . 0.1 OUTLIER -76.53 -6.72 53.06 Favored 'General case' 0 C--N 1.394 2.523 0 CA-C-N 112.133 -2.303 . . . . 0.0 110.985 -162.164 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.515 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 6.0 m-85 -162.68 108.51 1.19 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.0 -156.282 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.673 HD11 ' HB3' ' P' ' 127' ' ' ARG . 15.0 mt -122.44 135.65 54.72 Favored 'General case' 0 C--N 1.4 2.764 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -154.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.23 154.52 25.37 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 169.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.511 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.92 -49.23 94.5 Favored Pre-proline 0 CA--C 1.583 2.249 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.438 -161.144 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.511 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 81.9 Cg_exo -58.7 -29.61 90.0 Favored 'Trans proline' 0 C--N 1.401 3.341 0 N-CA-C 115.016 1.122 . . . . 0.0 115.016 -173.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.591 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -54.89 -70.48 0.1 Allowed 'General case' 0 C--N 1.382 2.006 0 CA-C-O 124.754 2.216 . . . . 0.0 106.31 161.905 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 1.004 ' NH2' ' HG3' ' P' ' 154' ' ' LYS . 2.0 ptt85 -66.85 -40.63 87.98 Favored 'General case' 0 C--N 1.393 2.476 0 CA-C-N 109.97 -3.287 . . . . 0.0 108.684 -155.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.627 ' O ' ' N ' ' P' ' 144' ' ' SER . 3.5 mt-10 -53.57 -41.01 66.09 Favored 'General case' 0 C--N 1.38 1.931 0 O-C-N 120.68 -1.262 . . . . 0.0 108.486 176.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -63.71 -37.89 89.05 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 112.933 -1.939 . . . . 0.0 109.15 -172.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.715 HD11 ' HB2' ' P' ' 123' ' ' GLU . 0.8 OUTLIER -58.1 -45.78 86.65 Favored 'General case' 0 C--N 1.386 2.172 0 CA-C-O 123.136 1.446 . . . . 0.0 109.056 167.278 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.597 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -62.87 -33.18 74.74 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 112.175 -2.284 . . . . 0.0 109.093 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.627 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.6 OUTLIER -73.66 -39.76 64.2 Favored 'General case' 0 C--N 1.384 2.101 0 CA-C-N 114.071 -1.422 . . . . 0.0 109.471 -177.52 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 40.1 mt -66.87 -47.41 71.97 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-O 124.57 2.128 . . . . 0.0 108.491 -166.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.999 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -98.41 -12.74 8.29 Favored 'Isoleucine or valine' 0 C--N 1.389 2.312 0 CA-C-N 110.87 -2.877 . . . . 0.0 107.954 -166.932 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 82.34 35.43 0.07 Allowed 'General case' 0 C--N 1.381 1.959 0 CA-C-O 125.774 2.702 . . . . 0.0 107.788 153.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.999 HD12 HD11 ' P' ' 146' ' ' ILE . 7.7 mt -96.17 170.28 9.37 Favored 'General case' 0 C--N 1.397 2.642 0 CA-C-N 111.54 -2.573 . . . . 0.0 109.42 168.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.618 ' O ' ' N ' ' P' ' 152' ' ' GLN . 19.2 p -92.93 144.65 28.79 Favored Pre-proline 0 CA--C 1.59 2.484 0 CA-C-O 123.168 1.461 . . . . 0.0 108.977 171.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.483 ' HB2' ' NH1' ' P' ' 139' ' ' ARG . 1.2 Cg_endo -58.76 -38.98 86.13 Favored 'Trans proline' 1 C--N 1.416 4.096 0 C-N-CA 122.616 2.211 . . . . 0.0 113.064 -156.093 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -34.89 62.75 Favored 'General case' 0 C--N 1.383 2.048 0 C-N-CA 119.945 -0.702 . . . . 0.0 109.755 167.01 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.618 ' N ' ' O ' ' P' ' 149' ' ' THR . 46.1 mt-30 -69.89 -27.92 65.2 Favored 'General case' 0 C--N 1.389 2.295 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 -176.584 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.602 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.4 t -64.39 -72.37 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.122 0 CA-C-N 121.273 1.852 . . . . 0.0 109.629 164.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 1.004 ' HG3' ' NH2' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.26 -55.3 0.51 Allowed 'General case' 0 C--N 1.383 2.065 0 C-N-CA 124.975 1.31 . . . . 0.0 110.536 -176.402 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 11.3 mm -61.49 -40.57 86.87 Favored 'Isoleucine or valine' 0 C--N 1.383 2.041 0 CA-C-N 113.999 -1.455 . . . . 0.0 109.481 -173.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.795 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.3 t90 -67.37 -31.53 71.83 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 121.168 -0.957 . . . . 0.0 109.195 172.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.688 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 30.1 m-85 -75.42 -42.85 52.59 Favored 'General case' 0 C--O 1.274 2.383 0 O-C-N 121.132 -0.98 . . . . 0.0 111.871 175.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -49.27 -60.37 2.87 Favored 'General case' 0 C--N 1.378 1.807 0 O-C-N 119.51 -1.994 . . . . 0.0 107.117 169.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -56.01 -24.99 42.44 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-O 117.677 -1.154 . . . . 0.0 109.494 -166.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.552 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 3.3 t-160 -77.15 -45.45 26.74 Favored 'General case' 0 C--O 1.284 2.88 0 CA-C-N 121.374 1.897 . . . . 0.0 111.479 178.344 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.515 ' CD ' ' CE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 1.988 0 CA-C-N 122.586 2.448 . . . . 0.0 109.513 -164.007 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.585 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.251 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.84 148.58 50.99 Favored 'General case' 0 C--N 1.384 2.105 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 -174.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.405 ' O ' ' N ' ' P' ' 122' ' ' TYR . 22.9 ttmt -44.9 -36.72 3.47 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-N 113.134 -1.848 . . . . 0.0 109.17 -177.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 119' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' P' ' 122' ' ' TYR . . . -53.35 -62.06 1.89 Allowed 'General case' 0 C--N 1.383 2.046 0 CA-C-O 124.242 1.973 . . . . 0.0 109.242 174.57 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 82.0 mt-30 -54.48 -45.55 73.24 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 112.538 -2.119 . . . . 0.0 109.872 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.58 ' HA ' HD12 ' P' ' 124' ' ' LEU . 10.7 m -49.74 -56.68 9.35 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 168.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.722 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.4 OUTLIER -52.94 -48.27 67.47 Favored 'General case' 0 C--N 1.382 2.01 0 CA-C-O 122.609 1.195 . . . . 0.0 110.052 -168.985 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.705 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.75 -37.1 83.96 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.113 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.755 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.9 mt -60.52 -51.86 67.66 Favored 'General case' 0 C--N 1.384 2.086 0 O-C-N 120.281 -1.512 . . . . 0.0 109.493 170.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' P' ' 129' ' ' ARG . 10.2 mt-10 -55.35 -48.97 73.44 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-O 122.686 1.231 . . . . 0.0 109.598 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.722 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.92 -67.52 0.25 Allowed 'General case' 0 C--N 1.378 1.814 0 CA-C-N 112.191 -2.277 . . . . 0.0 109.14 174.954 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.575 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.5 OUTLIER -60.33 -37.87 81.98 Favored 'General case' 0 C--N 1.39 2.37 0 CA-C-N 112.388 -2.187 . . . . 0.0 108.191 -171.345 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.807 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 15.7 t80 -69.94 -47.59 61.74 Favored 'General case' 0 C--N 1.381 1.976 0 O-C-N 121.409 -0.807 . . . . 0.0 110.183 177.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.552 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 4.6 mmm180 -62.35 -20.04 63.98 Favored 'General case' 0 C--N 1.38 1.927 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -168.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -91.58 -42.55 10.16 Favored 'General case' 0 C--N 1.379 1.85 0 CA-C-O 124.126 1.917 . . . . 0.0 106.935 -174.095 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.438 ' HG2' ' CD2' ' P' ' 134' ' ' LEU . 2.6 tp-100 -152.81 123.87 7.5 Favored 'General case' 0 C--N 1.386 2.169 0 CA-C-N 111.422 -2.626 . . . . 0.0 110.313 -155.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 132' ' ' ARG . . . . . 0.526 ' HG2' ' CG ' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -79.29 -23.83 43.31 Favored 'General case' 0 C--N 1.386 2.166 0 CA-C-N 112.784 -2.007 . . . . 0.0 110.8 -173.172 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.657 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 1.0 OUTLIER -155.22 112.21 3.28 Favored 'General case' 0 C--N 1.377 1.798 0 CA-C-O 123.472 1.606 . . . . 0.0 108.986 -152.987 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.613 HD22 ' HG3' ' P' ' 138' ' ' GLU . 27.3 mt -123.22 134.79 54.1 Favored 'General case' 0 C--N 1.405 3.011 0 CA-C-N 112.598 -2.092 . . . . 0.0 108.042 -160.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.08 155.24 26.39 Favored 'General case' 0 C--N 1.382 1.988 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 167.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.537 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.46 -49.42 92.44 Favored Pre-proline 0 CA--C 1.583 2.244 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.233 -160.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.537 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 76.7 Cg_exo -58.63 -29.23 88.6 Favored 'Trans proline' 0 C--N 1.401 3.332 0 C-N-CA 121.057 1.171 . . . . 0.0 115.041 -175.454 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.613 ' HG3' HD22 ' P' ' 134' ' ' LEU . 2.4 mm-40 -54.02 -70.43 0.1 Allowed 'General case' 0 C--N 1.38 1.896 0 CA-C-O 124.624 2.154 . . . . 0.0 106.456 160.022 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.875 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.18 -39.15 82.6 Favored 'General case' 0 C--N 1.39 2.368 0 CA-C-N 109.907 -3.315 . . . . 0.0 108.75 -154.592 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.62 ' O ' ' N ' ' P' ' 144' ' ' SER . 5.1 mt-10 -53.36 -39.02 63.83 Favored 'General case' 0 C--N 1.38 1.91 0 CA-C-O 122.61 1.195 . . . . 0.0 108.505 177.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -63.54 -37.13 86.13 Favored 'General case' 0 C--N 1.379 1.879 0 CA-C-N 113.016 -1.902 . . . . 0.0 109.322 -173.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.635 ' CD1' HD13 ' P' ' 146' ' ' ILE . 0.7 OUTLIER -58.7 -46.12 87.98 Favored 'General case' 0 C--N 1.387 2.201 0 CA-C-O 122.974 1.368 . . . . 0.0 108.87 166.287 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.38 -31.71 72.93 Favored 'General case' 0 C--N 1.385 2.139 0 CA-C-N 112.339 -2.21 . . . . 0.0 109.217 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.62 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.9 OUTLIER -74.25 -41.56 61.08 Favored 'General case' 0 C--N 1.384 2.08 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.666 179.552 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' P' P ' 145' ' ' LEU . . . . . 0.561 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 43.5 mt -65.13 -48.44 73.57 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-O 124.906 2.289 . . . . 0.0 108.039 -165.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.991 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.51 -16.94 7.02 Favored 'Isoleucine or valine' 0 C--N 1.386 2.153 0 CA-C-N 110.316 -3.129 . . . . 0.0 107.739 -170.828 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' P' P ' 147' ' ' ARG . . . . . 0.599 ' HG3' ' O ' ' P' ' 144' ' ' SER . 0.1 OUTLIER 81.21 37.71 0.08 Allowed 'General case' 0 C--N 1.386 2.188 0 CA-C-N 111.375 -2.648 . . . . 0.0 108.055 153.008 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.991 HD12 HD11 ' P' ' 146' ' ' ILE . 5.7 mt -95.03 168.5 10.74 Favored 'General case' 0 C--N 1.39 2.354 0 CA-C-N 112.224 -2.262 . . . . 0.0 109.294 168.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.65 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.9 p -88.6 143.03 31.44 Favored Pre-proline 0 CA--C 1.588 2.415 0 CA-C-O 122.854 1.311 . . . . 0.0 108.01 173.128 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -60.19 -37.41 83.47 Favored 'Trans proline' 0 C--N 1.413 3.953 0 C-N-CA 122.652 2.235 . . . . 0.0 112.054 -155.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.35 -29.06 65.67 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.67 167.507 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.65 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.9 mt-30 -73.52 -28.33 61.83 Favored 'General case' 0 C--N 1.39 2.333 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.613 HG13 ' CD2' ' P' ' 157' ' ' PHE . 1.2 t -64.48 -71.14 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.077 0 CA-C-N 121.901 2.137 . . . . 0.0 109.597 165.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.875 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.95 -57.98 0.45 Allowed 'General case' 0 C--N 1.385 2.139 0 C-N-CA 124.762 1.225 . . . . 0.0 110.531 -176.916 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.58 HD12 ' OE1' ' P' ' 158' ' ' GLN . 0.2 OUTLIER -58.59 -42.39 84.63 Favored 'Isoleucine or valine' 0 C--N 1.383 2.057 0 CA-C-N 113.389 -1.732 . . . . 0.0 108.994 -172.989 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.755 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.4 t90 -66.68 -32.23 73.42 Favored 'General case' 0 C--N 1.385 2.11 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.807 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 49.0 m-85 -74.35 -40.56 62.06 Favored 'General case' 0 C--O 1.272 2.261 0 O-C-N 121.072 -1.018 . . . . 0.0 111.998 173.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.58 ' OE1' HD12 ' P' ' 155' ' ' ILE . 73.2 mt-30 -50.97 -59.32 4.27 Favored 'General case' 0 C--N 1.378 1.813 0 O-C-N 119.664 -1.898 . . . . 0.0 106.77 169.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -56.04 -25.01 43.02 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.923 -166.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.559 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.0 t-160 -77.39 -47.58 19.47 Favored 'General case' 0 C--O 1.281 2.736 0 CA-C-N 121.714 2.052 . . . . 0.0 111.327 175.354 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.657 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.957 0 CA-C-N 122.985 2.63 . . . . 0.0 110.762 -160.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.618 ' CD1' HD22 ' P' ' 148' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.258 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.45 149.48 50.17 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -175.075 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.417 ' O ' ' N ' ' P' ' 122' ' ' TYR . 31.8 ttmt -44.94 -36.06 3.18 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.538 -1.665 . . . . 0.0 109.252 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -52.88 -62.73 1.46 Allowed 'General case' 0 C--N 1.383 2.033 0 CA-C-O 124.305 2.003 . . . . 0.0 109.128 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.554 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.4 mt-30 -54.85 -43.99 73.57 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-N 112.42 -2.173 . . . . 0.0 109.709 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.554 ' HA ' HD12 ' P' ' 124' ' ' LEU . 9.8 m -51.18 -57.68 8.12 Favored 'General case' 0 C--N 1.385 2.129 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 166.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.717 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.7 OUTLIER -53.04 -48.15 67.86 Favored 'General case' 0 C--N 1.382 2.021 0 CA-C-O 122.487 1.136 . . . . 0.0 110.051 -168.5 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.749 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.5 OUTLIER -66.33 -37.85 86.31 Favored 'General case' 0 C--N 1.378 1.834 0 CA-C-N 114.562 -1.199 . . . . 0.0 107.878 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.792 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.6 mt -60.46 -50.82 72.07 Favored 'General case' 0 C--N 1.384 2.084 0 O-C-N 120.536 -1.352 . . . . 0.0 109.615 171.505 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' P' ' 129' ' ' ARG . 20.0 mt-10 -54.39 -52.76 60.66 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-O 122.384 1.088 . . . . 0.0 109.21 177.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.717 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.98 -67.78 0.22 Allowed 'General case' 0 C--N 1.378 1.818 0 CA-C-N 111.872 -2.422 . . . . 0.0 108.754 177.378 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.413 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.3 OUTLIER -59.21 -36.81 76.05 Favored 'General case' 0 C--N 1.397 2.634 0 CA-C-N 112.032 -2.349 . . . . 0.0 108.373 -172.478 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.85 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 12.6 t80 -69.21 -48.85 60.91 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-N 119.1 0.864 . . . . 0.0 109.679 178.127 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' P' ' 125' ' ' GLU . 27.3 mtm180 -62.96 -15.96 57.71 Favored 'General case' 0 C--N 1.38 1.931 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -166.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -101.66 -39.86 7.26 Favored 'General case' 0 C--N 1.379 1.862 0 C-N-CA 126.669 1.988 . . . . 0.0 107.374 -170.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.492 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.1 OUTLIER -153.2 104.49 2.8 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 111.723 -2.489 . . . . 0.0 108.64 -153.963 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' P' P ' 132' ' ' ARG . . . . . 0.492 ' HB3' ' CD2' ' P' ' 133' ' ' TYR . 3.2 mtt85 -74.48 -15.79 60.87 Favored 'General case' 0 C--N 1.391 2.41 0 CA-C-N 112.197 -2.274 . . . . 0.0 110.721 -166.2 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.492 ' CD2' ' HB3' ' P' ' 132' ' ' ARG . 66.8 m-85 -160.16 112.14 2.0 Favored 'General case' 0 C--N 1.378 1.835 0 CA-C-N 113.842 -1.526 . . . . 0.0 108.289 -153.05 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.559 HD22 ' HB3' ' P' ' 138' ' ' GLU . 19.1 mt -129.45 133.33 47.25 Favored 'General case' 0 C--N 1.396 2.595 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.028 -155.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . 0.338 1.3 t -92.6 166.57 12.43 Favored 'General case' 0 C--N 1.394 2.533 0 CA-C-N 122.103 2.229 . . . . 0.0 107.372 174.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.536 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.75 -46.47 98.45 Favored Pre-proline 0 CA--C 1.582 2.188 0 CA-C-N 113.573 -1.648 . . . . 0.0 108.684 -155.004 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 0.1 OUTLIER -53.64 -46.49 33.34 Favored 'Trans proline' 0 C--N 1.395 2.982 0 N-CA-C 116.73 1.781 . . . . 0.0 116.73 177.413 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.559 ' HB3' HD22 ' P' ' 134' ' ' LEU . 1.6 mm-40 -51.86 -65.68 0.52 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 123.726 1.727 . . . . 0.0 106.813 170.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.946 ' NH2' ' HG3' ' P' ' 154' ' ' LYS . 1.7 ptt180 -69.62 -32.18 70.74 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 109.942 -3.299 . . . . 0.0 108.718 -160.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.628 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 2.4 mt-10 -52.81 -47.02 67.93 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 122.987 1.375 . . . . 0.0 108.131 170.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -64.78 -37.85 89.01 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-N 112.416 -2.175 . . . . 0.0 109.608 -166.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.493 HD13 HD13 ' P' ' 146' ' ' ILE . 1.3 tm? -59.29 -44.5 92.51 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-O 123.169 1.461 . . . . 0.0 108.913 169.308 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.628 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.89 -34.27 77.58 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-N 112.037 -2.347 . . . . 0.0 109.095 177.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.581 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -72.5 -37.69 68.33 Favored 'General case' 0 C--N 1.388 2.243 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.451 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 45.7 mt -67.25 -52.48 40.35 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 124.777 2.227 . . . . 0.0 108.337 -167.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.973 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -91.61 -16.6 7.94 Favored 'Isoleucine or valine' 0 C--N 1.386 2.194 0 CA-C-N 110.498 -3.046 . . . . 0.0 107.959 -172.831 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' P' P ' 147' ' ' ARG . . . . . 0.516 ' HD3' ' O ' ' P' ' 144' ' ' SER . 3.2 mmt-85 81.3 38.54 0.07 Allowed 'General case' 0 C--N 1.385 2.144 0 CA-C-N 111.464 -2.607 . . . . 0.0 107.822 153.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.973 HD12 HD11 ' P' ' 146' ' ' ILE . 5.8 mt -94.19 171.79 8.62 Favored 'General case' 0 C--N 1.39 2.335 0 CA-C-N 112.023 -2.353 . . . . 0.0 109.055 166.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.64 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.4 p -89.99 139.86 27.49 Favored Pre-proline 0 CA--C 1.588 2.432 0 CA-C-O 123.148 1.451 . . . . 0.0 108.061 171.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.43 ' HB3' HH11 ' P' ' 139' ' ' ARG . 0.6 OUTLIER -46.34 -48.6 13.05 Favored 'Trans proline' 0 C--N 1.406 3.566 0 C-N-CA 124.935 3.757 . . . . 0.0 115.286 -165.436 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.41 -29.61 35.88 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 118.347 -0.835 . . . . 0.0 110.06 169.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.64 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -74.85 -27.67 60.36 Favored 'General case' 0 C--N 1.39 2.347 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.802 HG13 ' CD2' ' P' ' 157' ' ' PHE . 1.5 t -64.69 -72.86 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.382 2.007 0 CA-C-N 122.069 2.213 . . . . 0.0 109.883 162.322 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.946 ' HG3' ' NH2' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.47 -54.93 0.54 Allowed 'General case' 0 C--N 1.386 2.154 0 C-N-CA 124.896 1.278 . . . . 0.0 110.409 -175.504 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 16.5 mm -60.98 -41.7 90.12 Favored 'Isoleucine or valine' 0 C--N 1.387 2.199 0 CA-C-N 114.072 -1.422 . . . . 0.0 109.498 -174.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.792 ' HB3' HD22 ' P' ' 124' ' ' LEU . 7.7 t90 -66.81 -32.08 73.12 Favored 'General case' 0 C--N 1.382 2.0 0 O-C-N 121.228 -0.92 . . . . 0.0 109.076 172.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.85 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 52.2 m-85 -74.9 -42.2 58.24 Favored 'General case' 0 C--O 1.276 2.463 0 O-C-N 121.376 -0.827 . . . . 0.0 111.815 176.073 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.436 ' N ' ' O ' ' P' ' 154' ' ' LYS . 60.5 mt-30 -50.57 -60.25 3.22 Favored 'General case' 0 C--N 1.377 1.778 0 O-C-N 119.571 -1.956 . . . . 0.0 107.28 169.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -56.25 -23.42 36.0 Favored 'General case' 0 C--N 1.391 2.374 0 CA-C-O 117.358 -1.306 . . . . 0.0 109.629 -166.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.564 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 1.2 t-160 -75.28 -50.64 15.43 Favored 'General case' 0 C--O 1.281 2.744 0 CA-C-N 121.307 1.867 . . . . 0.0 110.128 175.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.47 ' NH1' ' CD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.018 0 CA-C-N 122.538 2.427 . . . . 0.0 110.732 -158.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.546 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.6 m-85 . . . . . 0 C--O 1.257 1.459 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.19 147.82 52.75 Favored 'General case' 0 C--N 1.381 1.976 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -168.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.424 ' O ' ' N ' ' P' ' 122' ' ' TYR . 37.5 ttmt -42.82 -36.22 1.41 Allowed 'General case' 0 C--N 1.381 1.963 0 CA-C-N 113.716 -1.584 . . . . 0.0 109.381 -177.012 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.77 -67.39 0.26 Allowed 'General case' 0 C--N 1.383 2.025 0 CA-C-O 123.981 1.848 . . . . 0.0 109.088 173.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.1 mt-30 -48.32 -48.8 35.84 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 112.435 -2.166 . . . . 0.0 110.038 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.649 ' HA ' HD12 ' P' ' 124' ' ' LEU . 9.1 m -50.39 -58.38 5.84 Favored 'General case' 0 C--N 1.384 2.071 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.438 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.538 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 0.6 OUTLIER -52.94 -46.99 68.39 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.985 -170.246 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.688 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -67.06 -35.94 80.94 Favored 'General case' 0 C--O 1.265 1.898 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.137 177.416 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.75 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.7 mt -59.98 -53.97 51.51 Favored 'General case' 0 C--N 1.381 1.956 0 O-C-N 119.593 -1.942 . . . . 0.0 109.619 168.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.576 ' O ' ' N ' ' P' ' 129' ' ' ARG . 11.6 mt-10 -55.36 -42.37 73.81 Favored 'General case' 0 C--N 1.381 1.962 0 CA-C-O 122.564 1.173 . . . . 0.0 109.679 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.538 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -47.41 -71.6 0.07 Allowed 'General case' 0 C--N 1.38 1.912 0 CA-C-N 111.235 -2.712 . . . . 0.0 108.132 177.085 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.681 ' HD2' HD21 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -60.82 -33.3 72.81 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 113.933 -1.485 . . . . 0.0 108.405 -172.397 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.842 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 30.6 t80 -69.89 -48.9 56.9 Favored 'General case' 0 C--N 1.38 1.929 0 CA-C-N 119.623 1.102 . . . . 0.0 109.998 176.304 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.576 ' N ' ' O ' ' P' ' 125' ' ' GLU . 71.3 mtt180 -62.19 -19.08 62.75 Favored 'General case' 0 C--N 1.38 1.93 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -167.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -99.92 -40.02 7.88 Favored 'General case' 0 C--N 1.379 1.85 0 C-N-CA 126.279 1.832 . . . . 0.0 107.097 -169.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.482 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.8 OUTLIER -154.58 102.86 2.43 Favored 'General case' 0 C--N 1.384 2.102 0 CA-C-N 111.953 -2.385 . . . . 0.0 109.329 -152.61 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -13.89 60.76 Favored 'General case' 0 C--N 1.394 2.533 0 CA-C-N 112.244 -2.253 . . . . 0.0 111.212 -161.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.453 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 12.8 m-85 -159.23 111.09 2.12 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-N 113.36 -1.745 . . . . 0.0 108.089 -154.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.681 HD21 ' HD2' ' P' ' 127' ' ' ARG . 29.2 mt -123.4 132.36 53.93 Favored 'General case' 0 C--N 1.398 2.703 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -155.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.0 155.46 23.94 Favored 'General case' 0 C--N 1.38 1.934 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 171.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.533 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.17 -49.32 93.6 Favored Pre-proline 0 CA--C 1.584 2.276 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -160.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.533 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 75.5 Cg_exo -59.84 -28.8 88.02 Favored 'Trans proline' 0 C--N 1.401 3.312 0 N-CA-C 115.402 1.27 . . . . 0.0 115.402 -176.386 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.45 ' HB3' HD22 ' P' ' 134' ' ' LEU . 2.9 mm-40 -53.33 -72.4 0.06 Allowed 'General case' 0 C--N 1.379 1.872 0 CA-C-O 124.822 2.249 . . . . 0.0 106.795 158.397 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.906 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -66.45 -39.44 88.88 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 110.267 -3.152 . . . . 0.0 108.407 -154.318 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.635 ' O ' ' N ' ' P' ' 144' ' ' SER . 1.7 mt-10 -53.81 -43.2 69.15 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.576 1.179 . . . . 0.0 108.319 177.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -63.55 -36.81 85.03 Favored 'General case' 0 C--N 1.381 1.936 0 CA-C-N 112.693 -2.048 . . . . 0.0 109.277 -174.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.613 ' O ' HG23 ' P' ' 146' ' ' ILE . 0.8 OUTLIER -60.02 -45.65 92.07 Favored 'General case' 0 C--N 1.386 2.172 0 CA-C-O 122.79 1.281 . . . . 0.0 108.857 165.675 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.75 -30.53 71.62 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 112.606 -2.088 . . . . 0.0 109.368 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.635 ' N ' ' O ' ' P' ' 140' ' ' GLU . 8.0 t -74.81 -43.46 54.56 Favored 'General case' 0 C--N 1.383 2.04 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.327 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 145' ' ' LEU . . . . . 0.533 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 39.4 mt -62.51 -44.06 97.28 Favored 'General case' 0 C--N 1.38 1.914 0 CA-C-O 124.727 2.203 . . . . 0.0 107.794 -164.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.976 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -102.87 -17.24 7.13 Favored 'Isoleucine or valine' 0 C--N 1.385 2.135 0 CA-C-N 110.283 -3.144 . . . . 0.0 107.792 -168.766 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' P' P ' 147' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.0 OUTLIER 81.22 37.55 0.08 Allowed 'General case' 0 C--N 1.388 2.249 0 CA-C-N 111.249 -2.705 . . . . 0.0 108.292 153.496 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.976 HD12 HD11 ' P' ' 146' ' ' ILE . 5.7 mt -95.25 168.04 10.98 Favored 'General case' 0 C--N 1.39 2.332 0 CA-C-N 112.353 -2.203 . . . . 0.0 109.416 167.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.638 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -88.77 143.38 31.64 Favored Pre-proline 0 CA--C 1.587 2.378 0 CA-C-O 122.948 1.356 . . . . 0.0 108.25 173.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -60.74 -37.32 79.56 Favored 'Trans proline' 1 C--N 1.415 4.062 0 C-N-CA 122.621 2.214 . . . . 0.0 112.885 -155.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.79 -34.9 63.26 Favored 'General case' 0 C--N 1.384 2.092 0 C-N-CA 119.593 -0.843 . . . . 0.0 109.774 165.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.638 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.7 mt-30 -70.91 -27.67 63.96 Favored 'General case' 0 C--N 1.388 2.272 0 N-CA-C 105.639 -1.986 . . . . 0.0 105.639 -177.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.79 HG11 ' HB2' ' P' ' 139' ' ' ARG . 1.3 t -64.55 -71.99 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.096 0 CA-C-N 121.537 1.971 . . . . 0.0 109.567 164.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.906 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.75 -58.93 0.42 Allowed 'General case' 0 C--N 1.385 2.144 0 C-N-CA 124.807 1.243 . . . . 0.0 110.784 -177.8 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.444 HD13 ' OE1' ' P' ' 158' ' ' GLN . 22.7 mm -58.81 -40.86 81.03 Favored 'Isoleucine or valine' 0 C--N 1.381 1.969 0 CA-C-N 113.089 -1.869 . . . . 0.0 108.847 -172.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.75 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.9 t90 -67.71 -31.89 72.14 Favored 'General case' 0 C--N 1.382 2.011 0 O-C-N 121.419 -0.801 . . . . 0.0 109.311 173.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.842 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 72.5 m-85 -75.18 -38.76 60.69 Favored 'General case' 0 C--O 1.274 2.345 0 O-C-N 121.274 -0.891 . . . . 0.0 112.302 173.65 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.482 ' N ' ' O ' ' P' ' 154' ' ' LYS . 81.1 mt-30 -53.22 -62.93 1.33 Allowed 'General case' 0 C--N 1.376 1.754 0 O-C-N 119.879 -1.763 . . . . 0.0 106.465 167.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -56.53 -24.49 47.11 Favored 'General case' 0 C--N 1.39 2.331 0 CA-C-O 117.672 -1.156 . . . . 0.0 109.648 -166.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.543 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 1.1 t-80 -79.26 -38.03 36.48 Favored 'General case' 0 C--O 1.282 2.787 0 CA-C-N 121.491 1.95 . . . . 0.0 111.895 178.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.502 ' NH2' ' HB3' ' P' ' 157' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.96 0 CA-C-N 122.997 2.635 . . . . 0.0 111.225 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.499 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 . . . . . 0 C--O 1.258 1.531 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.29 148.13 52.3 Favored 'General case' 0 C--N 1.381 1.965 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -169.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.433 ' O ' ' N ' ' P' ' 122' ' ' TYR . 31.8 ttmt -43.43 -36.15 1.86 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-N 113.384 -1.734 . . . . 0.0 109.226 -177.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.67 -66.86 0.32 Allowed 'General case' 0 C--N 1.382 2.019 0 CA-C-O 124.109 1.909 . . . . 0.0 109.138 173.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.546 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.7 mt-30 -48.71 -45.92 39.95 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-N 112.476 -2.147 . . . . 0.0 109.663 177.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.71 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.0 m -54.73 -54.75 37.83 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.359 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.614 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.6 t80 -53.18 -46.13 68.81 Favored 'General case' 0 C--N 1.382 2.014 0 CA-C-O 122.381 1.086 . . . . 0.0 110.161 -171.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.696 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.3 OUTLIER -66.35 -40.15 89.64 Favored 'General case' 0 C--N 1.38 1.893 0 CA-C-N 114.245 -1.343 . . . . 0.0 107.803 179.417 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.736 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.7 mt -60.98 -48.94 79.5 Favored 'General case' 0 C--N 1.386 2.174 0 O-C-N 120.528 -1.357 . . . . 0.0 109.607 173.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.6 mt-10 -55.18 -52.63 62.72 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.755 1.264 . . . . 0.0 109.398 176.266 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.614 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -42.28 -58.67 2.09 Favored 'General case' 0 C--N 1.379 1.848 0 CA-C-N 112.209 -2.269 . . . . 0.0 109.075 177.073 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.679 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -69.83 -32.72 71.3 Favored 'General case' 0 C--N 1.396 2.596 0 CA-C-N 112.481 -2.145 . . . . 0.0 108.467 -168.083 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.715 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.0 t80 -68.95 -52.09 32.87 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-O 121.81 0.814 . . . . 0.0 109.638 171.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.668 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 3.2 mmm180 -62.58 -14.07 38.4 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-N 113.545 -1.661 . . . . 0.0 108.302 -164.652 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -95.91 -47.33 6.17 Favored 'General case' 0 C--N 1.379 1.87 0 CA-C-O 123.93 1.824 . . . . 0.0 106.539 -176.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.614 ' OE1' HD23 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -159.36 123.1 3.78 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 111.919 -2.401 . . . . 0.0 110.256 -166.043 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' P' P ' 132' ' ' ARG . . . . . 0.5 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 1.1 ptt-85 -80.45 -7.65 59.23 Favored 'General case' 0 C--N 1.387 2.223 0 CA-C-N 112.36 -2.2 . . . . 0.0 111.243 -162.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.578 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 0.4 OUTLIER -152.84 90.6 1.48 Allowed 'General case' 0 C--N 1.378 1.837 0 CA-C-O 126.846 3.212 . . . . 0.0 109.183 -154.268 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.614 HD23 ' OE1' ' P' ' 131' ' ' GLN . 65.0 mt -97.3 137.88 35.62 Favored 'General case' 0 C--N 1.415 3.413 0 CA-C-N 111.863 -2.426 . . . . 0.0 108.528 -166.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.31 156.68 25.4 Favored 'General case' 0 C--N 1.381 1.971 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 161.184 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.521 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.11 -50.01 90.05 Favored Pre-proline 0 CA--C 1.583 2.221 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.458 -163.663 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.521 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 69.9 Cg_exo -57.05 -28.86 80.72 Favored 'Trans proline' 0 C--N 1.4 3.269 0 N-CA-C 115.011 1.12 . . . . 0.0 115.011 -172.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.564 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.1 OUTLIER -55.53 -70.88 0.1 Allowed 'General case' 0 C--N 1.384 2.093 0 CA-C-O 125.039 2.352 . . . . 0.0 105.734 164.421 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 1.015 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.59 -40.51 80.46 Favored 'General case' 0 C--N 1.391 2.388 0 CA-C-N 109.514 -3.494 . . . . 0.0 108.739 -156.047 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.647 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.8 mt-10 -53.17 -41.28 65.04 Favored 'General case' 0 C--N 1.38 1.901 0 CA-C-O 123.482 1.611 . . . . 0.0 108.368 178.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -64.03 -35.13 79.7 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.99 -172.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.679 HD13 ' CG ' ' P' ' 127' ' ' ARG . 2.5 tp -65.33 -43.04 92.21 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-O 123.282 1.515 . . . . 0.0 108.957 168.337 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.2 -34.98 66.77 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-N 112.32 -2.218 . . . . 0.0 108.37 174.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.572 ' N ' ' O ' ' P' ' 140' ' ' GLU . 3.1 t -73.49 -44.27 58.28 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.248 -179.153 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 81.2 mt -66.19 -47.01 75.31 Favored 'General case' 0 C--N 1.379 1.88 0 CA-C-O 124.897 2.284 . . . . 0.0 107.933 -163.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 1.045 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.66 -17.07 7.1 Favored 'Isoleucine or valine' 0 C--N 1.385 2.124 0 CA-C-N 110.539 -3.028 . . . . 0.0 107.688 -171.565 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 81.26 37.11 0.08 Allowed 'General case' 0 C--N 1.385 2.148 0 CA-C-N 111.44 -2.618 . . . . 0.0 108.181 152.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 1.045 HD12 HD11 ' P' ' 146' ' ' ILE . 6.0 mt -95.32 168.25 10.84 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 112.084 -2.325 . . . . 0.0 109.395 168.723 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.65 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.9 p -89.28 143.8 31.45 Favored Pre-proline 0 CA--C 1.588 2.407 0 CA-C-O 122.794 1.283 . . . . 0.0 108.26 172.533 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -60.66 -37.82 76.52 Favored 'Trans proline' 0 C--N 1.414 3.993 0 C-N-CA 122.531 2.154 . . . . 0.0 112.409 -155.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.27 -32.65 62.55 Favored 'General case' 0 C--N 1.385 2.121 0 C-N-CA 119.512 -0.875 . . . . 0.0 109.806 166.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.65 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.8 mt-30 -72.4 -29.44 63.74 Favored 'General case' 0 C--N 1.389 2.283 0 N-CA-C 105.848 -1.908 . . . . 0.0 105.848 -178.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.83 HG11 ' HB2' ' P' ' 139' ' ' ARG . 1.2 t -64.71 -69.75 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.098 0 CA-C-N 121.9 2.137 . . . . 0.0 109.562 166.556 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 1.015 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.68 -59.18 0.41 Allowed 'General case' 0 C--N 1.387 2.234 0 C-N-CA 124.986 1.315 . . . . 0.0 110.801 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.462 HD13 ' HA ' ' P' ' 155' ' ' ILE . 3.4 mm -55.22 -43.15 69.49 Favored 'Isoleucine or valine' 0 C--N 1.384 2.082 0 CA-C-N 112.825 -1.989 . . . . 0.0 110.089 -176.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.736 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.0 t90 -66.83 -30.56 70.77 Favored 'General case' 0 C--N 1.382 1.981 0 O-C-N 120.912 -1.118 . . . . 0.0 108.998 174.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.715 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 45.2 m-85 -76.11 -44.39 38.8 Favored 'General case' 0 C--O 1.276 2.493 0 O-C-N 121.235 -0.916 . . . . 0.0 111.939 174.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' P' ' 154' ' ' LYS . 23.5 mt-30 -42.71 -66.3 0.38 Allowed 'General case' 0 C--N 1.378 1.807 0 O-C-N 119.078 -2.264 . . . . 0.0 107.713 167.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -56.66 -21.93 30.97 Favored 'General case' 0 C--N 1.396 2.628 0 CA-C-N 112.759 -2.019 . . . . 0.0 109.695 -165.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.509 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.3 t-160 -76.12 -49.84 16.29 Favored 'General case' 0 C--O 1.284 2.876 0 CA-C-N 120.9 1.682 . . . . 0.0 110.809 172.253 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.578 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.269 2.083 0 CA-C-N 122.505 2.411 . . . . 0.0 109.578 -160.062 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.581 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.299 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.68 148.17 52.28 Favored 'General case' 0 C--N 1.382 1.984 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 -171.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -43.78 -36.51 2.32 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-N 113.279 -1.782 . . . . 0.0 109.157 -177.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.51 -65.16 0.61 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 124.203 1.954 . . . . 0.0 109.237 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.561 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.2 mt-30 -49.32 -47.61 46.99 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 127.081 2.152 . . . . 0.0 109.722 176.189 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.649 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.5 m -51.16 -56.18 14.08 Favored 'General case' 0 C--N 1.384 2.072 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 169.823 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.546 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 2.6 t80 -52.96 -48.62 67.24 Favored 'General case' 0 C--N 1.381 1.975 0 CA-C-O 122.593 1.187 . . . . 0.0 110.048 -169.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.934 ' CD ' HG22 ' P' ' 146' ' ' ILE . 6.9 mt-10 -66.23 -36.97 84.42 Favored 'General case' 0 C--N 1.377 1.798 0 CA-C-N 114.253 -1.34 . . . . 0.0 107.826 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.827 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -59.98 -51.85 67.92 Favored 'General case' 0 C--N 1.384 2.079 0 O-C-N 120.76 -1.212 . . . . 0.0 109.871 170.447 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' P' ' 129' ' ' ARG . 24.2 mt-10 -54.59 -51.47 65.22 Favored 'General case' 0 C--N 1.379 1.872 0 CA-C-O 122.629 1.205 . . . . 0.0 109.294 178.209 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.608 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -41.46 -70.06 0.12 Allowed 'General case' 0 C--N 1.379 1.873 0 CA-C-N 111.683 -2.508 . . . . 0.0 108.681 177.076 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.62 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.7 OUTLIER -56.67 -38.73 72.63 Favored 'General case' 0 C--N 1.387 2.238 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.259 -173.181 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.862 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 27.5 t80 -69.47 -46.44 66.66 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-O 121.541 0.686 . . . . 0.0 110.144 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' P' ' 125' ' ' GLU . 13.2 mtp85 -62.63 -13.96 37.74 Favored 'General case' 0 C--N 1.381 1.936 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 -168.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -107.44 -37.19 6.28 Favored 'General case' 0 C--N 1.379 1.887 0 C-N-CA 126.938 2.095 . . . . 0.0 107.96 -168.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.496 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -153.43 108.37 3.17 Favored 'General case' 0 C--N 1.39 2.328 0 CA-C-N 111.971 -2.377 . . . . 0.0 108.615 -153.45 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -76.15 -19.37 58.53 Favored 'General case' 0 C--N 1.39 2.36 0 CA-C-N 112.021 -2.354 . . . . 0.0 110.508 -168.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.435 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 36.5 m-85 -162.27 112.54 1.53 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 113.875 -1.511 . . . . 0.0 108.313 -153.275 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.603 HD22 ' HG3' ' P' ' 138' ' ' GLU . 29.6 mt -120.84 142.69 49.4 Favored 'General case' 0 C--N 1.398 2.706 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -163.024 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.83 152.24 29.82 Favored 'General case' 0 C--N 1.382 2.02 0 O-C-N 121.14 -0.975 . . . . 0.0 108.408 158.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.44 ' HA ' ' CG ' ' P' ' 139' ' ' ARG . . . -58.58 -43.78 98.34 Favored Pre-proline 0 CA--C 1.583 2.216 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -161.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 137' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -49.82 -43.35 41.11 Favored 'Trans proline' 0 C--N 1.393 2.914 0 N-CA-C 116.954 1.867 . . . . 0.0 116.954 -179.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.603 ' HG3' HD22 ' P' ' 134' ' ' LEU . 7.6 mm-40 -52.79 -62.61 1.54 Allowed 'General case' 0 C--N 1.39 2.353 0 CA-C-O 124.13 1.919 . . . . 0.0 105.984 169.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 1.042 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -68.01 -46.79 70.28 Favored 'General case' 0 C--N 1.388 2.273 0 CA-C-N 109.492 -3.504 . . . . 0.0 108.331 -158.506 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.66 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 3.3 mt-10 -53.87 -35.71 61.85 Favored 'General case' 0 C--N 1.38 1.893 0 CA-C-O 122.744 1.259 . . . . 0.0 108.003 -177.36 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -65.96 -36.4 83.24 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.563 -1.653 . . . . 0.0 108.859 -173.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.635 HD21 ' C ' ' P' ' 123' ' ' GLU . 1.0 OUTLIER -65.72 -42.28 91.24 Favored 'General case' 0 C--N 1.382 1.992 0 CA-C-O 123.172 1.463 . . . . 0.0 109.072 168.163 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.66 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.18 -32.66 64.54 Favored 'General case' 0 C--N 1.389 2.308 0 CA-C-N 112.62 -2.082 . . . . 0.0 108.346 172.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.627 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -73.15 -43.63 61.26 Favored 'General case' 0 C--N 1.389 2.302 0 CA-C-N 113.468 -1.696 . . . . 0.0 109.571 -177.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 86.4 mt -69.2 -45.68 69.32 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-O 124.812 2.244 . . . . 0.0 108.262 -164.025 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.969 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -97.14 -13.28 8.14 Favored 'Isoleucine or valine' 0 C--N 1.39 2.36 0 CA-C-N 110.934 -2.848 . . . . 0.0 108.11 -169.245 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 83.05 34.87 0.06 Allowed 'General case' 0 C--N 1.382 1.995 0 CA-C-O 125.67 2.652 . . . . 0.0 108.249 152.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.969 HD12 HD11 ' P' ' 146' ' ' ILE . 9.2 mt -96.89 171.41 8.52 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 111.65 -2.523 . . . . 0.0 109.736 169.357 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.569 ' O ' ' N ' ' P' ' 152' ' ' GLN . 20.7 p -95.2 143.19 25.68 Favored Pre-proline 0 CA--C 1.588 2.442 0 CA-C-O 122.361 1.077 . . . . 0.0 108.773 168.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.475 ' HG3' ' HA ' ' P' ' 140' ' ' GLU . 77.5 Cg_exo -55.37 -36.45 93.85 Favored 'Trans proline' 0 C--N 1.41 3.787 0 C-N-CA 122.059 1.84 . . . . 0.0 114.475 -165.085 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.73 -9.26 13.35 Favored 'General case' 0 C--N 1.38 1.93 0 CA-C-N 119.992 1.269 . . . . 0.0 111.687 167.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.569 ' N ' ' O ' ' P' ' 149' ' ' THR . 42.5 mt-30 -88.56 -34.22 17.43 Favored 'General case' 0 C--O 1.285 2.952 0 CA-C-O 117.169 -1.396 . . . . 0.0 108.471 168.299 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.971 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -65.0 -70.5 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.941 0 CA-C-N 124.65 3.386 . . . . 0.0 109.731 165.806 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 1.042 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.4 -54.2 0.52 Allowed 'General case' 0 C--N 1.386 2.17 0 C-N-CA 125.796 1.638 . . . . 0.0 108.865 -178.315 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.579 HD13 ' OE1' ' P' ' 158' ' ' GLN . 7.4 mm -56.89 -61.74 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.956 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.827 ' HB3' HD22 ' P' ' 124' ' ' LEU . 3.4 t90 -49.82 -30.19 9.33 Favored 'General case' 0 C--N 1.382 2.019 0 O-C-N 120.2 -1.562 . . . . 0.0 109.187 -178.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.971 ' CE2' HG13 ' P' ' 153' ' ' VAL . 74.1 m-85 -75.51 -43.88 46.65 Favored 'General case' 0 C--O 1.282 2.779 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 170.744 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.579 ' OE1' HD13 ' P' ' 155' ' ' ILE . 13.6 mt-30 -41.95 -70.94 0.09 Allowed 'General case' 0 C--N 1.378 1.808 0 O-C-N 118.517 -2.614 . . . . 0.0 106.533 161.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -18.92 22.82 Favored 'General case' 0 C--N 1.385 2.15 0 CA-C-O 117.684 -1.151 . . . . 0.0 111.187 -165.425 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.558 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.8 OUTLIER -74.95 -48.87 22.21 Favored 'General case' 0 C--O 1.281 2.72 0 CA-C-N 120.964 1.711 . . . . 0.0 110.186 177.073 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.435 ' CD ' ' CE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.269 2.079 0 CA-C-N 122.443 2.383 . . . . 0.0 110.59 -159.035 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.413 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.5 m-85 . . . . . 0 C--O 1.256 1.416 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.1 p -67.37 148.08 52.09 Favored 'General case' 0 C--N 1.381 1.967 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -171.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.43 ' O ' ' N ' ' P' ' 122' ' ' TYR . 35.0 ttmt -43.17 -36.17 1.63 Allowed 'General case' 0 C--N 1.382 2.012 0 CA-C-N 113.271 -1.786 . . . . 0.0 109.258 -178.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.56 -66.67 0.35 Allowed 'General case' 0 C--N 1.383 2.032 0 CA-C-O 124.172 1.939 . . . . 0.0 109.078 173.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.9 mt-30 -49.12 -48.24 44.71 Favored 'General case' 0 C--N 1.382 2.005 0 CA-C-N 112.421 -2.172 . . . . 0.0 109.491 177.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.707 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.9 m -52.38 -55.07 24.15 Favored 'General case' 0 C--N 1.385 2.143 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 170.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.509 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 2.3 t80 -53.05 -45.69 68.19 Favored 'General case' 0 C--N 1.383 2.057 0 CA-C-O 122.237 1.018 . . . . 0.0 109.985 -171.481 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.715 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.8 -39.64 87.84 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-N 114.321 -1.309 . . . . 0.0 107.834 179.664 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.745 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.3 mt -60.55 -49.49 77.33 Favored 'General case' 0 C--N 1.385 2.111 0 O-C-N 120.532 -1.355 . . . . 0.0 109.599 172.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.5 mt-10 -55.68 -51.79 66.06 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-O 122.575 1.179 . . . . 0.0 109.639 177.058 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.594 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -40.65 -70.24 0.11 Allowed 'General case' 0 C--N 1.378 1.822 0 CA-C-N 111.851 -2.431 . . . . 0.0 109.022 177.245 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.735 ' HD2' HD21 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -62.82 -31.44 72.43 Favored 'General case' 0 C--N 1.379 1.866 0 CA-C-N 113.702 -1.59 . . . . 0.0 108.244 -171.185 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.813 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 19.9 t80 -70.13 -49.02 54.93 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-N 119.786 1.176 . . . . 0.0 109.971 175.364 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.5 mmm180 -62.65 -16.12 55.41 Favored 'General case' 0 C--N 1.38 1.909 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -166.643 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -105.29 -41.29 5.57 Favored 'General case' 0 C--N 1.378 1.84 0 CA-C-O 124.07 1.891 . . . . 0.0 107.217 -168.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.459 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.7 OUTLIER -152.94 96.67 2.12 Favored 'General case' 0 C--N 1.386 2.175 0 CA-C-N 111.752 -2.477 . . . . 0.0 109.54 -152.012 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' P' P ' 132' ' ' ARG . . . . . 0.487 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -77.48 -5.85 51.44 Favored 'General case' 0 C--N 1.394 2.52 0 CA-C-N 111.59 -2.55 . . . . 0.0 110.779 -158.406 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.726 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 2.5 m-30 -163.85 113.04 1.23 Allowed 'General case' 0 C--N 1.38 1.923 0 CA-C-N 114.516 -1.22 . . . . 0.0 108.356 -154.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.735 HD21 ' HD2' ' P' ' 127' ' ' ARG . 43.3 mt -120.67 139.6 52.79 Favored 'General case' 0 C--N 1.397 2.664 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -161.064 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.85 157.63 25.63 Favored 'General case' 0 C--N 1.382 2.022 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 160.65 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.522 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.22 -49.81 90.9 Favored Pre-proline 0 CA--C 1.583 2.222 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.465 -164.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 50.9 Cg_exo -55.99 -29.73 75.03 Favored 'Trans proline' 0 C--N 1.399 3.187 0 C-N-CA 121.002 1.135 . . . . 0.0 114.649 -173.146 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.445 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -55.87 -69.45 0.14 Allowed 'General case' 0 C--N 1.385 2.121 0 CA-C-O 124.176 1.941 . . . . 0.0 106.09 165.535 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.632 ' CZ ' ' HG3' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.67 -35.79 75.44 Favored 'General case' 0 C--N 1.391 2.408 0 CA-C-N 109.858 -3.337 . . . . 0.0 108.85 -156.275 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.668 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.0 mt-10 -52.25 -44.8 65.08 Favored 'General case' 0 C--N 1.381 1.944 0 CA-C-O 123.628 1.68 . . . . 0.0 107.786 174.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -67.12 -36.3 81.6 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 112.396 -2.184 . . . . 0.0 109.121 -166.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.573 ' O ' HG23 ' P' ' 146' ' ' ILE . 1.0 OUTLIER -65.95 -42.1 90.42 Favored 'General case' 0 C--N 1.382 1.995 0 CA-C-O 123.158 1.456 . . . . 0.0 109.049 169.401 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.3 -35.69 67.81 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.54 -2.118 . . . . 0.0 108.094 172.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.596 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.5 t -70.9 -43.14 68.92 Favored 'General case' 0 C--N 1.389 2.305 0 CA-C-N 113.231 -1.804 . . . . 0.0 110.592 -178.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.73 -46.96 67.55 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-O 124.863 2.268 . . . . 0.0 108.09 -164.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.992 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.37 -13.16 8.23 Favored 'Isoleucine or valine' 0 C--N 1.39 2.351 0 CA-C-N 110.815 -2.902 . . . . 0.0 108.042 -168.291 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' P' P ' 147' ' ' ARG . . . . . 0.568 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 7.4 tpt180 82.32 35.28 0.07 Allowed 'General case' 0 C--N 1.382 1.998 0 CA-C-O 125.635 2.636 . . . . 0.0 107.837 153.116 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.992 HD12 HD11 ' P' ' 146' ' ' ILE . 9.8 mt -95.89 172.32 8.09 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 111.473 -2.603 . . . . 0.0 109.145 168.611 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.477 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.3 p -88.98 146.43 36.54 Favored Pre-proline 0 CA--C 1.587 2.371 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 165.422 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.554 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 85.0 Cg_exo -50.45 -49.39 16.68 Favored 'Trans proline' 0 C--N 1.408 3.71 0 C-N-CA 123.78 2.986 . . . . 0.0 114.127 -167.355 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 151' ' ' THR . . . . . 0.427 HG22 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -58.26 -20.66 44.04 Favored 'General case' 0 C--N 1.386 2.194 0 CA-C-N 112.759 -2.019 . . . . 0.0 110.79 173.847 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.4 mt-30 -78.07 -32.48 50.8 Favored 'General case' 0 C--O 1.277 2.522 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 171.302 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.762 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.7 t -64.27 -75.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.381 1.972 0 CA-C-N 122.967 2.621 . . . . 0.0 109.718 162.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.632 ' HG3' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -40.65 -42.84 1.8 Allowed 'General case' 0 C--N 1.387 2.212 0 C-N-CA 124.881 1.273 . . . . 0.0 109.971 -171.108 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.427 HG12 HG22 ' P' ' 151' ' ' THR . 0.7 OUTLIER -60.3 -63.05 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.956 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 -179.381 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.745 ' HB3' HD22 ' P' ' 124' ' ' LEU . 2.7 t90 -49.5 -29.03 6.08 Favored 'General case' 0 C--N 1.384 2.078 0 O-C-N 121.415 -0.803 . . . . 0.0 109.311 -177.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.813 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 52.1 m-85 -75.19 -43.06 54.17 Favored 'General case' 0 C--O 1.275 2.437 0 O-C-N 121.629 -0.669 . . . . 0.0 112.37 173.127 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -46.58 -65.32 0.58 Allowed 'General case' 0 C--N 1.376 1.759 0 O-C-N 119.131 -2.231 . . . . 0.0 107.028 165.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -56.0 -19.77 13.93 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-O 117.868 -1.063 . . . . 0.0 111.073 -164.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.559 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 2.3 t-160 -79.19 -46.59 17.59 Favored 'General case' 0 C--O 1.286 3.019 0 CA-C-N 121.055 1.752 . . . . 0.0 111.752 173.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.726 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.939 0 CA-C-N 123.603 2.91 . . . . 0.0 110.192 -163.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.55 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.2 m-85 . . . . . 0 C--O 1.258 1.515 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.55 147.41 53.46 Favored 'General case' 0 C--N 1.381 1.964 0 N-CA-C 107.543 -1.281 . . . . 0.0 107.543 -166.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' P' ' 122' ' ' TYR . 33.7 ttmt -41.72 -36.24 0.95 Allowed 'General case' 0 C--N 1.381 1.957 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.283 -176.694 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.1 -68.75 0.16 Allowed 'General case' 0 C--N 1.382 2.013 0 CA-C-O 124.329 2.014 . . . . 0.0 109.14 173.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.552 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.8 mt-30 -46.79 -50.11 18.81 Favored 'General case' 0 C--N 1.383 2.056 0 CA-C-N 112.356 -2.202 . . . . 0.0 109.855 176.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.628 ' HA ' HD12 ' P' ' 124' ' ' LEU . 18.7 m -51.18 -55.92 15.44 Favored 'General case' 0 C--N 1.383 2.05 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 170.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.616 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.8 t80 -52.99 -46.38 68.29 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-O 122.34 1.067 . . . . 0.0 110.194 -171.203 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.691 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.3 OUTLIER -66.42 -39.5 88.99 Favored 'General case' 0 C--N 1.379 1.88 0 CA-C-N 114.455 -1.248 . . . . 0.0 107.759 179.494 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.856 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.7 mt -60.84 -49.11 78.8 Favored 'General case' 0 C--N 1.385 2.136 0 O-C-N 120.592 -1.317 . . . . 0.0 109.953 173.205 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' P' ' 129' ' ' ARG . 17.8 mt-10 -53.74 -55.37 26.87 Favored 'General case' 0 C--N 1.38 1.895 0 CA-C-O 122.354 1.073 . . . . 0.0 108.841 175.761 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.616 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.82 -66.56 0.29 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 111.918 -2.401 . . . . 0.0 108.677 178.785 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.555 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.7 OUTLIER -61.09 -33.31 73.14 Favored 'General case' 0 C--N 1.394 2.503 0 CA-C-N 112.427 -2.17 . . . . 0.0 108.384 -173.416 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.727 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 13.8 t80 -67.5 -50.99 56.34 Favored 'General case' 0 C--N 1.387 2.23 0 O-C-N 121.195 -0.941 . . . . 0.0 110.29 174.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.493 ' HA ' ' NE ' ' P' ' 129' ' ' ARG . 0.1 OUTLIER -62.58 -12.56 23.59 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-N 112.916 -1.947 . . . . 0.0 108.158 -165.996 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -108.62 -39.67 5.32 Favored 'General case' 0 C--N 1.38 1.909 0 C-N-CA 126.383 1.873 . . . . 0.0 108.251 -170.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.481 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -151.79 110.24 3.77 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 112.051 -2.34 . . . . 0.0 108.861 -153.237 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -76.78 -20.28 56.63 Favored 'General case' 0 C--N 1.392 2.441 0 CA-C-N 112.23 -2.259 . . . . 0.0 110.738 -168.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.411 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 33.0 m-85 -161.02 114.18 1.97 Allowed 'General case' 0 C--N 1.379 1.887 0 CA-C-N 113.812 -1.54 . . . . 0.0 108.298 -153.255 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.627 HD22 ' HG3' ' P' ' 138' ' ' GLU . 26.4 mt -124.91 137.04 54.29 Favored 'General case' 0 C--N 1.399 2.753 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -159.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.35 154.84 26.27 Favored 'General case' 0 C--N 1.381 1.95 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 166.266 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.513 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.68 -49.36 92.28 Favored Pre-proline 0 CA--C 1.583 2.242 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.248 -161.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.513 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 82.7 Cg_exo -58.05 -28.89 85.09 Favored 'Trans proline' 0 C--N 1.4 3.286 0 C-N-CA 121.183 1.255 . . . . 0.0 114.956 -174.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.627 ' HG3' HD22 ' P' ' 134' ' ' LEU . 1.4 mm-40 -54.04 -70.78 0.09 Allowed 'General case' 0 C--N 1.379 1.883 0 CA-C-O 124.786 2.231 . . . . 0.0 106.308 160.509 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.903 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.25 -40.47 81.93 Favored 'General case' 0 C--N 1.39 2.328 0 CA-C-N 109.88 -3.327 . . . . 0.0 108.794 -155.14 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.649 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 5.0 mt-10 -53.24 -38.24 62.8 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-O 123.125 1.441 . . . . 0.0 108.294 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -65.18 -35.6 81.6 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 112.955 -1.93 . . . . 0.0 108.728 -172.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.583 ' O ' HG23 ' P' ' 146' ' ' ILE . 2.9 tp -64.37 -43.14 95.44 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-O 123.277 1.513 . . . . 0.0 108.976 167.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.649 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.86 -34.61 67.99 Favored 'General case' 0 C--N 1.39 2.351 0 CA-C-N 112.29 -2.232 . . . . 0.0 108.613 176.249 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.59 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.9 OUTLIER -73.83 -44.04 56.89 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.142 -179.587 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 74.7 mt -65.54 -46.75 78.33 Favored 'General case' 0 C--N 1.379 1.859 0 CA-C-O 124.866 2.27 . . . . 0.0 107.88 -163.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 1.029 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.99 -17.65 6.85 Favored 'Isoleucine or valine' 0 C--N 1.384 2.108 0 CA-C-N 110.435 -3.075 . . . . 0.0 107.664 -171.101 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 80.93 37.44 0.09 Allowed 'General case' 0 C--N 1.385 2.141 0 CA-C-N 111.397 -2.638 . . . . 0.0 108.158 152.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 1.029 HD12 HD11 ' P' ' 146' ' ' ILE . 6.0 mt -95.05 168.71 10.6 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-N 112.121 -2.308 . . . . 0.0 109.308 168.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.648 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.4 p -88.29 143.48 32.69 Favored Pre-proline 0 CA--C 1.587 2.375 0 CA-C-O 122.862 1.315 . . . . 0.0 108.137 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -37.35 86.91 Favored 'Trans proline' 1 C--N 1.414 4.001 0 C-N-CA 122.634 2.223 . . . . 0.0 111.926 -155.743 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' P' P ' 151' ' ' THR . . . . . 0.422 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.2 OUTLIER -56.69 -33.1 66.09 Favored 'General case' 0 C--N 1.386 2.174 0 C-N-CA 119.657 -0.817 . . . . 0.0 110.059 167.644 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.648 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.8 mt-30 -72.8 -26.97 61.7 Favored 'General case' 0 C--N 1.388 2.269 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.619 HG12 ' N ' ' P' ' 154' ' ' LYS . 0.9 OUTLIER -64.29 -69.78 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.084 0 CA-C-N 121.789 2.086 . . . . 0.0 109.229 164.39 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.903 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -35.55 -60.13 0.52 Allowed 'General case' 0 C--N 1.386 2.153 0 C-N-CA 125.194 1.398 . . . . 0.0 110.462 -176.852 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.453 HD13 ' HA ' ' P' ' 155' ' ' ILE . 4.3 mm -58.95 -37.38 66.99 Favored 'Isoleucine or valine' 0 C--N 1.384 2.106 0 CA-C-N 112.889 -1.96 . . . . 0.0 110.841 -174.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.856 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.5 t90 -67.38 -32.17 72.91 Favored 'General case' 0 C--N 1.381 1.959 0 O-C-N 120.369 -1.457 . . . . 0.0 109.21 169.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.727 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 44.0 m-85 -75.51 -43.79 47.18 Favored 'General case' 0 C--O 1.276 2.497 0 O-C-N 120.713 -1.242 . . . . 0.0 111.823 175.138 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' P' ' 154' ' ' LYS . 46.3 mt-30 -50.68 -58.25 6.33 Favored 'General case' 0 C--N 1.377 1.784 0 O-C-N 118.994 -2.316 . . . . 0.0 107.292 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -54.93 -29.92 57.38 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-O 117.957 -1.02 . . . . 0.0 108.917 -169.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.552 ' HB3' ' CE1' ' P' ' 128' ' ' PHE . 0.6 OUTLIER -77.58 -41.12 39.91 Favored 'General case' 0 C--O 1.285 2.972 0 CA-C-N 121.562 1.983 . . . . 0.0 111.667 -174.892 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.411 ' CD ' ' CE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.963 0 CA-C-N 122.995 2.634 . . . . 0.0 108.482 -170.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.664 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.255 1.393 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.93 148.97 50.53 Favored 'General case' 0 C--N 1.383 2.024 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 -171.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' P' ' 122' ' ' TYR . 19.8 ttmt -33.21 -50.07 0.28 Allowed 'General case' 0 C--N 1.383 2.063 0 O-C-N 126.883 2.614 . . . . 0.0 108.268 174.259 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.66 -58.11 5.92 Favored 'General case' 0 C--N 1.385 2.109 0 CA-C-N 111.424 -2.625 . . . . 0.0 109.165 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.542 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.7 mt-30 -59.83 -46.57 88.83 Favored 'General case' 0 C--N 1.381 1.969 0 CA-C-N 112.434 -2.166 . . . . 0.0 109.464 -178.148 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.575 ' HA ' HD12 ' P' ' 124' ' ' LEU . 3.3 m -47.64 -57.6 5.29 Favored 'General case' 0 C--N 1.386 2.155 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 166.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.667 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.34 -48.52 68.44 Favored 'General case' 0 C--N 1.382 1.997 0 CA-C-O 122.587 1.184 . . . . 0.0 109.904 -167.573 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.703 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.6 OUTLIER -66.2 -37.95 86.79 Favored 'General case' 0 C--N 1.378 1.83 0 CA-C-N 114.032 -1.44 . . . . 0.0 107.856 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.81 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.0 mt -60.7 -50.88 71.69 Favored 'General case' 0 C--N 1.384 2.105 0 O-C-N 120.52 -1.362 . . . . 0.0 109.604 171.378 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' P' ' 129' ' ' ARG . 9.3 mt-10 -55.47 -50.18 70.57 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-O 122.418 1.104 . . . . 0.0 109.48 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.667 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.65 -69.79 0.12 Allowed 'General case' 0 C--N 1.378 1.845 0 CA-C-N 111.872 -2.422 . . . . 0.0 108.719 176.211 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.724 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.5 OUTLIER -59.31 -36.0 74.83 Favored 'General case' 0 C--N 1.391 2.373 0 CA-C-N 112.778 -2.01 . . . . 0.0 108.343 -171.969 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.813 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 25.7 t80 -70.31 -46.92 63.27 Favored 'General case' 0 C--N 1.381 1.966 0 CA-C-N 119.148 0.886 . . . . 0.0 110.338 178.099 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.5 mmp_? -62.51 -15.95 53.15 Favored 'General case' 0 C--N 1.381 1.937 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -168.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -104.51 -39.44 6.41 Favored 'General case' 0 C--N 1.379 1.878 0 C-N-CA 126.592 1.957 . . . . 0.0 107.383 -169.231 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.503 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -156.21 98.71 1.88 Allowed 'General case' 0 C--N 1.388 2.24 0 CA-C-N 111.759 -2.473 . . . . 0.0 109.223 -153.5 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' P' P ' 132' ' ' ARG . . . . . 0.519 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 0.4 OUTLIER -77.32 -11.79 59.88 Favored 'General case' 0 C--N 1.388 2.257 0 CA-C-N 111.784 -2.462 . . . . 0.0 110.466 -164.845 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.677 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 3.4 m-30 -154.12 110.81 3.34 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.362 -162.161 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.724 HD11 ' CD ' ' P' ' 127' ' ' ARG . 19.5 mt -121.33 140.01 52.66 Favored 'General case' 0 C--N 1.396 2.63 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -162.413 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.46 160.56 23.95 Favored 'General case' 0 C--N 1.382 1.983 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 164.399 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.558 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.35 -51.63 80.42 Favored Pre-proline 0 CA--C 1.585 2.312 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -166.495 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 71.4 Cg_exo -58.16 -29.99 89.1 Favored 'Trans proline' 0 C--N 1.399 3.229 0 N-CA-C 115.387 1.264 . . . . 0.0 115.387 -172.679 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.629 ' CB ' HD22 ' P' ' 134' ' ' LEU . 15.7 mp0 -58.72 -66.18 0.54 Allowed 'General case' 0 C--N 1.381 1.942 0 CA-C-O 124.866 2.27 . . . . 0.0 105.468 163.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.765 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -67.64 -41.66 83.53 Favored 'General case' 0 C--N 1.391 2.382 0 CA-C-N 109.659 -3.428 . . . . 0.0 108.71 -153.797 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.611 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 0.7 OUTLIER -53.19 -38.05 62.49 Favored 'General case' 0 C--N 1.381 1.94 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.915 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -65.39 -39.08 91.78 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.226 -1.807 . . . . 0.0 109.051 -172.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.63 ' O ' HG23 ' P' ' 146' ' ' ILE . 0.5 OUTLIER -55.57 -46.21 77.23 Favored 'General case' 0 C--N 1.387 2.212 0 CA-C-O 123.256 1.503 . . . . 0.0 108.515 167.447 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.611 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.44 -35.69 81.27 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 111.738 -2.483 . . . . 0.0 108.967 -178.604 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.579 ' N ' ' O ' ' P' ' 140' ' ' GLU . 4.0 m -73.37 -37.6 65.98 Favored 'General case' 0 C--N 1.387 2.217 0 CA-C-N 114.087 -1.415 . . . . 0.0 109.651 -176.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 37.7 mt -67.3 -49.05 65.77 Favored 'General case' 0 C--N 1.382 1.995 0 CA-C-O 124.492 2.092 . . . . 0.0 108.694 -167.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.974 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.43 -13.54 8.21 Favored 'Isoleucine or valine' 0 C--N 1.389 2.308 0 CA-C-N 110.943 -2.844 . . . . 0.0 108.031 -167.649 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' P' P ' 147' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' P' ' 147' ' ' ARG . 0.0 OUTLIER 82.41 35.62 0.07 Allowed 'General case' 0 C--N 1.382 2.019 0 CA-C-O 125.853 2.74 . . . . 0.0 107.668 153.549 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.974 HD12 HD11 ' P' ' 146' ' ' ILE . 7.6 mt -95.95 172.44 8.01 Favored 'General case' 0 C--N 1.396 2.63 0 CA-C-N 111.472 -2.604 . . . . 0.0 109.352 166.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.565 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -89.09 143.59 31.4 Favored Pre-proline 0 CA--C 1.586 2.333 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 167.605 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.594 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 72.4 Cg_exo -51.4 -46.05 33.76 Favored 'Trans proline' 0 C--N 1.408 3.689 0 C-N-CA 124.252 3.301 . . . . 0.0 114.673 -165.083 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.71 -33.69 48.92 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-N 112.163 -2.29 . . . . 0.0 109.507 170.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.565 ' N ' ' O ' ' P' ' 149' ' ' THR . 48.1 mt-30 -72.5 -28.27 62.77 Favored 'General case' 0 C--N 1.392 2.43 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.73 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.2 t -64.61 -71.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.026 0 CA-C-N 121.798 2.09 . . . . 0.0 109.814 163.301 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.765 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.23 -57.78 0.4 Allowed 'General case' 0 C--N 1.388 2.254 0 C-N-CA 124.466 1.106 . . . . 0.0 110.364 -177.581 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.404 HD13 ' OE1' ' P' ' 158' ' ' GLN . 9.9 mm -59.89 -40.22 82.21 Favored 'Isoleucine or valine' 0 C--N 1.382 1.995 0 CA-C-N 113.311 -1.768 . . . . 0.0 109.47 -173.296 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.81 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.3 t90 -67.45 -31.33 71.43 Favored 'General case' 0 C--N 1.381 1.965 0 O-C-N 121.182 -0.949 . . . . 0.0 109.231 172.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.813 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 66.3 m-85 -74.65 -40.19 61.61 Favored 'General case' 0 C--O 1.273 2.34 0 O-C-N 121.526 -0.734 . . . . 0.0 111.956 173.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.451 ' N ' ' O ' ' P' ' 154' ' ' LYS . 23.8 mt-30 -49.86 -63.62 1.06 Allowed 'General case' 0 C--N 1.378 1.823 0 O-C-N 119.47 -2.018 . . . . 0.0 106.821 167.514 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -56.7 -19.29 15.84 Favored 'General case' 0 C--N 1.388 2.28 0 CA-C-O 117.907 -1.044 . . . . 0.0 110.446 -164.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.528 ' ND1' ' CZ ' ' P' ' 128' ' ' PHE . 14.7 t-80 -76.48 -52.51 9.67 Favored 'General case' 0 C--O 1.279 2.639 0 CA-C-N 120.743 1.61 . . . . 0.0 111.084 171.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.677 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.921 0 CA-C-N 122.535 2.425 . . . . 0.0 111.06 -158.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.496 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 3.2 m-85 . . . . . 0 C--O 1.257 1.455 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.24 148.11 52.32 Favored 'General case' 0 C--N 1.383 2.035 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 -171.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' P' ' 122' ' ' TYR . 34.4 ttmt -42.71 -36.09 1.33 Allowed 'General case' 0 C--N 1.382 2.003 0 CA-C-N 113.923 -1.489 . . . . 0.0 109.446 -177.422 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.87 -67.8 0.23 Allowed 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.148 -1.842 . . . . 0.0 109.161 173.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.561 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.2 mt-30 -49.9 -50.77 44.83 Favored 'General case' 0 C--N 1.382 1.986 0 CA-C-N 112.437 -2.165 . . . . 0.0 109.399 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.761 ' HA ' HD12 ' P' ' 124' ' ' LEU . 21.5 m -49.75 -56.86 8.68 Favored 'General case' 0 C--N 1.382 1.994 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 170.543 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.544 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 1.0 OUTLIER -53.23 -45.51 68.74 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 122.29 1.043 . . . . 0.0 109.74 -170.996 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.968 ' CD ' HG22 ' P' ' 146' ' ' ILE . 6.9 mt-10 -66.9 -38.56 86.48 Favored 'General case' 0 C--N 1.379 1.853 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.607 178.218 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.829 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.4 mt -60.71 -50.01 75.22 Favored 'General case' 0 C--N 1.382 2.005 0 O-C-N 119.62 -1.925 . . . . 0.0 109.9 171.157 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' P' ' 129' ' ' ARG . 20.1 mt-10 -55.75 -52.18 64.8 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-O 122.613 1.197 . . . . 0.0 109.55 177.158 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.544 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.38 -60.18 1.15 Allowed 'General case' 0 C--N 1.38 1.898 0 CA-C-N 112.128 -2.305 . . . . 0.0 109.362 176.032 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.817 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -70.5 -32.04 69.38 Favored 'General case' 0 C--N 1.397 2.638 0 CA-C-N 112.274 -2.239 . . . . 0.0 108.343 -167.097 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.765 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.3 t80 -67.94 -53.04 29.36 Favored 'General case' 0 C--N 1.384 2.072 0 CA-C-O 121.832 0.825 . . . . 0.0 109.397 170.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.411 ' N ' ' O ' ' P' ' 125' ' ' GLU . 19.6 mmm180 -62.72 -17.77 61.35 Favored 'General case' 0 C--N 1.379 1.888 0 CA-C-N 113.213 -1.812 . . . . 0.0 108.239 -163.462 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 130' ' ' GLN . . . . . 0.42 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 35.9 mt-30 -88.22 -51.68 5.63 Favored 'General case' 0 C--N 1.379 1.882 0 CA-C-O 123.811 1.767 . . . . 0.0 106.482 -179.494 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.31 125.5 4.43 Favored 'General case' 0 C--N 1.394 2.522 0 CA-C-N 112.19 -2.277 . . . . 0.0 110.843 -168.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 132' ' ' ARG . . . . . 0.657 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 3.7 ptt-85 -80.02 -6.52 57.74 Favored 'General case' 0 C--N 1.393 2.47 0 CA-C-N 111.774 -2.467 . . . . 0.0 111.318 -160.247 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.723 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 3.0 m-30 -148.27 115.01 6.03 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 125.297 2.475 . . . . 0.0 109.768 -161.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.553 HD22 ' HG3' ' P' ' 138' ' ' GLU . 67.2 mt -125.3 133.91 52.45 Favored 'General case' 0 C--N 1.415 3.425 0 O-C-N 119.851 -1.781 . . . . 0.0 108.826 -162.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.33 158.2 21.24 Favored 'General case' 0 C--N 1.381 1.978 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 168.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.575 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.15 -50.36 88.17 Favored Pre-proline 0 CA--C 1.584 2.285 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -161.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 77.7 Cg_exo -58.66 -28.86 87.61 Favored 'Trans proline' 0 C--N 1.401 3.338 0 N-CA-C 115.185 1.186 . . . . 0.0 115.185 -175.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.553 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -53.45 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.379 1.864 0 CA-C-O 124.295 1.997 . . . . 0.0 106.483 159.895 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 1.028 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.51 -34.87 74.93 Favored 'General case' 0 C--N 1.387 2.226 0 CA-C-N 109.919 -3.31 . . . . 0.0 109.159 -155.124 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.651 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 2.7 mt-10 -52.42 -42.94 64.52 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-O 123.493 1.616 . . . . 0.0 108.137 175.284 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -64.76 -35.67 81.82 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 112.501 -2.136 . . . . 0.0 108.97 -169.263 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.817 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.1 tp -65.91 -43.03 89.36 Favored 'General case' 0 C--N 1.382 1.998 0 CA-C-O 123.201 1.477 . . . . 0.0 109.163 168.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -55.34 -35.82 65.62 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.036 174.214 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.581 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.7 OUTLIER -72.43 -43.17 64.2 Favored 'General case' 0 C--N 1.389 2.29 0 CA-C-N 113.762 -1.563 . . . . 0.0 110.407 -178.113 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 81.3 mt -66.11 -44.87 83.05 Favored 'General case' 0 C--N 1.379 1.89 0 CA-C-O 124.838 2.256 . . . . 0.0 108.301 -164.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 1.01 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -98.83 -13.42 8.09 Favored 'Isoleucine or valine' 0 C--N 1.39 2.344 0 CA-C-N 110.905 -2.861 . . . . 0.0 108.064 -166.249 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 81.8 34.98 0.08 Allowed 'General case' 0 C--N 1.381 1.975 0 CA-C-O 125.586 2.612 . . . . 0.0 107.946 153.251 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 1.01 HD12 HD11 ' P' ' 146' ' ' ILE . 8.6 mt -95.63 172.36 8.1 Favored 'General case' 0 C--N 1.396 2.593 0 CA-C-N 111.47 -2.605 . . . . 0.0 109.078 167.31 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.586 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.1 p -91.27 141.53 26.29 Favored Pre-proline 0 CA--C 1.589 2.454 0 CA-C-O 122.795 1.283 . . . . 0.0 108.264 166.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.538 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 0.3 OUTLIER -48.21 -46.99 20.94 Favored 'Trans proline' 0 C--N 1.403 3.429 0 C-N-CA 124.934 3.756 . . . . 0.0 115.404 -167.289 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' P' P ' 151' ' ' THR . . . . . 0.465 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -52.85 -30.55 34.39 Favored 'General case' 0 C--N 1.383 2.065 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.112 169.278 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.586 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.3 mt-30 -73.87 -30.58 62.72 Favored 'General case' 0 C--N 1.391 2.401 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 179.407 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.696 HG13 ' CD2' ' P' ' 157' ' ' PHE . 0.9 OUTLIER -64.07 -67.05 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.382 2.018 0 CA-C-N 122.011 2.187 . . . . 0.0 109.743 165.803 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 1.028 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -32.93 -60.08 0.33 Allowed 'General case' 0 C--N 1.387 2.201 0 C-N-CA 124.615 1.166 . . . . 0.0 110.845 -177.254 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.418 HD13 ' OE1' ' P' ' 158' ' ' GLN . 37.5 mm -64.78 -34.94 73.5 Favored 'Isoleucine or valine' 0 C--N 1.382 2.01 0 CA-C-N 112.794 -2.003 . . . . 0.0 108.756 -169.592 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.829 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.1 t90 -67.47 -33.07 74.37 Favored 'General case' 0 C--N 1.384 2.109 0 O-C-N 121.691 -0.631 . . . . 0.0 109.353 168.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.765 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 39.2 m-85 -74.89 -41.71 59.24 Favored 'General case' 0 C--O 1.272 2.272 0 O-C-N 120.966 -1.084 . . . . 0.0 111.94 174.599 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' P' ' 154' ' ' LYS . 77.3 mt-30 -50.98 -59.8 3.77 Favored 'General case' 0 C--N 1.377 1.77 0 O-C-N 119.785 -1.822 . . . . 0.0 106.703 170.016 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -56.5 -20.28 19.57 Favored 'General case' 0 C--N 1.389 2.314 0 CA-C-O 117.409 -1.281 . . . . 0.0 110.333 -168.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.561 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.8 OUTLIER -76.39 -50.35 14.42 Favored 'General case' 0 C--O 1.282 2.816 0 CA-C-N 121.2 1.818 . . . . 0.0 110.313 174.666 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.723 ' HD3' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.019 0 CA-C-N 122.784 2.538 . . . . 0.0 111.166 -158.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.677 ' CD1' HD22 ' P' ' 148' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.272 2.268 0 CA-C-O 118.215 -0.898 . . . . 0.0 109.71 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -69.81 155.48 40.49 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 122.831 2.56 . . . . 0.0 110.006 -172.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.502 ' HB2' ' HE3' ' P' ' 118' ' ' LYS . 0.2 OUTLIER -43.92 -37.12 2.71 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 122.329 1.062 . . . . 0.0 111.223 176.515 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.21 -58.31 9.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 122.953 1.359 . . . . 0.0 110.206 172.224 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.611 ' O ' HD12 ' P' ' 124' ' ' LEU . 78.6 mt-30 -55.51 -47.9 75.5 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.775 177.387 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.503 ' HA ' HD12 ' P' ' 124' ' ' LEU . 3.2 m -53.03 -44.93 67.72 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.348 -0.845 . . . . 0.0 110.242 170.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.508 ' CE2' ' NH1' ' P' ' 126' ' ' ARG . 11.1 t80 -65.43 -40.24 93.07 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 121.714 -0.616 . . . . 0.0 111.088 -171.812 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.64 ' HB2' HG21 ' P' ' 146' ' ' ILE . 0.0 OUTLIER -71.46 -26.71 62.83 Favored 'General case' 0 C--O 1.265 1.878 0 O-C-N 120.83 -1.169 . . . . 0.0 111.303 169.606 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.611 HD12 ' O ' ' P' ' 120' ' ' GLN . 1.4 mt -73.67 -40.65 63.53 Favored 'General case' 0 C--O 1.247 0.931 0 O-C-N 119.026 -2.296 . . . . 0.0 110.739 172.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 125' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -61.5 -45.68 93.2 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 123.152 1.453 . . . . 0.0 111.442 171.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.508 ' NH1' ' CE2' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -45.92 -65.1 0.59 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.941 172.451 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.798 ' HG3' HD13 ' P' ' 142' ' ' LEU . 0.7 OUTLIER -65.22 -31.32 72.43 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 118.652 -0.69 . . . . 0.0 109.911 -172.463 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.627 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 26.1 t80 -75.78 -44.69 40.17 Favored 'General case' 0 C--O 1.264 1.831 0 CA-C-N 120.685 1.584 . . . . 0.0 112.974 171.351 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 129' ' ' ARG . . . . . . . . . . . . . 5.8 mtp180 -67.23 -13.58 62.11 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 119.12 -2.237 . . . . 0.0 110.502 -173.158 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -106.0 -33.62 7.85 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 126.369 1.867 . . . . 0.0 111.559 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.51 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -151.8 108.58 3.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 123.862 1.791 . . . . 0.0 112.665 -167.762 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' P' P ' 132' ' ' ARG . . . . . 0.421 ' HB3' ' CD2' ' P' ' 133' ' ' TYR . 4.2 mtt85 -77.79 -9.14 58.87 Favored 'General case' 0 C--O 1.244 0.779 0 O-C-N 120.444 -1.41 . . . . 0.0 113.649 -171.031 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.421 ' CD2' ' HB3' ' P' ' 132' ' ' ARG . 98.2 m-85 -152.74 116.78 4.86 Favored 'General case' 0 C--O 1.26 1.647 0 C-N-CA 123.712 0.805 . . . . 0.0 109.765 -168.605 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.598 HD22 ' HB3' ' P' ' 138' ' ' GLU . 23.7 mt -123.11 143.34 50.05 Favored 'General case' 0 C--O 1.276 2.483 0 O-C-N 119.362 -2.086 . . . . 0.0 111.336 -166.113 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.58 162.7 19.71 Favored 'General case' 0 C--O 1.26 1.647 0 CA-C-N 124.492 3.315 . . . . 0.0 110.137 168.821 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.898 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -50.77 -60.49 5.38 Favored Pre-proline 0 C--O 1.253 1.274 0 O-C-N 119.974 -1.704 . . . . 0.0 111.585 -170.455 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.898 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 85.3 Cg_exo -50.67 -31.23 31.52 Favored 'Trans proline' 1 N--CA 1.538 4.128 1 C-N-CA 125.321 4.014 . . . . 0.0 115.57 -177.392 . . . . . . . . 4 3 . 1 . 017 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.598 ' HB3' HD22 ' P' ' 134' ' ' LEU . 2.3 mm-40 -65.54 -61.15 2.26 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 126.101 2.857 . . . . 0.0 108.638 167.516 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.623 ' NE ' ' HG3' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -74.99 -22.82 58.3 Favored 'General case' 0 C--O 1.276 2.464 0 CA-C-N 112.273 -2.24 . . . . 0.0 113.102 -166.582 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.668 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 3.5 mt-10 -68.78 -39.4 80.2 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 123.844 3.02 . . . . 0.0 111.297 169.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -59.99 -33.72 72.34 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.633 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.798 HD13 ' HG3' ' P' ' 127' ' ' ARG . 0.9 OUTLIER -68.85 -37.14 78.91 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.058 0.932 . . . . 0.0 109.552 169.954 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.68 -36.68 69.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.219 172.012 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 1.6 t -72.09 -42.54 66.04 Favored 'General case' 0 C--O 1.266 1.952 0 N-CA-C 113.971 1.101 . . . . 0.0 113.971 176.118 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 145' ' ' LEU . . . . . 0.579 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 87.1 mt -66.99 -46.0 75.91 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 125.586 2.612 . . . . 0.0 108.674 -168.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 1.012 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -94.13 -15.36 7.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-N 112.311 -2.222 . . . . 0.0 110.381 -175.499 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' P' P ' 147' ' ' ARG . . . . . 0.579 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.1 OUTLIER 76.75 43.65 0.13 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 123.844 1.783 . . . . 0.0 112.122 165.399 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 1.012 HD12 HD11 ' P' ' 146' ' ' ILE . 5.6 mt -103.7 164.91 11.37 Favored 'General case' 0 C--O 1.253 1.273 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.212 168.166 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.512 ' HB ' ' HD2' ' P' ' 150' ' ' PRO . 7.1 p -77.42 153.95 81.71 Favored Pre-proline 0 C--N 1.321 -0.662 0 O-C-N 120.452 -1.405 . . . . 0.0 109.263 169.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.512 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 9.0 Cg_endo -60.0 -45.14 25.48 Favored 'Trans proline' 0 N--CA 1.533 3.825 0 C-N-CA 124.418 3.412 . . . . 0.0 114.184 -171.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 1.1 m -60.48 -20.08 58.87 Favored 'General case' 0 C--O 1.27 2.18 0 CA-C-N 122.274 2.306 . . . . 0.0 112.61 166.45 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.472 ' HB3' ' CE1' ' P' ' 116' ' ' PHE . 40.2 mt-30 -74.35 -28.4 61.12 Favored 'General case' 0 C--O 1.276 2.452 0 CA-C-N 123.853 3.024 . . . . 0.0 108.442 169.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.564 ' O ' ' HD1' ' P' ' 157' ' ' PHE . 1.2 t -72.41 -63.17 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 CA-C-N 124.585 3.357 . . . . 0.0 111.465 168.482 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.623 ' HG3' ' NE ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -42.47 -50.04 5.24 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.13 0.972 . . . . 0.0 111.934 -179.51 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.486 HD13 ' HA ' ' P' ' 155' ' ' ILE . 0.8 OUTLIER -56.67 -52.91 48.12 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 O-C-N 121.539 -0.726 . . . . 0.0 110.9 177.373 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.548 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.1 t90 -57.56 -29.98 64.86 Favored 'General case' 0 C--O 1.245 0.865 0 O-C-N 121.265 -0.897 . . . . 0.0 110.0 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.627 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 10.3 m-85 -76.71 -41.38 45.46 Favored 'General case' 0 C--O 1.288 3.113 0 O-C-N 120.227 -1.545 . . . . 0.0 112.999 171.498 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -51.5 -65.97 0.47 Allowed 'General case' 0 C--N 1.314 -0.957 0 O-C-N 116.624 -3.798 . . . . 0.0 110.863 165.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -58.38 -21.24 49.54 Favored 'General case' 0 C--O 1.276 2.463 0 CA-C-O 115.698 -2.096 . . . . 0.0 111.405 -171.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.474 ' NE2' ' CZ2' ' P' ' 156' ' ' TRP . 0.2 OUTLIER -73.25 -56.87 4.51 Favored 'General case' 0 C--O 1.28 2.696 0 CA-C-N 124.924 3.511 . . . . 0.0 112.93 169.929 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' P' P ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.27 2.182 0 O-C-N 117.962 -2.961 . . . . 0.0 113.651 -170.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.544 ' CD1' ' CD2' ' P' ' 148' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.256 1.416 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 117' ' ' THR . . . . . 0.433 ' O ' ' N ' ' P' ' 121' ' ' THR . 1.3 p -65.25 150.03 48.93 Favored 'General case' 0 C--N 1.382 2.02 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 -168.791 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' P' ' 122' ' ' TYR . 33.2 ttmt -45.06 -35.92 3.28 Favored 'General case' 0 C--N 1.382 1.98 0 CA-C-N 114.5 -1.227 . . . . 0.0 109.212 -178.071 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.2 -59.7 4.23 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-O 124.361 2.029 . . . . 0.0 109.49 174.259 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.555 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.6 mt-30 -60.24 -48.09 83.2 Favored 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.332 2.253 . . . . 0.0 109.949 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.635 ' HA ' HD12 ' P' ' 124' ' ' LEU . 4.2 m -47.47 -55.94 8.03 Favored 'General case' 0 C--N 1.385 2.139 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 167.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.587 ' CZ ' ' HG3' ' P' ' 126' ' ' ARG . 0.0 OUTLIER -52.85 -51.37 61.29 Favored 'General case' 0 C--N 1.38 1.912 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.023 -168.498 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.952 ' CD ' HG22 ' P' ' 146' ' ' ILE . 7.8 mt-10 -65.34 -36.37 83.81 Favored 'General case' 0 C--N 1.379 1.869 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.764 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.698 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.3 mt -60.01 -51.87 67.83 Favored 'General case' 0 C--N 1.383 2.062 0 O-C-N 120.885 -1.135 . . . . 0.0 109.735 170.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.469 ' O ' ' N ' ' P' ' 129' ' ' ARG . 19.1 mt-10 -55.89 -49.49 73.25 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-O 122.638 1.208 . . . . 0.0 109.738 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.587 ' HG3' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -42.39 -70.41 0.11 Allowed 'General case' 0 C--N 1.378 1.826 0 CA-C-N 111.896 -2.411 . . . . 0.0 108.717 176.464 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.653 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.3 OUTLIER -58.7 -36.59 74.49 Favored 'General case' 0 C--N 1.393 2.484 0 CA-C-N 112.641 -2.072 . . . . 0.0 108.393 -171.179 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.774 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 25.9 t80 -70.42 -47.23 61.73 Favored 'General case' 0 C--N 1.38 1.924 0 CA-C-O 121.638 0.732 . . . . 0.0 110.346 179.175 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.513 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 0.0 OUTLIER -62.52 -20.62 64.82 Favored 'General case' 0 C--N 1.381 1.949 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -168.585 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -94.06 -44.15 8.17 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-O 123.886 1.803 . . . . 0.0 106.576 -169.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.31 127.34 5.62 Favored 'General case' 0 C--N 1.394 2.51 0 CA-C-N 112.005 -2.361 . . . . 0.0 109.957 -163.235 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.03 -20.14 49.7 Favored 'General case' 0 C--N 1.397 2.673 0 CA-C-N 111.366 -2.652 . . . . 0.0 110.616 -158.313 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.674 ' HD1' ' CZ ' ' P' ' 161' ' ' ARG . 18.0 m-85 -153.0 115.57 4.48 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-O 124.946 2.307 . . . . 0.0 109.094 -154.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.544 HD22 ' HG3' ' P' ' 138' ' ' GLU . 35.8 mt -113.27 139.41 48.84 Favored 'General case' 0 C--N 1.417 3.534 0 O-C-N 119.65 -1.906 . . . . 0.0 108.724 -166.193 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 135' ' ' SER . . . . . 0.409 ' HB2' ' HD2' ' P' ' 137' ' ' PRO . 0.0 OUTLIER -79.25 154.52 29.12 Favored 'General case' 0 C--N 1.384 2.106 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 158.39 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' P' P ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.29 -42.94 97.46 Favored Pre-proline 0 CA--C 1.583 2.224 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.455 -162.453 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.409 ' HD2' ' HB2' ' P' ' 135' ' ' SER . 0.0 OUTLIER -48.28 -48.48 16.76 Favored 'Trans proline' 0 C--N 1.394 2.942 0 C-N-CA 121.706 1.604 . . . . 0.0 115.903 -178.747 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.544 ' HG3' HD22 ' P' ' 134' ' ' LEU . 5.0 mm-40 -52.85 -60.79 2.83 Favored 'General case' 0 C--N 1.394 2.506 0 CA-C-O 123.89 1.805 . . . . 0.0 106.183 175.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.645 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -70.03 -33.58 72.16 Favored 'General case' 0 C--O 1.27 2.171 0 CA-C-N 109.662 -3.426 . . . . 0.0 109.494 -161.726 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.677 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 6.8 mt-10 -52.76 -47.84 67.18 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-N 121.434 1.925 . . . . 0.0 107.783 169.12 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -68.08 -36.67 80.2 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-N 112.241 -2.254 . . . . 0.0 109.033 -164.011 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.653 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.0 OUTLIER -65.96 -42.07 90.39 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-O 123.177 1.465 . . . . 0.0 109.073 168.768 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -55.71 -36.69 67.46 Favored 'General case' 0 C--N 1.389 2.319 0 CA-C-N 112.646 -2.07 . . . . 0.0 108.413 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.599 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.6 t -72.8 -41.18 65.22 Favored 'General case' 0 C--N 1.388 2.261 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.545 -178.613 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 77.8 mt -66.76 -50.9 61.24 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-O 124.882 2.277 . . . . 0.0 108.048 -165.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.963 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -90.7 -17.94 7.69 Favored 'Isoleucine or valine' 0 C--N 1.387 2.229 0 CA-C-N 110.406 -3.088 . . . . 0.0 107.949 -172.883 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 81.84 38.35 0.06 Allowed 'General case' 0 C--N 1.386 2.161 0 CA-C-N 111.414 -2.63 . . . . 0.0 107.981 153.353 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.963 HD12 HD11 ' P' ' 146' ' ' ILE . 6.0 mt -94.92 172.84 7.91 Favored 'General case' 0 C--N 1.39 2.356 0 CA-C-N 112.018 -2.356 . . . . 0.0 109.165 166.216 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.528 ' O ' ' N ' ' P' ' 152' ' ' GLN . 16.8 p -87.84 145.29 36.4 Favored Pre-proline 0 CA--C 1.585 2.304 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 168.676 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.543 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 65.9 Cg_exo -49.56 -48.28 19.58 Favored 'Trans proline' 0 C--N 1.408 3.701 0 C-N-CA 124.078 3.185 . . . . 0.0 113.909 -167.126 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.52 -26.27 54.12 Favored 'General case' 0 C--N 1.388 2.255 0 CA-C-N 112.174 -2.285 . . . . 0.0 110.339 173.188 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' P' ' 149' ' ' THR . 47.3 mt-30 -77.58 -28.44 51.67 Favored 'General case' 0 C--N 1.392 2.42 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 174.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.593 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.0 OUTLIER -64.19 -70.5 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.954 0 CA-C-N 122.326 2.33 . . . . 0.0 109.545 163.395 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.645 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.0 -59.21 0.43 Allowed 'General case' 0 C--N 1.385 2.149 0 C-N-CA 124.869 1.267 . . . . 0.0 110.338 -176.818 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.446 HD13 ' HA ' ' P' ' 155' ' ' ILE . 9.4 mm -64.03 -34.5 68.98 Favored 'Isoleucine or valine' 0 C--N 1.385 2.12 0 CA-C-N 112.898 -1.955 . . . . 0.0 110.163 -171.276 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.698 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.7 t90 -67.45 -31.55 71.79 Favored 'General case' 0 C--N 1.381 1.95 0 O-C-N 121.305 -0.872 . . . . 0.0 109.472 168.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.774 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 65.0 m-85 -74.62 -40.24 61.64 Favored 'General case' 0 C--O 1.273 2.338 0 O-C-N 121.436 -0.79 . . . . 0.0 111.975 172.463 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.519 ' N ' ' O ' ' P' ' 154' ' ' LYS . 39.3 mt-30 -54.25 -59.67 4.36 Favored 'General case' 0 C--N 1.378 1.823 0 O-C-N 119.592 -1.943 . . . . 0.0 106.244 170.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -57.11 -24.74 56.27 Favored 'General case' 0 C--N 1.389 2.32 0 CA-C-O 117.509 -1.234 . . . . 0.0 109.935 -169.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.548 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.5 OUTLIER -79.08 -41.84 27.79 Favored 'General case' 0 C--O 1.284 2.92 0 CA-C-N 121.779 2.082 . . . . 0.0 111.323 177.719 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.674 ' CZ ' ' HD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.264 1.818 0 CA-C-N 122.946 2.612 . . . . 0.0 109.955 -176.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.514 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.0 m-85 . . . . . 0 C--O 1.257 1.452 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.82 148.05 52.44 Favored 'General case' 0 C--N 1.382 1.994 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 -170.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' P' P ' 118' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' P' ' 122' ' ' TYR . 31.5 ttmt -43.24 -36.37 1.76 Allowed 'General case' 0 C--N 1.382 1.979 0 CA-C-N 113.425 -1.716 . . . . 0.0 109.218 -177.77 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 119' ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' P' ' 122' ' ' TYR . . . -53.68 -66.78 0.33 Allowed 'General case' 0 C--N 1.382 1.978 0 CA-C-O 124.178 1.942 . . . . 0.0 109.14 174.075 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.0 mt-30 -48.52 -49.35 36.44 Favored 'General case' 0 C--N 1.382 2.001 0 CA-C-N 112.448 -2.16 . . . . 0.0 109.527 177.298 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.721 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.5 m -51.6 -54.27 29.51 Favored 'General case' 0 C--N 1.384 2.101 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 171.528 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.664 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.9 OUTLIER -52.96 -46.5 68.23 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 122.428 1.109 . . . . 0.0 110.095 -172.085 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.713 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.89 -38.74 86.83 Favored 'General case' 0 C--N 1.379 1.871 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.87 179.84 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' P' ' 121' ' ' THR . 1.3 mt -60.56 -50.23 74.36 Favored 'General case' 0 C--N 1.385 2.112 0 O-C-N 120.305 -1.497 . . . . 0.0 109.525 172.404 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.457 ' O ' ' N ' ' P' ' 129' ' ' ARG . 23.4 mt-10 -55.81 -50.35 70.77 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-O 122.626 1.203 . . . . 0.0 109.653 177.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.664 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.46 -68.38 0.19 Allowed 'General case' 0 C--N 1.378 1.808 0 CA-C-N 112.09 -2.323 . . . . 0.0 108.844 175.184 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.769 ' CG ' HD13 ' P' ' 142' ' ' LEU . 1.1 mmt85 -60.56 -36.19 77.89 Favored 'General case' 0 C--N 1.386 2.165 0 CA-C-N 113.06 -1.882 . . . . 0.0 108.418 -170.4 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.796 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 13.7 t80 -70.2 -48.09 58.67 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-N 119.066 0.848 . . . . 0.0 110.123 176.172 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' P' ' 125' ' ' GLU . 14.7 mtm180 -62.5 -18.88 62.88 Favored 'General case' 0 C--N 1.381 1.945 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 -168.132 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -95.35 -41.04 9.21 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 123.975 1.845 . . . . 0.0 107.059 -173.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.442 ' OE1' HD21 ' P' ' 134' ' ' LEU . 1.8 tt0 -156.46 123.59 5.3 Favored 'General case' 0 C--N 1.393 2.487 0 CA-C-N 111.888 -2.414 . . . . 0.0 108.982 -156.572 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 132' ' ' ARG . . . . . 0.445 ' NH1' ' HG3' ' P' ' 132' ' ' ARG . 0.0 OUTLIER -77.73 -16.54 58.37 Favored 'General case' 0 C--N 1.384 2.08 0 CA-C-N 111.805 -2.452 . . . . 0.0 110.249 -172.021 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' P' P ' 133' ' ' TYR . . . . . 0.458 ' HD1' ' HA ' ' P' ' 133' ' ' TYR . 0.2 OUTLIER -155.27 123.84 6.02 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-O 124.886 2.279 . . . . 0.0 109.308 -154.255 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.523 HD11 ' HD3' ' P' ' 127' ' ' ARG . 30.9 mt -136.05 136.93 40.63 Favored 'General case' 0 C--N 1.404 2.954 0 O-C-N 119.884 -1.76 . . . . 0.0 109.359 -164.243 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 135' ' ' SER . . . . . 0.402 ' HB2' ' HD2' ' P' ' 137' ' ' PRO . 0.1 OUTLIER -82.45 151.71 26.44 Favored 'General case' 0 C--N 1.383 2.05 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 172.948 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' P' P ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.68 -39.49 76.98 Favored Pre-proline 0 CA--C 1.588 2.406 0 O-C-N 121.405 -0.81 . . . . 0.0 109.259 -165.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.402 ' HD2' ' HB2' ' P' ' 135' ' ' SER . 0.1 OUTLIER -55.71 -42.56 66.24 Favored 'Trans proline' 0 C--N 1.396 3.033 0 N-CA-C 119.2 2.731 . . . . 0.0 119.2 175.638 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.413 ' HB3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -49.32 -71.28 0.07 Allowed 'General case' 0 C--N 1.379 1.855 0 CA-C-O 124.626 2.155 . . . . 0.0 107.548 162.771 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.824 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.26 -37.07 77.75 Favored 'General case' 0 C--N 1.391 2.376 0 CA-C-N 109.563 -3.471 . . . . 0.0 108.492 -157.37 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.636 ' O ' ' N ' ' P' ' 144' ' ' SER . 2.4 mt-10 -53.29 -40.3 64.63 Favored 'General case' 0 C--N 1.381 1.952 0 CA-C-O 123.103 1.43 . . . . 0.0 108.023 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 141' ' ' HIS . . . . . 0.424 ' O ' ' HB3' ' P' ' 144' ' ' SER . 3.9 t-160 -63.3 -36.0 82.23 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-N 112.937 -1.938 . . . . 0.0 108.445 -171.153 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.769 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.7 tp -66.02 -43.19 88.39 Favored 'General case' 0 C--N 1.383 2.024 0 CA-C-O 123.037 1.399 . . . . 0.0 109.16 168.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.628 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.07 -33.17 64.78 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 112.75 -2.023 . . . . 0.0 108.28 173.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.636 ' N ' ' O ' ' P' ' 140' ' ' GLU . 7.4 t -73.5 -44.26 58.2 Favored 'General case' 0 C--N 1.387 2.228 0 CA-C-N 113.631 -1.622 . . . . 0.0 109.698 -177.347 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 83.0 mt -68.04 -44.22 76.9 Favored 'General case' 0 C--N 1.38 1.933 0 CA-C-O 124.793 2.235 . . . . 0.0 108.255 -163.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 1.009 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -100.2 -13.08 8.31 Favored 'Isoleucine or valine' 0 C--N 1.39 2.34 0 CA-C-N 110.931 -2.85 . . . . 0.0 107.916 -167.696 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 82.37 34.74 0.07 Allowed 'General case' 0 C--N 1.382 1.993 0 CA-C-O 125.508 2.575 . . . . 0.0 107.942 152.519 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 1.009 HD12 HD11 ' P' ' 146' ' ' ILE . 9.3 mt -96.26 169.59 9.83 Favored 'General case' 0 C--N 1.397 2.637 0 CA-C-N 111.573 -2.558 . . . . 0.0 109.516 170.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.648 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.5 p -91.56 139.81 25.17 Favored Pre-proline 0 CA--C 1.593 2.597 0 CA-C-O 122.661 1.22 . . . . 0.0 108.543 170.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.417 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 15.0 Cg_exo -56.07 -35.31 94.67 Favored 'Trans proline' 1 C--N 1.415 4.047 0 C-N-CA 122.688 2.259 . . . . 0.0 112.92 -159.674 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 1.3 m -59.65 -28.5 67.3 Favored 'General case' 0 C--N 1.384 2.071 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.866 167.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.648 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -72.8 -30.83 64.39 Favored 'General case' 0 C--O 1.271 2.197 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.609 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.4 t -64.35 -74.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 122.094 2.224 . . . . 0.0 109.326 164.236 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.824 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -38.22 -45.71 0.99 Allowed 'General case' 0 C--N 1.385 2.128 0 C-N-CA 125.452 1.501 . . . . 0.0 110.873 -173.069 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' P' P ' 155' ' ' ILE . . . . . 0.542 HD13 ' HA ' ' P' ' 155' ' ' ILE . 0.7 OUTLIER -59.28 -64.72 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.382 2.015 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 -179.445 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.721 ' HB3' HD22 ' P' ' 124' ' ' LEU . 2.1 t90 -49.6 -30.9 9.53 Favored 'General case' 0 C--N 1.385 2.126 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -176.408 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.796 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 45.9 m-85 -74.57 -44.93 48.54 Favored 'General case' 0 C--O 1.278 2.598 0 O-C-N 121.252 -0.905 . . . . 0.0 112.228 171.215 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -46.05 -64.31 0.78 Allowed 'General case' 0 C--N 1.378 1.815 0 O-C-N 119.0 -2.312 . . . . 0.0 107.005 167.256 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -55.97 -21.54 21.62 Favored 'General case' 0 C--N 1.386 2.193 0 CA-C-O 117.431 -1.271 . . . . 0.0 110.551 -164.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.534 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 3.1 t-160 -80.69 -41.58 23.44 Favored 'General case' 0 C--O 1.292 3.31 0 CA-C-N 121.621 2.01 . . . . 0.0 112.436 176.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.507 ' NH2' ' HB3' ' P' ' 157' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.267 1.984 0 CA-C-N 123.825 3.011 . . . . 0.0 109.116 -167.505 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 116' ' ' PHE . . . . . 0.4 ' CD1' ' CD2' ' P' ' 148' ' ' LEU . 2.1 m-85 . . . . . 0 C--O 1.257 1.496 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.1 p -66.01 149.48 50.17 Favored 'General case' 0 C--N 1.383 2.026 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 -171.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -45.06 -36.9 3.81 Favored 'General case' 0 C--N 1.381 1.973 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.067 -177.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.5 -57.91 9.02 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 113.136 -1.847 . . . . 0.0 109.655 175.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' P' P ' 120' ' ' GLN . . . . . 0.572 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.7 mt-30 -60.9 -48.66 80.77 Favored 'General case' 0 C--N 1.382 2.01 0 C-N-CA 126.728 2.011 . . . . 0.0 109.694 179.609 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 121' ' ' THR . . . . . 0.691 ' HA ' HD12 ' P' ' 124' ' ' LEU . 5.7 m -47.6 -54.68 11.15 Favored 'General case' 0 C--N 1.383 2.062 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 169.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 122' ' ' TYR . . . . . 0.57 ' CZ ' ' HG3' ' P' ' 126' ' ' ARG . 0.0 OUTLIER -52.3 -51.17 60.1 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.09 -170.361 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' P' P ' 123' ' ' GLU . . . . . 0.942 ' CD ' HG22 ' P' ' 146' ' ' ILE . 7.8 mt-10 -64.89 -37.38 87.45 Favored 'General case' 0 C--N 1.379 1.89 0 CA-C-N 113.964 -1.471 . . . . 0.0 107.601 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 124' ' ' LEU . . . . . 0.705 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.3 mt -60.82 -49.67 76.56 Favored 'General case' 0 C--N 1.384 2.097 0 O-C-N 120.967 -1.083 . . . . 0.0 110.28 171.174 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 125' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' P' ' 129' ' ' ARG . 27.2 mt-10 -53.97 -55.39 27.53 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-O 122.347 1.07 . . . . 0.0 108.394 176.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 126' ' ' ARG . . . . . 0.603 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -39.08 -68.38 0.17 Allowed 'General case' 0 C--N 1.379 1.861 0 CA-C-N 111.935 -2.393 . . . . 0.0 108.882 179.697 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' P' P ' 127' ' ' ARG . . . . . 0.889 ' HG2' HD13 ' P' ' 142' ' ' LEU . 0.0 OUTLIER -58.54 -34.47 71.05 Favored 'General case' 0 C--N 1.394 2.536 0 CA-C-N 112.673 -2.058 . . . . 0.0 108.469 -174.831 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' P' P ' 128' ' ' PHE . . . . . 0.715 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 9.0 t80 -67.73 -50.94 54.72 Favored 'General case' 0 C--N 1.388 2.264 0 O-C-N 121.213 -0.93 . . . . 0.0 110.382 176.615 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 129' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' P' ' 125' ' ' GLU . 3.2 mmm180 -62.56 -13.15 27.79 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 112.894 -1.957 . . . . 0.0 108.073 -165.353 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -107.88 -39.74 5.46 Favored 'General case' 0 C--N 1.379 1.886 0 C-N-CA 126.319 1.848 . . . . 0.0 107.444 -169.421 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' P' P ' 131' ' ' GLN . . . . . 0.511 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.4 OUTLIER -153.99 109.08 3.13 Favored 'General case' 0 C--N 1.386 2.164 0 CA-C-N 112.003 -2.362 . . . . 0.0 109.34 -152.914 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -77.04 -18.09 58.33 Favored 'General case' 0 C--N 1.393 2.479 0 CA-C-N 112.45 -2.159 . . . . 0.0 110.556 -167.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' P' P ' 133' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -156.81 112.51 2.92 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-N 114.212 -1.358 . . . . 0.0 108.065 -154.324 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' P' P ' 134' ' ' LEU . . . . . 0.599 HD11 ' HB3' ' P' ' 127' ' ' ARG . 20.4 mt -127.88 130.63 48.85 Favored 'General case' 0 C--N 1.398 2.701 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 -154.016 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.19 156.79 20.17 Favored 'General case' 0 C--N 1.382 1.987 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 136' ' ' ALA . . . . . 0.463 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.36 -43.3 98.03 Favored Pre-proline 0 CA--C 1.585 2.319 0 O-C-N 121.452 -0.78 . . . . 0.0 109.377 -158.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 137' ' ' PRO . . . . . 0.463 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 0.2 OUTLIER -56.5 -40.17 86.35 Favored 'Trans proline' 0 C--N 1.395 3.001 0 N-CA-C 119.056 2.675 . . . . 0.0 119.056 176.694 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' P' P ' 138' ' ' GLU . . . . . 0.459 ' HB3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -49.79 -73.7 0.04 OUTLIER 'General case' 0 C--N 1.38 1.902 0 CA-C-O 124.049 1.88 . . . . 0.0 107.497 161.721 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' P' P ' 139' ' ' ARG . . . . . 0.921 ' CZ ' ' HG3' ' P' ' 154' ' ' LYS . 2.1 ptt180 -69.79 -33.53 72.51 Favored 'General case' 0 C--N 1.391 2.386 0 CA-C-N 109.722 -3.399 . . . . 0.0 108.774 -156.505 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 140' ' ' GLU . . . . . 0.682 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 1.7 mt-10 -53.1 -45.99 68.49 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-O 123.578 1.656 . . . . 0.0 108.127 174.387 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -66.99 -35.49 80.07 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 112.439 -2.164 . . . . 0.0 109.417 -164.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' P' P ' 142' ' ' LEU . . . . . 0.889 HD13 ' HG2' ' P' ' 127' ' ' ARG . 1.1 tp -65.31 -41.79 93.67 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-O 123.369 1.557 . . . . 0.0 108.981 169.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 143' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -57.04 -36.41 70.46 Favored 'General case' 0 C--N 1.39 2.36 0 CA-C-N 112.224 -2.262 . . . . 0.0 107.971 173.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 144' ' ' SER . . . . . 0.555 ' N ' ' O ' ' P' ' 140' ' ' GLU . 2.1 t -69.76 -43.07 72.98 Favored 'General case' 0 C--N 1.388 2.275 0 CA-C-N 113.22 -1.809 . . . . 0.0 111.083 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 82.5 mt -69.04 -48.14 63.63 Favored 'General case' 0 C--N 1.38 1.891 0 CA-C-O 124.851 2.263 . . . . 0.0 108.205 -163.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' P' P ' 146' ' ' ILE . . . . . 0.966 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -92.02 -13.89 8.69 Favored 'Isoleucine or valine' 0 C--N 1.389 2.325 0 CA-C-N 110.675 -2.966 . . . . 0.0 107.958 -169.407 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 82.27 36.13 0.07 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 125.761 2.696 . . . . 0.0 107.66 152.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' P' P ' 148' ' ' LEU . . . . . 0.966 HD12 HD11 ' P' ' 146' ' ' ILE . 8.3 mt -95.18 173.82 7.37 Favored 'General case' 0 C--N 1.396 2.594 0 CA-C-N 111.353 -2.658 . . . . 0.0 109.083 166.572 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 149' ' ' THR . . . . . 0.426 ' O ' ' N ' ' P' ' 152' ' ' GLN . 16.6 p -89.16 148.22 40.32 Favored Pre-proline 0 CA--C 1.586 2.349 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 164.404 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 150' ' ' PRO . . . . . 0.544 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 86.6 Cg_exo -50.36 -51.99 9.89 Favored 'Trans proline' 0 C--N 1.408 3.69 0 C-N-CA 123.48 2.787 . . . . 0.0 113.543 -169.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -11.59 3.6 Favored 'General case' 0 C--N 1.388 2.252 0 CA-C-N 113.341 -1.754 . . . . 0.0 110.782 175.003 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 152' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' P' ' 149' ' ' THR . 43.6 mt-30 -86.31 -30.55 22.17 Favored 'General case' 0 C--O 1.279 2.656 0 CA-C-N 120.0 1.273 . . . . 0.0 108.443 167.297 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 153' ' ' VAL . . . . . 0.723 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.4 t -63.52 -72.93 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.38 1.919 0 CA-C-N 123.534 2.879 . . . . 0.0 109.779 163.159 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 154' ' ' LYS . . . . . 0.921 ' HG3' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -32.43 -56.11 0.34 Allowed 'General case' 0 C--N 1.385 2.117 0 C-N-CA 124.358 1.063 . . . . 0.0 110.822 -176.68 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.81 -45.13 95.12 Favored 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 113.549 -1.66 . . . . 0.0 108.937 -171.818 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 156' ' ' TRP . . . . . 0.705 ' HB3' HD22 ' P' ' 124' ' ' LEU . 2.7 t90 -62.97 -31.54 72.67 Favored 'General case' 0 C--N 1.381 1.947 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.06 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 157' ' ' PHE . . . . . 0.723 ' CE2' HG13 ' P' ' 153' ' ' VAL . 66.0 m-85 -74.87 -35.57 62.32 Favored 'General case' 0 C--O 1.279 2.623 0 O-C-N 121.275 -0.89 . . . . 0.0 111.819 170.704 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 158' ' ' GLN . . . . . 0.549 ' N ' ' O ' ' P' ' 154' ' ' LYS . 33.0 mt-30 -56.96 -62.76 1.52 Allowed 'General case' 0 C--N 1.378 1.817 0 O-C-N 119.047 -2.283 . . . . 0.0 106.802 169.052 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -56.65 -24.91 51.71 Favored 'General case' 0 C--N 1.393 2.46 0 CA-C-O 117.062 -1.447 . . . . 0.0 109.525 -166.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' P' P ' 160' ' ' HIS . . . . . 0.544 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 1.3 t-80 -74.38 -49.19 23.67 Favored 'General case' 0 C--O 1.283 2.835 0 CA-C-N 121.463 1.938 . . . . 0.0 109.914 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' P' P ' 161' ' ' ARG . . . . . 0.562 HH21 ' HB3' ' P' ' 157' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.003 0 CA-C-N 122.19 2.268 . . . . 0.0 109.527 -160.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.556 3.755 0 N19-C1'-C2' 119.613 3.383 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.639 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.561 3.299 1 P-O3'-C3' 124.761 4.218 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.639 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.861 0 C2'-C3'-O3' 116.949 2.352 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.614 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.337 0 P-O3'-C3' 122.852 2.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.534 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.88 1 P-O3'-C3' 125.527 4.856 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.517 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.977 0 N19-C1'-C2' 118.986 2.992 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.935 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.627 1 P-O3'-C3' 125.268 4.64 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.935 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.449 0 P-O3'-C3' 123.177 2.897 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.655 " H5'" ' HE2' ' P' ' 111' ' ' LYS . . . . . . . . 0 C5'--C4' 1.538 3.378 0 O4'-C4'-C3' 108.452 2.852 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.591 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.858 0 P-O3'-C3' 123.228 2.94 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.573 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.46 0 O4'-C4'-C3' 108.412 2.812 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . 0.441 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.437 1 P-O3'-C3' 125.018 4.432 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.636 " H2'" ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.578 0 O4'-C4'-C3' 108.387 2.787 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.841 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.691 0 C2'-C3'-O3' 116.666 2.247 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.943 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.832 1 O4'-C1'-N19 111.396 4.494 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.943 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.452 0 C3'-C2'-C1' 106.442 2.673 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.752 0 O5'-C5'-C4' 115.063 3.473 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.5 ' C4 ' ' N6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.617 1 P-O3'-C3' 125.071 4.476 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.5 ' N6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.358 0 O4'-C4'-C3' 108.201 2.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.454 " H1'" ' N3 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.454 0 O4'-C4'-C3' 108.208 2.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.507 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.571 4.291 0 O4'-C1'-N19 105.244 -3.195 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.507 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.481 1 P-O3'-C3' 127.073 6.144 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.573 ' C2 ' ' C2 ' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.635 0 O4'-C4'-C3' 107.991 2.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.535 ' C2 ' ' N3 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.74 0 P-O3'-C3' 123.929 3.524 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.442 H5'' H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.728 0 P-O3'-C3' 124.109 3.674 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.56 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.182 0 N19-C1'-C2' 119.066 3.041 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.615 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.683 0 P-O3'-C3' 123.472 3.143 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.615 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.562 0 C4'-C3'-C2' 100.642 -2.558 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.614 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.633 0 P-O3'-C3' 124.11 3.675 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.594 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.346 0 O4'-C4'-C3' 108.09 2.49 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.594 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.646 0 O4'-C4'-C3' 108.348 2.748 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . 0.476 ' C2 ' ' N2 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.891 0 O4'-C1'-N19 109.315 1.894 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.528 3.462 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.6 m -178.25 136.93 0.17 Allowed 'General case' 0 C--N 1.382 2.008 0 CA-C-N 113.674 -1.603 . . . . 0.0 108.654 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 170.01 -38.31 0.0 OUTLIER 'General case' 0 C--N 1.388 2.268 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.023 -171.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . 116.86 -90.29 0.51 Allowed Glycine 0 C--N 1.381 3.065 0 N-CA-C 108.92 -1.672 . . . . 0.0 108.92 -162.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.709 HD22 ' HD2' ' P' ' 106' ' ' PRO . 0.6 OUTLIER 170.89 149.44 0.17 Allowed Pre-proline 0 CA--C 1.581 2.159 0 CA-C-N 113.663 -1.268 . . . . 0.0 108.689 -166.167 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.709 ' HD2' HD22 ' P' ' 105' ' ' LEU . 73.3 Cg_exo -50.28 92.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.396 3.069 0 C-N-CA 122.777 2.318 . . . . 0.0 110.315 155.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -141.59 146.46 36.3 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-O 122.392 1.091 . . . . 0.0 109.183 162.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 108' ' ' LYS . . . . . 0.85 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -157.56 54.86 0.49 Allowed 'General case' 0 C--N 1.381 1.976 0 CA-C-N 113.701 -1.591 . . . . 0.0 108.091 -169.304 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.505 ' HB3' ' HE3' ' P' ' 109' ' ' LYS . 0.0 OUTLIER -84.92 168.39 15.06 Favored 'General case' 0 C--N 1.38 1.923 0 CA-C-N 113.623 -1.626 . . . . 0.0 108.829 -155.215 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.85 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.7 OUTLIER -144.18 100.97 3.64 Favored 'General case' 0 C--N 1.381 1.966 0 CA-C-N 113.98 -1.463 . . . . 0.0 108.873 -155.185 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.655 ' HE2' " H5'" ' A' ' 9' ' ' ' DG' . 0.3 OUTLIER -104.97 95.93 6.19 Favored 'General case' 0 C--N 1.381 1.94 0 CA-C-N 113.654 -1.612 . . . . 0.0 107.452 170.491 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.21 146.63 30.38 Favored 'General case' 0 C--N 1.378 1.817 0 CA-C-N 113.149 -1.841 . . . . 0.0 106.827 160.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 1.012 ' CD ' HD21 ' P' ' 115' ' ' LEU . 1.3 ttm180 -59.68 117.88 5.47 Favored 'General case' 0 C--N 1.388 2.277 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 -166.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.542 ' O ' HG13 ' P' ' 114' ' ' VAL . 11.7 p -107.12 58.85 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.023 0 CA-C-O 124.948 2.309 . . . . 0.0 108.018 -154.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 1.012 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.07 136.06 38.64 Favored 'General case' 0 C--N 1.39 2.366 0 CA-C-N 111.232 -2.713 . . . . 0.0 109.963 -155.328 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.513 ' CE2' ' HB2' ' P' ' 156' ' ' TRP . 1.0 OUTLIER -90.28 145.76 24.74 Favored 'General case' 0 C--N 1.381 1.966 0 CA-C-N 113.499 -1.682 . . . . 0.0 108.461 178.382 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -68.14 147.53 52.17 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -174.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' P' ' 122' ' ' TYR . 34.7 ttmt -43.96 -37.16 2.77 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 112.824 -1.989 . . . . 0.0 109.165 -177.052 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 119' ' ' ALA . . . . . 0.411 ' O ' ' HB3' ' P' ' 122' ' ' TYR . . . -53.5 -65.26 0.6 Allowed 'General case' 0 C--N 1.383 2.024 0 CA-C-O 124.071 1.891 . . . . 0.0 109.279 174.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.566 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.6 mt-30 -48.24 -49.58 32.7 Favored 'General case' 0 C--N 1.382 1.991 0 CA-C-N 112.56 -2.109 . . . . 0.0 109.394 175.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.616 ' HA ' HD12 ' P' ' 124' ' ' LEU . 22.6 m -49.07 -55.76 11.14 Favored 'General case' 0 C--N 1.382 1.987 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 170.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.686 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.19 -46.1 68.85 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-O 122.504 1.145 . . . . 0.0 110.224 -169.47 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.664 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.1 OUTLIER -66.16 -40.05 90.23 Favored 'General case' 0 C--N 1.379 1.883 0 CA-C-N 113.983 -1.462 . . . . 0.0 107.927 179.102 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.839 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -61.02 -48.68 80.65 Favored 'General case' 0 C--N 1.385 2.139 0 O-C-N 120.484 -1.385 . . . . 0.0 110.226 172.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.404 ' O ' ' N ' ' P' ' 129' ' ' ARG . 26.0 mt-10 -53.17 -56.12 18.86 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 122.191 0.996 . . . . 0.0 108.598 175.104 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.686 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.53 -62.0 0.74 Allowed 'General case' 0 C--N 1.379 1.855 0 CA-C-N 112.172 -2.285 . . . . 0.0 108.705 179.113 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.536 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.4 OUTLIER -66.85 -30.51 70.71 Favored 'General case' 0 C--N 1.395 2.571 0 CA-C-N 112.233 -2.258 . . . . 0.0 108.282 -170.63 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.824 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.4 t80 -69.74 -50.82 39.77 Favored 'General case' 0 C--N 1.387 2.232 0 O-C-N 121.067 -1.021 . . . . 0.0 110.96 171.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.448 ' HA ' ' NE ' ' P' ' 129' ' ' ARG . 0.4 OUTLIER -62.26 -12.01 18.13 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-N 113.338 -1.755 . . . . 0.0 108.177 -167.218 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -102.66 -43.33 5.63 Favored 'General case' 0 C--N 1.381 1.945 0 CA-C-O 123.985 1.85 . . . . 0.0 107.258 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.425 ' HG2' ' CD2' ' P' ' 134' ' ' LEU . 2.8 tp-100 -151.69 128.74 11.08 Favored 'General case' 0 C--N 1.387 2.209 0 CA-C-N 111.608 -2.542 . . . . 0.0 110.822 -154.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -79.33 -27.94 42.08 Favored 'General case' 0 C--N 1.389 2.29 0 CA-C-N 112.003 -2.362 . . . . 0.0 111.46 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.495 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 9.2 m-85 -158.66 114.48 2.65 Favored 'General case' 0 C--N 1.377 1.79 0 CA-C-O 122.679 1.228 . . . . 0.0 109.009 -150.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.676 HD22 ' HG3' ' P' ' 138' ' ' GLU . 36.6 mt -122.92 136.08 54.73 Favored 'General case' 0 C--N 1.404 2.957 0 CA-C-N 114.393 -1.276 . . . . 0.0 108.267 -160.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.11 155.79 26.09 Favored 'General case' 0 C--N 1.383 2.025 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 166.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.539 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.34 -49.86 90.43 Favored Pre-proline 0 CA--C 1.584 2.269 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -161.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 84.1 Cg_exo -57.87 -28.89 84.38 Favored 'Trans proline' 0 C--N 1.4 3.277 0 C-N-CA 121.122 1.215 . . . . 0.0 114.932 -174.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.676 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -53.92 -71.36 0.08 Allowed 'General case' 0 C--N 1.38 1.9 0 CA-C-O 124.606 2.146 . . . . 0.0 106.44 160.782 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.904 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.96 -38.69 79.57 Favored 'General case' 0 C--N 1.39 2.334 0 CA-C-N 109.828 -3.351 . . . . 0.0 108.785 -155.33 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.643 ' O ' ' N ' ' P' ' 144' ' ' SER . 5.6 mt-10 -52.84 -39.58 62.63 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 122.849 1.309 . . . . 0.0 108.183 177.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -64.83 -36.47 84.44 Favored 'General case' 0 C--N 1.379 1.879 0 CA-C-N 112.926 -1.943 . . . . 0.0 108.562 -170.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.656 ' O ' HG23 ' P' ' 146' ' ' ILE . 3.2 tp -64.84 -43.2 93.83 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-O 123.104 1.431 . . . . 0.0 109.116 167.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.635 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -57.31 -32.43 66.67 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 112.597 -2.092 . . . . 0.0 108.45 175.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.643 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.4 OUTLIER -73.71 -44.91 55.17 Favored 'General case' 0 C--N 1.386 2.158 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.552 -178.07 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 78.5 mt -67.26 -42.84 83.24 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-O 124.598 2.142 . . . . 0.0 108.349 -163.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.994 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -101.82 -13.01 8.55 Favored 'Isoleucine or valine' 0 C--N 1.389 2.292 0 CA-C-N 111.05 -2.796 . . . . 0.0 107.817 -167.081 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 82.13 34.7 0.08 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-O 125.597 2.618 . . . . 0.0 107.98 152.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.994 HD12 HD11 ' P' ' 146' ' ' ILE . 8.4 mt -96.28 170.04 9.52 Favored 'General case' 0 C--N 1.397 2.633 0 CA-C-N 111.556 -2.565 . . . . 0.0 109.468 170.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.651 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.4 p -91.21 139.71 25.61 Favored Pre-proline 0 CA--C 1.592 2.58 0 CA-C-O 122.729 1.252 . . . . 0.0 108.718 169.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.434 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 16.2 Cg_exo -56.03 -33.9 90.89 Favored 'Trans proline' 1 C--N 1.415 4.075 0 C-N-CA 122.727 2.284 . . . . 0.0 113.114 -159.829 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -37.57 72.62 Favored 'General case' 0 C--N 1.383 2.045 0 C-N-CA 119.534 -0.866 . . . . 0.0 109.807 166.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.651 ' N ' ' O ' ' P' ' 149' ' ' THR . 49.0 mt-30 -68.51 -28.48 67.04 Favored 'General case' 0 C--N 1.387 2.225 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 -175.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.595 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.1 t -64.53 -70.31 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.193 0 CA-C-N 121.183 1.811 . . . . 0.0 109.517 165.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.904 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.95 -58.59 0.44 Allowed 'General case' 0 C--N 1.384 2.106 0 C-N-CA 125.013 1.325 . . . . 0.0 110.959 -178.143 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.512 HG21 " C5'" ' A' ' 8' ' ' ' DA' . 33.4 mm -60.19 -39.33 80.29 Favored 'Isoleucine or valine' 0 C--N 1.382 1.989 0 CA-C-N 113.106 -1.861 . . . . 0.0 109.114 -172.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.839 ' HB3' HD22 ' P' ' 124' ' ' LEU . 3.8 t90 -67.21 -32.08 72.9 Favored 'General case' 0 C--N 1.382 2.003 0 O-C-N 121.373 -0.829 . . . . 0.0 109.088 172.17 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.824 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 49.2 m-85 -74.66 -40.72 61.28 Favored 'General case' 0 C--O 1.273 2.337 0 O-C-N 120.927 -1.108 . . . . 0.0 111.972 173.495 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.497 ' OE1' HD13 ' P' ' 155' ' ' ILE . 77.8 mt-30 -52.37 -58.14 7.63 Favored 'General case' 0 C--N 1.377 1.778 0 O-C-N 119.771 -1.831 . . . . 0.0 106.765 170.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -55.84 -25.62 42.85 Favored 'General case' 0 C--N 1.388 2.27 0 CA-C-O 117.709 -1.138 . . . . 0.0 109.659 -168.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.575 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.4 OUTLIER -79.75 -42.89 23.61 Favored 'General case' 0 C--O 1.286 2.992 0 CA-C-N 121.526 1.967 . . . . 0.0 111.878 -178.622 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.616 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -67.53 -35.4 79.02 Favored 'General case' 0 C--O 1.267 2.003 0 CA-C-N 123.57 2.896 . . . . 0.0 110.785 -167.35 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 162' ' ' TYR . . . . . 0.589 ' HE2' ' CZ ' ' P' ' 166' ' ' ARG . 12.6 t80 -69.09 -37.96 78.71 Favored 'General case' 0 C--N 1.38 1.925 0 O-C-N 119.939 -1.726 . . . . 0.0 109.802 168.323 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.08 -36.81 84.82 Favored 'General case' 0 C--N 1.381 1.945 0 O-C-N 121.287 -0.883 . . . . 0.0 109.636 -167.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.616 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.6 OUTLIER -52.8 -59.84 4.0 Favored 'General case' 0 C--N 1.379 1.857 0 CA-C-O 125.179 2.419 . . . . 0.0 106.601 -175.37 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.423 ' HG2' HG23 ' P' ' 164' ' ' THR . 8.2 mmmt -58.74 -44.76 90.57 Favored 'General case' 0 C--N 1.387 2.221 1 CA-C-N 108.203 -4.089 . . . . 0.0 107.866 -159.583 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' P' P ' 166' ' ' ARG . . . . . 0.589 ' CZ ' ' HE2' ' P' ' 162' ' ' TYR . 5.7 mtt180 -55.36 -47.46 75.72 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-N 112.348 -2.205 . . . . 0.0 110.641 177.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -49.86 -37.66 31.98 Favored 'General case' 0 C--N 1.387 2.203 0 CA-C-O 123.347 1.546 . . . . 0.0 108.356 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.56 -23.2 40.1 Favored 'General case' 0 C--N 1.39 2.356 0 CA-C-N 111.884 -2.416 . . . . 0.0 109.447 -168.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -60.61 -33.2 72.4 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-O 122.55 1.167 . . . . 0.0 109.398 170.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.55 -39.21 90.26 Favored 'General case' 0 C--N 1.384 2.097 0 CA-C-N 113.772 -1.558 . . . . 0.0 108.117 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -89.89 88.96 7.53 Favored 'General case' 0 C--N 1.381 1.949 0 CA-C-N 113.819 -1.537 . . . . 0.0 109.182 -159.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 126.31 -79.47 0.37 Allowed Glycine 0 C--N 1.382 3.086 0 N-CA-C 108.947 -1.661 . . . . 0.0 108.947 -156.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 159.01 173.57 0.01 OUTLIER 'General case' 0 C--N 1.382 1.998 0 CA-C-N 113.517 -1.341 . . . . 0.0 109.969 156.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -81.33 51.29 1.6 Allowed 'General case' 0 C--N 1.381 1.949 0 CA-C-N 112.101 -2.318 . . . . 0.0 110.286 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -78.16 99.94 1.6 Allowed Glycine 0 C--N 1.383 3.166 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 -158.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -146.4 121.22 5.39 Favored Pre-proline 0 CA--C 1.58 2.101 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 -174.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 CA--C 1.594 3.483 0 C-N-CA 121.493 1.462 . . . . 0.0 111.641 169.992 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.64 0 N19-C1'-C2' 119.646 3.404 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.707 " C2'" ' H71' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.385 0 O4'-C4'-C3' 108.158 2.558 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.707 ' H71' " C2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.858 0 C2'-C3'-O3' 117.056 2.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.609 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.697 0 P-O3'-C3' 123.473 3.145 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.547 ' H71' " H2'" ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.95 0 N19-C1'-C2' 118.132 2.458 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.558 H2'' ' C8 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.566 3.804 1 P-O3'-C3' 129.012 7.76 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.657 ' OP1' HD13 ' P' ' 115' ' ' LEU . . . . . . . . 0 C5'--C4' 1.539 3.538 2 P-O3'-C3' 130.556 9.047 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.653 H2'' " O5'" ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.719 0 C3'-C2'-C1' 107.312 3.294 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.653 " O5'" H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.375 0 O4'-C4'-C3' 108.183 2.583 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.603 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.791 0 C2'-C3'-O3' 116.717 2.265 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.516 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.345 0 P-O3'-C3' 122.672 2.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . 0.473 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.352 0 O4'-C4'-C3' 107.96 2.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.5 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.568 0 O4'-C4'-C3' 108.211 2.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.5 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.551 0 P-O3'-C3' 124.437 3.947 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.905 ' C4 ' ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.541 3.749 1 O4'-C1'-N19 111.35 4.438 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.905 ' H71' ' C4 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.636 0 O4'-C1'-N19 109.728 2.41 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.634 0 O5'-C5'-C4' 115.071 3.479 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.568 3.951 0 O4'-C4'-C3' 108.207 2.607 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.458 0 O4'-C4'-C3' 108.234 2.634 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.556 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.298 0 O4'-C4'-C3' 108.017 2.417 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.647 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.572 4.375 0 N19-C1'-C2' 119.049 3.031 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.647 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.53 0 P-O3'-C3' 123.069 2.808 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.639 ' OP2' ' HD1' ' P' ' 162' ' ' TYR . . . . . . . . 0 C5'--C4' 1.538 3.352 0 C3'-C2'-C1' 107.035 3.096 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.619 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 P-O3'-C3' 123.666 3.305 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.503 " H5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.176 0 C2'-C3'-O3' 117.179 2.437 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.579 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.225 0 P-O3'-C3' 123.967 3.556 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.579 ' C8 ' H2'' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.554 3.568 0 P-O3'-C3' 123.603 3.253 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.535 ' C8 ' H2'' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.348 0 C3'-C2'-C1' 105.732 2.166 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.609 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.592 0 O4'-C4'-C3' 108.313 2.713 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.441 0 O4'-C4'-C3' 108.149 2.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.537 0 P-O3'-C3' 123.627 3.272 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . 0.472 ' C2 ' ' N2 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.829 0 O4'-C1'-N19 109.356 1.944 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.478 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.73 -59.4 1.75 Allowed 'General case' 0 C--N 1.381 1.977 0 CA-C-N 113.705 -1.589 . . . . 0.0 108.641 -176.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 169.96 23.32 0.0 OUTLIER 'General case' 0 C--N 1.395 2.559 0 CA-C-N 113.403 -1.726 . . . . 0.0 109.432 -169.401 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . 145.7 -118.6 1.1 Allowed Glycine 0 C--N 1.38 2.994 0 N-CA-C 108.815 -1.714 . . . . 0.0 108.815 -161.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.88 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.1 OUTLIER -172.17 154.88 3.43 Favored Pre-proline 0 CA--C 1.581 2.16 0 CA-C-N 113.717 -1.242 . . . . 0.0 108.573 177.978 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.88 ' HD2' HD13 ' P' ' 105' ' ' LEU . 66.8 Cg_exo -48.93 92.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.111 0 C-N-CA 122.854 2.37 . . . . 0.0 110.399 155.321 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -147.13 126.8 13.36 Favored 'General case' 0 C--N 1.38 1.92 0 CA-C-O 122.422 1.106 . . . . 0.0 109.178 159.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 22.5 mtmm -98.2 43.9 1.05 Allowed 'General case' 0 C--N 1.381 1.964 0 CA-C-N 113.705 -1.589 . . . . 0.0 107.853 175.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.488 ' HG3' ' N ' ' P' ' 110' ' ' ARG . 0.6 OUTLIER -94.45 162.49 13.8 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 113.35 -1.75 . . . . 0.0 109.821 175.996 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.488 ' N ' ' HG3' ' P' ' 109' ' ' LYS . 34.9 mmt-85 -118.75 -155.97 0.63 Allowed 'General case' 0 C--N 1.378 1.835 0 CA-C-N 113.723 -1.58 . . . . 0.0 107.231 -164.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' P' ' 111' ' ' LYS . 0.1 OUTLIER -140.18 116.89 10.9 Favored 'General case' 0 C--N 1.383 2.055 0 CA-C-N 112.06 -2.337 . . . . 0.0 108.026 176.326 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 3.3 mtp85 -76.5 150.48 36.63 Favored 'General case' 0 C--N 1.382 1.996 0 CA-C-N 113.656 -1.611 . . . . 0.0 108.037 154.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.967 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.3 OUTLIER -73.27 115.52 12.72 Favored 'General case' 0 C--N 1.387 2.201 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 -165.663 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.499 ' O ' HG13 ' P' ' 114' ' ' VAL . 13.9 p -107.82 59.09 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.048 0 CA-C-O 124.961 2.315 . . . . 0.0 108.012 -154.242 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.967 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.24 141.8 39.84 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 111.093 -2.776 . . . . 0.0 109.941 -155.433 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 116' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -92.25 145.57 24.39 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 113.703 -1.59 . . . . 0.0 108.51 -178.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.03 148.1 51.48 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -174.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' P' ' 122' ' ' TYR . 38.4 ttmt -44.02 -37.19 2.84 Favored 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.084 -1.871 . . . . 0.0 109.187 -178.041 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.58 -62.15 1.84 Allowed 'General case' 0 C--N 1.382 2.011 0 CA-C-O 124.036 1.874 . . . . 0.0 109.394 175.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.566 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.6 mt-30 -52.96 -48.16 67.58 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-N 112.617 -2.083 . . . . 0.0 109.587 177.067 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.645 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.0 m -49.33 -55.81 11.61 Favored 'General case' 0 C--N 1.384 2.093 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 169.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.546 ' CE1' ' CZ ' ' P' ' 126' ' ' ARG . 2.9 t80 -53.11 -48.11 68.08 Favored 'General case' 0 C--N 1.382 2.018 0 CA-C-O 122.628 1.204 . . . . 0.0 109.949 -169.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.971 ' CD ' HG22 ' P' ' 146' ' ' ILE . 4.2 mt-10 -66.02 -38.11 87.6 Favored 'General case' 0 C--N 1.378 1.807 0 CA-C-N 113.979 -1.464 . . . . 0.0 107.604 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.717 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.1 mt -60.76 -50.3 74.03 Favored 'General case' 0 C--N 1.385 2.114 0 O-C-N 120.658 -1.276 . . . . 0.0 110.062 171.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.474 ' O ' ' N ' ' P' ' 129' ' ' ARG . 15.5 mt-10 -54.3 -53.65 50.89 Favored 'General case' 0 C--N 1.379 1.887 0 CA-C-O 122.477 1.132 . . . . 0.0 109.014 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.578 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -39.94 -65.04 0.43 Allowed 'General case' 0 C--N 1.379 1.886 0 CA-C-N 111.96 -2.382 . . . . 0.0 108.76 177.46 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.878 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -63.78 -32.7 74.29 Favored 'General case' 0 C--N 1.394 2.519 0 CA-C-N 112.405 -2.18 . . . . 0.0 108.34 -170.794 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.765 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 7.3 t80 -68.76 -51.01 45.77 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-O 121.973 0.892 . . . . 0.0 110.373 173.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' P' ' 125' ' ' GLU . 8.9 mmm180 -62.36 -12.21 19.94 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.306 -1.77 . . . . 0.0 108.198 -165.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -107.75 -40.97 5.13 Favored 'General case' 0 C--N 1.379 1.878 0 C-N-CA 126.234 1.814 . . . . 0.0 107.626 -172.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.502 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.4 OUTLIER -156.11 97.89 1.83 Allowed 'General case' 0 C--N 1.387 2.22 0 CA-C-N 111.952 -2.385 . . . . 0.0 110.263 -153.164 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 132' ' ' ARG . . . . . 0.541 ' HG2' ' CD2' ' P' ' 133' ' ' TYR . 0.1 OUTLIER -76.98 -6.91 54.47 Favored 'General case' 0 C--N 1.394 2.501 0 CA-C-N 112.035 -2.348 . . . . 0.0 110.97 -163.968 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.563 ' CD1' ' CZ ' ' P' ' 161' ' ' ARG . 4.0 m-85 -161.6 112.42 1.68 Allowed 'General case' 0 C--N 1.381 1.946 0 CA-C-N 114.671 -1.15 . . . . 0.0 108.511 -154.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.611 HD22 ' HG3' ' P' ' 138' ' ' GLU . 30.3 mt -130.64 136.02 48.43 Favored 'General case' 0 C--N 1.396 2.599 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -156.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.52 156.11 25.43 Favored 'General case' 0 C--N 1.381 1.959 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 167.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.537 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.36 -50.2 88.65 Favored Pre-proline 0 CA--C 1.582 2.185 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -162.016 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.537 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 89.3 Cg_exo -57.23 -29.83 85.15 Favored 'Trans proline' 0 C--N 1.401 3.323 0 C-N-CA 120.836 1.024 . . . . 0.0 114.624 -174.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.611 ' HG3' HD22 ' P' ' 134' ' ' LEU . 1.6 mm-40 -54.29 -71.41 0.08 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-O 124.26 1.981 . . . . 0.0 106.48 161.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.933 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.56 -34.52 74.31 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 110.008 -3.269 . . . . 0.0 109.026 -155.35 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.626 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 7.4 mt-10 -52.3 -43.77 64.67 Favored 'General case' 0 C--N 1.38 1.908 0 CA-C-O 123.356 1.551 . . . . 0.0 108.03 174.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -63.27 -36.3 83.2 Favored 'General case' 0 C--N 1.38 1.911 0 CA-C-N 112.406 -2.179 . . . . 0.0 108.738 -168.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.878 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.1 tp -66.24 -42.8 88.09 Favored 'General case' 0 C--N 1.383 2.063 0 CA-C-O 122.987 1.375 . . . . 0.0 109.167 170.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.52 -34.58 67.16 Favored 'General case' 0 C--N 1.387 2.224 0 CA-C-N 112.742 -2.026 . . . . 0.0 108.183 172.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.607 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -71.38 -42.61 68.2 Favored 'General case' 0 C--N 1.388 2.263 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.395 -178.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 80.9 mt -68.63 -46.54 68.94 Favored 'General case' 0 C--N 1.38 1.917 0 CA-C-O 124.682 2.182 . . . . 0.0 108.226 -163.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.99 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.53 -13.01 8.27 Favored 'Isoleucine or valine' 0 C--N 1.389 2.302 0 CA-C-N 110.926 -2.852 . . . . 0.0 107.967 -168.366 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 82.18 35.5 0.07 Allowed 'General case' 0 C--N 1.381 1.956 0 CA-C-O 125.721 2.677 . . . . 0.0 107.652 152.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.99 HD12 HD11 ' P' ' 146' ' ' ILE . 8.6 mt -95.61 172.72 7.88 Favored 'General case' 0 C--N 1.397 2.635 0 CA-C-N 111.45 -2.614 . . . . 0.0 109.133 168.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.588 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.0 p -90.61 141.47 27.15 Favored Pre-proline 0 CA--C 1.589 2.462 0 CA-C-O 122.797 1.284 . . . . 0.0 108.267 166.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.545 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 0.4 OUTLIER -48.29 -47.0 21.13 Favored 'Trans proline' 0 C--N 1.405 3.502 0 C-N-CA 124.954 3.769 . . . . 0.0 115.424 -167.533 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 151' ' ' THR . . . . . 0.401 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -52.86 -31.03 37.13 Favored 'General case' 0 C--N 1.384 2.073 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.07 169.327 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.588 ' N ' ' O ' ' P' ' 149' ' ' THR . 46.8 mt-30 -74.66 -27.94 60.64 Favored 'General case' 0 C--N 1.392 2.42 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.709 HG13 ' CD2' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -64.15 -70.94 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.024 0 CA-C-N 122.116 2.235 . . . . 0.0 109.513 162.76 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.933 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.77 -59.57 0.4 Allowed 'General case' 0 C--N 1.387 2.199 0 CA-C-O 122.728 1.251 . . . . 0.0 110.583 -176.497 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.437 HG21 " H5'" ' A' ' 8' ' ' ' DA' . 13.4 mm -56.2 -43.03 75.19 Favored 'Isoleucine or valine' 0 C--N 1.383 2.029 0 CA-C-N 112.995 -1.911 . . . . 0.0 109.112 -174.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.717 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.6 t90 -67.23 -31.58 72.04 Favored 'General case' 0 C--N 1.383 2.033 0 O-C-N 120.876 -1.14 . . . . 0.0 109.324 174.107 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.765 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 44.6 m-85 -75.55 -41.98 53.5 Favored 'General case' 0 C--O 1.275 2.406 0 O-C-N 121.053 -1.029 . . . . 0.0 111.888 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.443 ' N ' ' O ' ' P' ' 154' ' ' LYS . 51.4 mt-30 -49.5 -59.67 3.54 Favored 'General case' 0 C--N 1.378 1.826 0 O-C-N 119.296 -2.127 . . . . 0.0 107.005 169.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -55.83 -25.0 39.74 Favored 'General case' 0 C--N 1.389 2.295 0 CA-C-O 117.713 -1.137 . . . . 0.0 109.386 -166.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.535 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.1 t-160 -76.5 -46.84 24.97 Favored 'General case' 0 C--O 1.282 2.801 0 CA-C-N 121.213 1.824 . . . . 0.0 111.286 175.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.606 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -66.66 -35.35 79.94 Favored 'General case' 0 C--N 1.378 1.841 0 CA-C-N 122.985 2.629 . . . . 0.0 110.543 -161.654 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 162' ' ' TYR . . . . . 0.639 ' HD1' ' OP2' ' B' ' 23' ' ' ' DA' . 82.0 t80 -68.86 -36.2 77.84 Favored 'General case' 0 C--N 1.38 1.929 0 O-C-N 120.135 -1.603 . . . . 0.0 109.652 171.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -65.05 -40.33 94.59 Favored 'General case' 0 C--N 1.381 1.965 0 O-C-N 121.668 -0.645 . . . . 0.0 109.293 -169.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.606 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.6 OUTLIER -53.71 -60.3 3.5 Favored 'General case' 0 C--N 1.379 1.873 0 CA-C-O 125.199 2.428 . . . . 0.0 106.484 -172.492 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.452 ' HG2' HG23 ' P' ' 164' ' ' THR . 9.9 mmmt -58.91 -46.61 87.48 Favored 'General case' 0 C--N 1.388 2.247 1 CA-C-N 108.208 -4.087 . . . . 0.0 108.285 -163.668 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' P' P ' 166' ' ' ARG . . . . . 0.514 ' HG3' ' CZ ' ' P' ' 162' ' ' TYR . 2.0 ttt180 -45.2 -49.52 12.15 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-N 112.798 -2.001 . . . . 0.0 111.505 173.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.4 -33.41 72.44 Favored 'General case' 0 C--N 1.381 1.95 0 CA-C-N 113.59 -1.641 . . . . 0.0 108.595 -174.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.34 -21.56 39.07 Favored 'General case' 0 C--N 1.387 2.206 0 CA-C-N 111.908 -2.405 . . . . 0.0 109.603 -174.073 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -54.73 -32.97 60.46 Favored 'General case' 0 C--N 1.383 2.04 0 CA-C-O 123.189 1.471 . . . . 0.0 109.559 167.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.07 -27.99 64.03 Favored 'General case' 0 C--N 1.386 2.179 0 CA-C-N 112.838 -1.983 . . . . 0.0 109.257 -163.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 4.7 mttt -87.13 105.31 17.1 Favored 'General case' 0 C--N 1.379 1.862 0 CA-C-N 113.55 -1.659 . . . . 0.0 107.985 -167.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 46.06 76.3 0.14 Allowed Glycine 0 CA--C 1.563 3.047 0 N-CA-C 108.558 -1.817 . . . . 0.0 108.558 -153.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . 0.251 37.5 m-85 -29.72 144.66 0.01 OUTLIER 'General case' 0 C--N 1.389 2.295 0 CA-C-O 123.966 1.841 . . . . 0.0 109.431 168.005 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.46 55.3 3.44 Favored 'General case' 0 C--N 1.392 2.415 0 CA-C-N 111.042 -2.799 . . . . 0.0 109.218 176.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -63.93 100.97 0.43 Allowed Glycine 0 C--N 1.38 2.999 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 -166.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 176' ' ' HIS . . . . . 0.534 ' CG ' ' HD2' ' P' ' 177' ' ' PRO . 1.6 t-80 -137.74 164.69 39.42 Favored Pre-proline 0 CA--C 1.58 2.104 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 -161.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 177' ' ' PRO . . . . . 0.534 ' HD2' ' CG ' ' P' ' 176' ' ' HIS . 65.9 Cg_exo . . . . . 0 CA--C 1.594 3.51 0 C-N-CA 121.503 1.469 . . . . 0.0 111.568 161.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.792 0 O5'-C5'-C4' 114.37 2.978 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.634 H2'' ' H71' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.366 1 P-O3'-C3' 127.271 6.309 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.634 ' H71' H2'' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.901 0 C2'-C3'-O3' 117.014 2.376 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.637 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.561 0 P-O3'-C3' 123.556 3.213 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.529 ' C2 ' ' C2 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.841 0 N19-C1'-C2' 118.473 2.671 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.549 ' C5 ' ' N6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.035 0 C3'-C2'-C1' 106.804 2.931 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.987 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.67 1 P-O3'-C3' 126.862 5.968 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.987 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.2 0 P-O3'-C3' 123.76 3.383 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.867 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.554 0 P-O3'-C3' 123.805 3.421 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.607 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.834 0 P-O3'-C3' 123.608 3.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.496 H2'' ' C8 ' ' A' ' 12' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.556 0 O4'-C4'-C3' 108.521 2.921 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . 0.496 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.315 1 P-O3'-C3' 125.049 4.457 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.522 H2'' " C5'" ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.624 0 O4'-C4'-C3' 108.375 2.775 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.522 " C5'" H2'' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.638 0 P-O3'-C3' 122.638 2.448 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.585 " C2'" ' H73' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.543 3.955 1 O4'-C1'-N19 111.58 4.725 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.585 ' H73' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.546 0 P-O3'-C3' 122.199 2.083 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.785 0 O5'-C5'-C4' 115.079 3.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.599 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.666 1 P-O3'-C3' 126.96 6.05 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.599 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.482 0 P-O3'-C3' 123.182 2.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.548 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.464 0 P-O3'-C3' 123.185 2.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.645 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.571 4.311 0 N19-C1'-C2' 118.987 2.992 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.645 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.56 0 P-O3'-C3' 123.231 2.942 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.532 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.562 3.395 0 O4'-C4'-C3' 108.393 2.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.532 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.632 0 O4'-C4'-C3' 108.848 3.248 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.513 " H5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.177 1 P-O3'-C3' 126.345 5.538 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.564 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C3'--C2' 1.559 4.135 0 N19-C1'-C2' 119.18 3.112 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.606 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.706 1 P-O3'-C3' 124.696 4.164 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.606 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.58 0 C4'-C3'-C2' 100.391 -2.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.637 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.554 1 P-O3'-C3' 124.767 4.223 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.375 0 O4'-C4'-C3' 107.915 2.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.541 0 O4'-C4'-C3' 108.195 2.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.857 0 P-O3'-C3' 122.007 1.922 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.518 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 29.6 m -106.37 74.04 1.0 Allowed 'General case' 0 C--N 1.381 1.969 0 CA-C-N 113.652 -1.613 . . . . 0.0 108.694 164.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 170.15 -38.34 0.0 OUTLIER 'General case' 0 C--N 1.389 2.303 0 CA-C-N 113.534 -1.666 . . . . 0.0 107.942 -168.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -104.9 94.28 1.0 Allowed Glycine 0 C--N 1.381 3.055 0 N-CA-C 108.94 -1.664 . . . . 0.0 108.94 -164.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.558 HD23 ' HD2' ' P' ' 106' ' ' PRO . 0.2 OUTLIER -86.52 -175.95 0.68 Allowed Pre-proline 0 CA--C 1.582 2.176 0 CA-C-N 113.662 -1.269 . . . . 0.0 108.788 173.896 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.558 ' HD2' HD23 ' P' ' 105' ' ' LEU . 96.2 Cg_exo -54.3 91.47 0.04 OUTLIER 'Trans proline' 0 C--N 1.397 3.081 0 C-N-CA 122.763 2.308 . . . . 0.0 110.314 155.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -126.81 -178.54 4.43 Favored 'General case' 0 C--N 1.382 2.018 0 CA-C-O 122.451 1.12 . . . . 0.0 109.176 167.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -95.56 98.76 10.75 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-N 113.675 -1.602 . . . . 0.0 108.136 171.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 1.047 ' HE3' ' CG ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -58.84 100.36 0.07 Allowed 'General case' 0 C--N 1.382 1.989 0 CA-C-N 113.662 -1.608 . . . . 0.0 109.089 -176.655 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 1.047 ' CG ' ' HE3' ' P' ' 109' ' ' LYS . 4.1 mmt85 71.26 98.37 0.07 Allowed 'General case' 0 C--N 1.411 3.247 0 CA-C-N 112.557 -2.111 . . . . 0.0 108.616 156.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.667 ' HD2' " O3'" ' A' ' 8' ' ' ' DA' . 0.7 OUTLIER -79.52 88.72 5.06 Favored 'General case' 0 C--N 1.384 2.097 0 CA-C-N 113.096 -1.866 . . . . 0.0 108.154 171.782 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 2.8 mtp85 -70.73 177.44 3.57 Favored 'General case' 0 C--N 1.393 2.459 0 CA-C-N 111.675 -2.511 . . . . 0.0 108.779 156.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.941 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.9 OUTLIER -84.93 119.04 24.91 Favored 'General case' 0 C--N 1.386 2.173 0 CA-C-N 113.614 -1.63 . . . . 0.0 106.897 168.846 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.513 ' O ' HG13 ' P' ' 114' ' ' VAL . 13.8 p -110.2 58.36 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.129 0 CA-C-O 124.972 2.32 . . . . 0.0 107.844 -155.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.941 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.56 139.36 39.54 Favored 'General case' 0 C--N 1.391 2.379 0 CA-C-N 110.852 -2.885 . . . . 0.0 109.792 -155.465 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.59 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 0.9 OUTLIER -92.05 146.5 23.68 Favored 'General case' 0 C--N 1.381 1.942 0 CA-C-N 113.946 -1.479 . . . . 0.0 108.216 -178.123 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -65.95 147.53 53.21 Favored 'General case' 0 C--N 1.382 2.011 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 -172.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.457 ' O ' ' N ' ' P' ' 122' ' ' TYR . 33.4 ttmt -42.65 -35.94 1.26 Allowed 'General case' 0 C--N 1.382 1.99 0 CA-C-N 113.547 -1.66 . . . . 0.0 109.594 -176.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.08 -68.12 0.21 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 124.078 1.894 . . . . 0.0 109.146 173.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.55 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.1 mt-30 -46.45 -50.58 16.62 Favored 'General case' 0 C--N 1.382 1.999 0 C-N-CA 127.166 2.186 . . . . 0.0 109.966 175.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.684 ' HA ' HD12 ' P' ' 124' ' ' LEU . 20.2 m -50.78 -57.26 8.82 Favored 'General case' 0 C--N 1.384 2.068 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 170.141 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.563 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.18 -46.25 68.87 Favored 'General case' 0 C--N 1.383 2.047 0 CA-C-O 122.329 1.061 . . . . 0.0 109.818 -170.217 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.959 ' CD ' HG22 ' P' ' 146' ' ' ILE . 6.5 mt-10 -66.86 -37.11 83.81 Favored 'General case' 0 C--N 1.379 1.872 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.496 178.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.759 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.2 mt -60.4 -51.24 70.34 Favored 'General case' 0 C--N 1.382 2.009 0 O-C-N 119.89 -1.756 . . . . 0.0 110.401 169.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.443 ' O ' ' N ' ' P' ' 129' ' ' ARG . 16.2 mt-10 -54.63 -52.88 60.89 Favored 'General case' 0 C--N 1.379 1.859 0 CA-C-O 122.434 1.111 . . . . 0.0 109.267 177.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.563 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -38.96 -67.62 0.2 Allowed 'General case' 0 C--N 1.379 1.891 0 CA-C-N 111.823 -2.444 . . . . 0.0 108.717 176.04 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.74 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.3 OUTLIER -62.28 -32.64 73.39 Favored 'General case' 0 C--N 1.393 2.462 0 CA-C-N 112.484 -2.144 . . . . 0.0 108.289 -170.117 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.804 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 12.6 t80 -68.8 -50.48 49.82 Favored 'General case' 0 C--N 1.388 2.247 0 CA-C-O 122.073 0.939 . . . . 0.0 110.77 174.353 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' P' ' 125' ' ' GLU . 8.6 mmm180 -62.33 -11.81 17.48 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.083 -1.871 . . . . 0.0 108.128 -167.059 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 130' ' ' GLN . . . . . 0.484 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 33.6 mt-30 -107.99 -40.46 5.23 Favored 'General case' 0 C--N 1.379 1.886 0 C-N-CA 126.378 1.871 . . . . 0.0 107.772 -172.091 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.5 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -155.19 102.48 2.3 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 111.943 -2.39 . . . . 0.0 109.501 -153.442 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 132' ' ' ARG . . . . . 0.644 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -77.15 -15.79 59.39 Favored 'General case' 0 C--N 1.387 2.205 0 CA-C-N 112.323 -2.217 . . . . 0.0 110.335 -165.629 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.775 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 2.6 m-30 -154.84 115.69 3.95 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.999 -1.455 . . . . 0.0 108.544 -158.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.504 HD22 ' HB3' ' P' ' 138' ' ' GLU . 21.1 mt -130.08 134.18 47.19 Favored 'General case' 0 C--N 1.398 2.717 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -157.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.2 154.11 25.62 Favored 'General case' 0 C--N 1.381 1.959 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 171.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.492 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.86 -45.89 99.58 Favored Pre-proline 0 CA--C 1.584 2.251 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -158.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 0.1 OUTLIER -52.55 -41.1 70.34 Favored 'Trans proline' 0 C--N 1.396 3.05 0 C-N-CA 122.631 2.22 . . . . 0.0 117.647 179.337 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.504 ' HB3' HD22 ' P' ' 134' ' ' LEU . 1.6 mm-40 -50.2 -69.45 0.11 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-O 123.509 1.623 . . . . 0.0 107.135 166.021 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.577 ' HB2' HG11 ' P' ' 153' ' ' VAL . 1.0 OUTLIER -69.12 -35.56 76.55 Favored 'General case' 0 C--N 1.389 2.291 0 CA-C-N 110.072 -3.24 . . . . 0.0 108.494 -158.339 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.63 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.2 mt-10 -53.29 -41.05 65.21 Favored 'General case' 0 C--N 1.38 1.926 0 CA-C-O 123.112 1.434 . . . . 0.0 108.539 176.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -64.67 -35.8 82.2 Favored 'General case' 0 C--N 1.38 1.921 0 CA-C-N 112.81 -1.996 . . . . 0.0 108.804 -169.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.74 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.3 tp -65.64 -42.99 90.84 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-O 123.211 1.482 . . . . 0.0 109.198 168.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.9 -33.89 67.38 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.429 -2.169 . . . . 0.0 108.227 174.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.629 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.7 m -73.28 -42.72 62.12 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 113.699 -1.591 . . . . 0.0 109.752 -178.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 78.7 mt -66.62 -48.02 70.79 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 124.659 2.171 . . . . 0.0 108.318 -165.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.986 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.56 -12.84 8.31 Favored 'Isoleucine or valine' 0 C--N 1.389 2.322 0 CA-C-N 110.821 -2.9 . . . . 0.0 107.933 -167.11 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 82.44 35.03 0.07 Allowed 'General case' 0 C--N 1.381 1.939 0 CA-C-O 125.755 2.693 . . . . 0.0 107.865 152.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.986 HD12 HD11 ' P' ' 146' ' ' ILE . 8.8 mt -96.17 170.81 9.0 Favored 'General case' 0 C--N 1.397 2.659 0 CA-C-N 111.571 -2.559 . . . . 0.0 109.382 169.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.643 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.2 p -92.46 140.15 24.04 Favored Pre-proline 0 CA--C 1.592 2.566 0 CA-C-O 122.738 1.256 . . . . 0.0 108.752 170.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.448 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 21.4 Cg_exo -55.08 -33.48 83.79 Favored 'Trans proline' 1 C--N 1.415 4.036 0 C-N-CA 122.902 2.401 . . . . 0.0 113.815 -160.234 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.21 -38.26 73.46 Favored 'General case' 0 C--N 1.382 2.003 0 C-N-CA 119.084 -1.046 . . . . 0.0 109.442 166.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.643 ' N ' ' O ' ' P' ' 149' ' ' THR . 49.1 mt-30 -69.36 -28.4 66.17 Favored 'General case' 0 C--N 1.387 2.214 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 -174.222 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.627 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.1 t -64.2 -71.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.186 0 CA-C-N 121.394 1.906 . . . . 0.0 109.259 164.259 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.627 ' N ' HG12 ' P' ' 153' ' ' VAL . 0.0 OUTLIER -34.69 -58.46 0.5 Allowed 'General case' 0 C--N 1.384 2.093 0 C-N-CA 125.012 1.325 . . . . 0.0 110.54 -176.175 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 28.8 mm -60.65 -38.85 79.69 Favored 'Isoleucine or valine' 0 C--N 1.381 1.969 0 CA-C-N 113.328 -1.76 . . . . 0.0 108.859 -172.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.759 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.1 t90 -67.66 -31.88 72.17 Favored 'General case' 0 C--N 1.384 2.07 0 O-C-N 121.168 -0.957 . . . . 0.0 109.451 172.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.804 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 62.9 m-85 -75.18 -40.14 59.63 Favored 'General case' 0 C--O 1.274 2.358 0 O-C-N 121.231 -0.918 . . . . 0.0 112.115 173.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.431 ' N ' ' O ' ' P' ' 154' ' ' LYS . 77.1 mt-30 -51.72 -61.76 2.05 Favored 'General case' 0 C--N 1.376 1.754 0 O-C-N 119.709 -1.869 . . . . 0.0 106.479 168.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -56.43 -24.19 43.62 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-O 117.446 -1.264 . . . . 0.0 109.448 -167.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.518 ' O ' HG22 ' P' ' 164' ' ' THR . 0.5 OUTLIER -78.33 -39.66 38.91 Favored 'General case' 0 C--O 1.282 2.785 0 CA-C-N 121.606 2.003 . . . . 0.0 111.489 177.425 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.775 ' HD3' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -68.51 -31.07 70.06 Favored 'General case' 0 C--O 1.265 1.903 0 CA-C-N 122.668 2.485 . . . . 0.0 111.137 -177.692 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -67.89 -45.9 73.16 Favored 'General case' 0 C--N 1.38 1.904 0 CA-C-N 120.738 1.608 . . . . 0.0 108.495 172.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 163' ' ' LYS . . . . . 0.403 ' HG3' ' N ' ' P' ' 164' ' ' THR . 0.0 OUTLIER -65.17 -39.52 93.04 Favored 'General case' 0 C--N 1.381 1.973 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -164.25 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.538 HG23 ' HG2' ' P' ' 165' ' ' LYS . 0.5 OUTLIER -52.11 -61.45 2.26 Favored 'General case' 0 C--N 1.378 1.841 0 CA-C-O 124.475 2.083 . . . . 0.0 106.937 -173.95 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.538 ' HG2' HG23 ' P' ' 164' ' ' THR . 5.1 mmmt -59.53 -51.24 70.69 Favored 'General case' 0 C--N 1.385 2.119 1 CA-C-N 108.256 -4.066 . . . . 0.0 108.483 -160.529 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 13.0 ttt85 -52.41 -40.3 61.96 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 112.459 -2.155 . . . . 0.0 109.22 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.52 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -63.11 -33.81 76.26 Favored 'General case' 0 C--N 1.385 2.125 0 CA-C-N 112.791 -2.004 . . . . 0.0 109.05 -172.35 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.62 -21.09 38.49 Favored 'General case' 0 C--N 1.388 2.265 0 CA-C-N 112.149 -2.296 . . . . 0.0 109.267 -173.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -57.19 -29.28 63.56 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.701 1.239 . . . . 0.0 110.042 168.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -73.6 -35.34 65.38 Favored 'General case' 0 C--N 1.386 2.18 0 CA-C-N 113.6 -1.636 . . . . 0.0 108.243 -166.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 6.8 mttt -83.88 94.56 8.26 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 113.947 -1.478 . . . . 0.0 109.169 -155.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 116.33 -83.48 0.34 Allowed Glycine 0 C--N 1.383 3.15 0 N-CA-C 108.738 -1.745 . . . . 0.0 108.738 -155.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 173' ' ' TYR . . . . . 0.423 ' O ' ' HD1' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 155.19 170.8 0.01 OUTLIER 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.399 -1.4 . . . . 0.0 109.786 166.367 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -81.68 51.51 1.71 Allowed 'General case' 0 C--N 1.381 1.941 0 CA-C-N 112.103 -2.317 . . . . 0.0 110.009 174.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -93.53 -38.3 5.33 Favored Glycine 0 C--N 1.384 3.24 0 O-C-N 120.185 -1.572 . . . . 0.0 109.177 -155.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -131.72 116.89 16.14 Favored Pre-proline 0 CA--C 1.581 2.145 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 -169.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo . . . . . 0 CA--C 1.594 3.478 0 C-N-CA 121.432 1.421 . . . . 0.0 111.574 164.117 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.83 0 N19-C1'-C2' 119.027 3.017 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.542 ' N1 ' ' C2 ' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.542 3.88 1 P-O3'-C3' 128.413 7.261 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.496 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.912 0 C2'-C3'-O3' 117.214 2.45 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.544 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.643 0 P-O3'-C3' 123.894 3.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.539 H5'' H2'' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.558 3.952 1 P-O3'-C3' 131.945 10.204 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.509 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.85 1 P-O3'-C3' 127.305 6.338 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 1.005 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.514 0 C3'-C2'-C1' 106.982 3.058 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 1.005 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.474 0 C4'-C3'-C2' 100.216 -2.984 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.725 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.402 0 P-O3'-C3' 123.281 2.985 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.502 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.887 0 P-O3'-C3' 123.363 3.053 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.512 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.474 0 P-O3'-C3' 123.01 2.759 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.604 0 C4'-C3'-C2' 100.456 -2.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.638 " H2'" ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.735 1 P-O3'-C3' 125.191 4.576 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.638 ' H72' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.688 0 O4'-C4'-C3' 108.017 2.417 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.712 ' N9 ' ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.904 1 O4'-C1'-N19 111.301 4.376 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.712 ' H71' ' N9 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.528 0 P-O3'-C3' 122.166 2.055 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.558 0 O5'-C5'-C4' 115.074 3.482 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.465 H2'' ' C8 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.579 0 O4'-C4'-C3' 108.304 2.704 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.465 ' C8 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.338 0 O4'-C4'-C3' 108.122 2.522 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.535 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.393 0 O4'-C4'-C3' 108.108 2.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.535 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.572 4.381 0 N19-C1'-C2' 119.164 3.102 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.518 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.556 3.762 1 P-O3'-C3' 126.531 5.692 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.576 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.533 0 C3'-C2'-C1' 107.312 3.294 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.576 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.613 0 O4'-C4'-C3' 108.698 3.098 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.484 H2'' ' C6 ' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.771 0 O4'-C4'-C3' 108.412 2.812 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.484 ' C6 ' H2'' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.568 3.978 0 N19-C1'-C2' 118.918 2.949 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.577 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.698 0 P-O3'-C3' 122.868 2.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.577 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.561 3.319 0 P-O3'-C3' 122.629 2.441 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.544 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.6 0 O4'-C4'-C3' 108.371 2.771 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.594 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.406 0 O4'-C4'-C3' 107.928 2.328 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.594 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.605 0 O4'-C4'-C3' 108.364 2.764 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . 0.542 ' C2 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.866 0 O4'-C1'-N19 109.406 2.008 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.514 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.94 142.0 23.07 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 113.685 -1.598 . . . . 0.0 108.664 -179.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 169.49 37.7 0.0 OUTLIER 'General case' 0 C--N 1.396 2.604 0 CA-C-N 113.342 -1.754 . . . . 0.0 109.5 -171.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 104' ' ' GLY . . . . . 0.551 ' O ' HD22 ' P' ' 105' ' ' LEU . . . 110.24 -49.3 0.86 Allowed Glycine 0 C--N 1.38 3.028 0 N-CA-C 108.72 -1.752 . . . . 0.0 108.72 162.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.585 HD12 ' HD2' ' P' ' 106' ' ' PRO . 3.4 mm? -134.57 161.56 62.94 Favored Pre-proline 0 CA--C 1.581 2.16 0 CA-C-N 113.746 -1.227 . . . . 0.0 108.69 161.027 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.585 ' HD2' HD12 ' P' ' 105' ' ' LEU . 0.1 OUTLIER -84.96 44.31 1.43 Allowed 'Trans proline' 0 C--N 1.394 2.939 0 C-N-CA 123.089 2.526 . . . . 0.0 110.484 169.736 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 52.8 m-20 -98.29 169.97 9.2 Favored 'General case' 0 C--N 1.383 2.033 0 CA-C-N 113.903 -1.499 . . . . 0.0 109.137 -173.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 108' ' ' LYS . . . . . 0.858 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -90.46 131.51 36.17 Favored 'General case' 0 C--N 1.382 2.009 0 CA-C-N 113.645 -1.616 . . . . 0.0 108.104 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.19 144.06 44.93 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 113.798 -1.547 . . . . 0.0 109.145 170.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.858 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.8 OUTLIER -110.22 50.4 0.8 Allowed 'General case' 0 C--N 1.382 1.979 0 CA-C-N 114.072 -1.422 . . . . 0.0 109.754 -155.116 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.62 ' HD3' " O3'" ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -124.08 101.09 7.04 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.667 -1.606 . . . . 0.0 109.094 171.241 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -102.95 152.58 21.15 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 112.085 -2.325 . . . . 0.0 108.237 154.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.984 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.8 OUTLIER -70.17 114.83 8.7 Favored 'General case' 0 C--N 1.387 2.201 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 -171.73 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.462 HG23 ' P ' ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -102.32 63.95 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.17 0 CA-C-O 125.811 2.72 . . . . 0.0 107.914 -157.482 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.984 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.36 109.42 10.06 Favored 'General case' 0 C--N 1.393 2.488 0 CA-C-N 111.166 -2.743 . . . . 0.0 109.232 -159.432 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.547 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.8 m-85 -75.72 143.2 42.2 Favored 'General case' 0 C--N 1.388 2.264 0 CA-C-N 112.603 -2.089 . . . . 0.0 108.05 -168.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 117' ' ' THR . . . . . 0.409 ' O ' ' N ' ' P' ' 121' ' ' THR . 1.2 p -65.88 147.64 53.05 Favored 'General case' 0 C--N 1.382 2.006 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -169.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -42.85 -36.56 1.53 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-N 113.843 -1.526 . . . . 0.0 109.286 -176.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.89 -65.54 0.55 Allowed 'General case' 0 C--N 1.382 2.014 0 CA-C-O 124.172 1.939 . . . . 0.0 109.261 174.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.566 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.0 mt-30 -50.96 -47.39 61.29 Favored 'General case' 0 C--N 1.381 1.967 0 CA-C-N 112.426 -2.17 . . . . 0.0 110.073 177.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.635 ' HA ' HD12 ' P' ' 124' ' ' LEU . 11.3 m -50.02 -57.83 6.76 Favored 'General case' 0 C--N 1.383 2.03 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 168.43 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.583 ' CE1' ' HG2' ' P' ' 126' ' ' ARG . 0.9 OUTLIER -52.86 -47.79 67.55 Favored 'General case' 0 C--N 1.383 2.038 0 CA-C-O 122.377 1.084 . . . . 0.0 110.017 -169.097 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.95 ' CD ' HG22 ' P' ' 146' ' ' ILE . 7.1 mt-10 -66.94 -35.86 80.93 Favored 'General case' 0 C--N 1.379 1.862 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.875 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.8 mt -60.43 -52.4 65.37 Favored 'General case' 0 C--N 1.383 2.043 0 O-C-N 120.044 -1.66 . . . . 0.0 110.592 168.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' P' ' 129' ' ' ARG . 15.8 mt-10 -53.77 -53.65 49.35 Favored 'General case' 0 C--N 1.379 1.854 0 CA-C-O 122.248 1.023 . . . . 0.0 108.874 177.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.583 ' HG2' ' CE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -38.05 -67.25 0.21 Allowed 'General case' 0 C--N 1.38 1.926 0 CA-C-N 111.683 -2.508 . . . . 0.0 108.679 176.403 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.725 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -64.14 -29.94 71.04 Favored 'General case' 0 C--N 1.394 2.501 0 CA-C-N 112.287 -2.233 . . . . 0.0 108.23 -169.897 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.8 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 12.3 t80 -69.44 -50.73 42.91 Favored 'General case' 0 C--N 1.389 2.29 0 O-C-N 121.134 -0.979 . . . . 0.0 110.956 172.368 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.45 ' N ' ' O ' ' P' ' 125' ' ' GLU . 10.1 mmm180 -62.28 -11.87 17.5 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.083 -1.872 . . . . 0.0 108.093 -166.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 130' ' ' GLN . . . . . 0.506 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 34.2 mt-30 -109.19 -39.74 5.16 Favored 'General case' 0 C--N 1.38 1.892 0 C-N-CA 126.355 1.862 . . . . 0.0 108.044 -171.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.505 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -153.15 109.36 3.35 Favored 'General case' 0 C--N 1.389 2.295 0 CA-C-N 112.24 -2.255 . . . . 0.0 109.217 -153.579 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -77.05 -19.77 56.73 Favored 'General case' 0 C--N 1.394 2.519 0 CA-C-N 112.171 -2.286 . . . . 0.0 110.806 -168.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.54 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 15.4 m-85 -159.82 114.34 2.31 Favored 'General case' 0 C--N 1.38 1.9 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.373 -153.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.614 HD22 ' HG3' ' P' ' 138' ' ' GLU . 27.1 mt -126.66 136.97 53.19 Favored 'General case' 0 C--N 1.399 2.754 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -158.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 155.16 25.93 Favored 'General case' 0 C--N 1.382 1.998 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 166.25 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.507 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.57 -49.62 91.2 Favored Pre-proline 0 CA--C 1.582 2.209 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.355 -161.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.507 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 81.3 Cg_exo -58.2 -28.69 84.99 Favored 'Trans proline' 0 C--N 1.401 3.297 0 C-N-CA 121.048 1.165 . . . . 0.0 114.894 -174.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.614 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.1 OUTLIER -54.03 -71.06 0.08 Allowed 'General case' 0 C--N 1.38 1.9 0 CA-C-O 124.704 2.192 . . . . 0.0 106.334 160.393 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.832 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.1 -40.14 82.66 Favored 'General case' 0 C--N 1.389 2.303 0 CA-C-N 109.965 -3.289 . . . . 0.0 108.885 -154.927 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.647 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 3.9 mt-10 -53.35 -39.17 63.93 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 123.163 1.459 . . . . 0.0 108.304 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -64.28 -35.46 80.91 Favored 'General case' 0 C--N 1.38 1.918 0 CA-C-N 112.945 -1.934 . . . . 0.0 108.732 -171.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.725 HD13 ' CG ' ' P' ' 127' ' ' ARG . 2.3 tp -65.47 -42.77 91.9 Favored 'General case' 0 C--N 1.383 2.023 0 CA-C-O 123.223 1.487 . . . . 0.0 109.038 168.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -57.04 -34.71 68.5 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-N 112.38 -2.191 . . . . 0.0 108.592 174.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.617 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 0.9 OUTLIER -73.51 -43.22 60.56 Favored 'General case' 0 C--N 1.387 2.225 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.19 -179.443 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 145' ' ' LEU . . . . . 0.725 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 75.0 mt -66.19 -48.06 71.9 Favored 'General case' 0 C--N 1.379 1.888 0 CA-C-O 124.743 2.211 . . . . 0.0 107.954 -164.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.987 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -94.68 -17.03 7.26 Favored 'Isoleucine or valine' 0 C--N 1.385 2.145 0 CA-C-N 110.544 -3.025 . . . . 0.0 107.84 -172.104 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 147' ' ' ARG . . . . . 0.725 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.0 OUTLIER 81.19 37.21 0.08 Allowed 'General case' 0 C--N 1.385 2.126 0 CA-C-N 111.494 -2.594 . . . . 0.0 108.112 152.777 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.987 HD12 HD11 ' P' ' 146' ' ' ILE . 6.1 mt -95.24 168.08 10.96 Favored 'General case' 0 C--N 1.39 2.35 0 CA-C-N 112.13 -2.305 . . . . 0.0 109.416 168.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.643 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.0 p -88.12 143.97 33.73 Favored Pre-proline 0 CA--C 1.587 2.392 0 CA-C-O 122.986 1.374 . . . . 0.0 108.273 172.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.402 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 1.3 Cg_endo -59.73 -38.44 80.85 Favored 'Trans proline' 1 C--N 1.415 4.031 0 C-N-CA 122.715 2.277 . . . . 0.0 112.073 -155.568 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 151' ' ' THR . . . . . 0.518 HG22 HG12 ' P' ' 155' ' ' ILE . 0.4 OUTLIER -57.81 -29.47 64.93 Favored 'General case' 0 C--N 1.385 2.129 0 CA-C-O 118.081 -0.961 . . . . 0.0 110.343 167.754 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.643 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -73.64 -28.04 61.58 Favored 'General case' 0 C--N 1.388 2.258 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.618 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.3 t -64.38 -72.53 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 122.019 2.19 . . . . 0.0 109.439 164.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.832 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.27 -57.44 0.49 Allowed 'General case' 0 C--N 1.385 2.148 0 C-N-CA 125.188 1.395 . . . . 0.0 111.017 -177.698 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.518 HG12 HG22 ' P' ' 151' ' ' THR . 0.7 OUTLIER -53.04 -47.81 53.71 Favored 'Isoleucine or valine' 0 C--N 1.386 2.17 0 CA-C-N 112.86 -1.973 . . . . 0.0 108.967 -176.45 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.875 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.4 t90 -66.19 -31.06 71.67 Favored 'General case' 0 C--N 1.382 1.98 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.8 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 69.0 m-85 -74.82 -39.87 61.4 Favored 'General case' 0 C--O 1.274 2.373 0 O-C-N 121.257 -0.902 . . . . 0.0 112.057 174.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' P' ' 154' ' ' LYS . 24.7 mt-30 -49.71 -63.87 0.98 Allowed 'General case' 0 C--N 1.377 1.762 0 O-C-N 119.558 -1.964 . . . . 0.0 106.953 167.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -57.48 -13.55 3.79 Favored 'General case' 0 C--N 1.388 2.253 0 CA-C-O 118.129 -0.938 . . . . 0.0 111.024 -165.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.559 ' ND1' ' CE2' ' P' ' 128' ' ' PHE . 31.5 t-80 -78.44 -56.45 4.43 Favored 'General case' 0 C--O 1.279 2.655 0 CA-C-N 120.46 1.482 . . . . 0.0 110.92 167.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.548 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -65.63 -37.54 86.86 Favored 'General case' 0 C--O 1.267 2.016 0 O-C-N 118.639 -2.538 . . . . 0.0 110.587 -155.909 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -69.04 -35.87 77.08 Favored 'General case' 0 C--N 1.38 1.92 0 O-C-N 119.94 -1.725 . . . . 0.0 109.657 175.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -41.59 92.23 Favored 'General case' 0 C--N 1.381 1.938 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -170.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.548 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -52.2 -58.8 5.51 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 125.329 2.49 . . . . 0.0 106.57 -171.963 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.442 ' HG2' HG23 ' P' ' 164' ' ' THR . 9.6 mmmt -58.71 -41.94 87.48 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 108.51 -3.95 . . . . 0.0 109.348 -168.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.6 -47.54 63.55 Favored 'General case' 0 C--N 1.38 1.93 0 CA-C-N 112.754 -2.021 . . . . 0.0 111.109 175.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -45.92 -40.28 9.96 Favored 'General case' 0 C--N 1.382 2.004 0 CA-C-O 123.548 1.642 . . . . 0.0 108.207 177.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -81.2 -23.04 38.42 Favored 'General case' 0 C--N 1.392 2.427 0 CA-C-N 111.445 -2.616 . . . . 0.0 109.949 -166.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -60.7 -33.55 73.04 Favored 'General case' 0 C--N 1.383 2.035 0 CA-C-N 113.498 -1.683 . . . . 0.0 109.466 169.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -61.27 -41.27 96.65 Favored 'General case' 0 C--N 1.384 2.086 0 CA-C-N 114.25 -1.341 . . . . 0.0 108.104 177.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -85.41 85.53 7.43 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-N 113.73 -1.577 . . . . 0.0 109.073 -158.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 131.3 -80.62 0.34 Allowed Glycine 0 C--N 1.382 3.09 0 N-CA-C 108.896 -1.682 . . . . 0.0 108.896 -155.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 173' ' ' TYR . . . . . 0.485 ' O ' ' HD1' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 158.85 173.33 0.01 OUTLIER 'General case' 0 C--N 1.382 2.019 0 CA-C-O 123.023 1.392 . . . . 0.0 109.856 160.478 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.93 69.42 9.73 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-N 112.239 -2.255 . . . . 0.0 109.404 176.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -61.66 -159.3 0.11 Allowed Glycine 0 C--N 1.379 2.955 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 166.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -103.45 136.26 19.25 Favored Pre-proline 0 CA--C 1.58 2.114 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -177.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo . . . . . 0 CA--C 1.594 3.522 0 C-N-CA 121.542 1.494 . . . . 0.0 111.58 178.002 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.788 0 O5'-C5'-C4' 114.352 2.966 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.641 ' O6 ' ' N4 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.364 0 P-O3'-C3' 122.723 2.519 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.587 ' H71' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.877 1 P-O3'-C3' 125.257 4.631 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.608 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.529 0 P-O3'-C3' 123.38 3.066 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.518 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.914 0 N19-C1'-C2' 118.154 2.471 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.518 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 1 C4'--C3' 1.57 4.169 1 P-O3'-C3' 127.428 6.44 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 1.023 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.57 4.236 0 P-O3'-C3' 124.262 3.802 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 1.023 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.543 3.998 1 P-O3'-C3' 126.51 5.675 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.585 ' C8 ' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.654 0 O4'-C4'-C3' 108.71 3.11 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.559 ' C7 ' ' C8 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.929 0 P-O3'-C3' 123.119 2.849 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.497 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.65 0 C3'-C2'-C1' 106.586 2.776 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . 0.579 H2'' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.402 1 P-O3'-C3' 129.43 8.108 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.579 ' C6 ' H2'' ' A' ' 12' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.644 0 O4'-C4'-C3' 108.335 2.735 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.602 0 O4'-C4'-C3' 108.686 3.086 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.935 ' C4 ' ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.541 3.718 1 O4'-C1'-N19 111.308 4.385 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.935 ' H71' ' C4 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.545 0 O4'-C1'-N19 109.725 2.406 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.674 0 O5'-C5'-C4' 115.074 3.481 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.533 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.64 1 P-O3'-C3' 126.964 6.053 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.533 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.491 1 P-O3'-C3' 129.171 7.892 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.569 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.349 0 O4'-C4'-C3' 107.924 2.324 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.569 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.573 4.477 0 O4'-C1'-N19 105.237 -3.203 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.553 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.557 3.881 0 P-O3'-C3' 123.745 3.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.643 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.661 1 P-O3'-C3' 124.868 4.306 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.643 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.465 0 O4'-C4'-C3' 108.613 3.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.524 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.156 0 C2'-C3'-O3' 117.026 2.38 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.587 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.568 3.989 0 P-O3'-C3' 124.148 3.706 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.605 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.567 1 P-O3'-C3' 126.338 5.532 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.625 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.375 0 P-O3'-C3' 122.546 2.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.625 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.678 1 P-O3'-C3' 125.869 5.141 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.43 0 O4'-C4'-C3' 107.944 2.344 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.641 ' N4 ' ' O6 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.632 0 O4'-C4'-C3' 108.285 2.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.905 0 O4'-C1'-N19 109.351 1.939 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.511 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.2 m -70.57 -45.2 65.87 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 113.703 -1.59 . . . . 0.0 108.682 -173.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 2.1 p30 170.3 -38.33 0.0 OUTLIER 'General case' 0 C--N 1.388 2.28 0 CA-C-N 113.518 -1.674 . . . . 0.0 107.965 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 104' ' ' GLY . . . . . 0.655 ' O ' HD22 ' P' ' 105' ' ' LEU . . . -121.81 -69.15 0.26 Allowed Glycine 0 C--N 1.382 3.084 0 N-CA-C 108.892 -1.683 . . . . 0.0 108.892 -162.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.655 HD22 ' O ' ' P' ' 104' ' ' GLY . 0.4 OUTLIER -171.66 151.69 2.94 Favored Pre-proline 0 CA--C 1.581 2.158 0 CA-C-N 113.658 -1.271 . . . . 0.0 108.553 -173.582 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 106' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -50.23 92.49 0.03 OUTLIER 'Trans proline' 0 C--N 1.396 3.074 0 C-N-CA 122.783 2.322 . . . . 0.0 110.354 155.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -81.39 100.6 9.34 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-O 122.485 1.136 . . . . 0.0 109.138 163.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 15.1 mtpt -128.1 -67.68 0.8 Allowed 'General case' 0 C--N 1.383 2.032 0 CA-C-N 113.707 -1.588 . . . . 0.0 108.142 -177.065 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.561 ' HE3' ' N ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -67.11 149.68 50.22 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 113.623 -1.626 . . . . 0.0 108.99 -171.968 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.576 ' HD2' ' C ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER 177.93 130.06 0.06 Allowed 'General case' 0 C--N 1.382 2.015 0 CA-C-O 123.832 1.777 . . . . 0.0 108.558 -155.372 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.826 ' HD3' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -138.81 111.83 7.9 Favored 'General case' 0 C--N 1.384 2.1 0 CA-C-N 112.606 -2.088 . . . . 0.0 107.501 156.673 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 112' ' ' ARG . . . . . 0.502 ' NH2' HG12 ' P' ' 114' ' ' VAL . 8.0 mtm180 -71.68 -176.12 1.54 Allowed 'General case' 0 C--N 1.385 2.131 0 CA-C-N 113.134 -1.848 . . . . 0.0 108.627 173.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 1.111 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.0 OUTLIER -91.89 95.37 9.79 Favored 'General case' 0 C--N 1.381 1.977 0 N-CA-C 105.911 -1.885 . . . . 0.0 105.911 162.796 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.712 HG22 ' OP2' ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -97.97 56.86 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.391 2.37 0 CA-C-O 125.472 2.558 . . . . 0.0 108.408 -169.245 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 1.111 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.1 OUTLIER -77.66 105.71 9.0 Favored 'General case' 0 C--N 1.388 2.259 0 CA-C-N 110.701 -2.954 . . . . 0.0 109.317 -157.33 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.495 ' CE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 -76.22 141.18 41.83 Favored 'General case' 0 C--N 1.392 2.441 0 CA-C-N 112.081 -2.327 . . . . 0.0 107.793 -162.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 117' ' ' THR . . . . . 0.402 ' O ' ' N ' ' P' ' 121' ' ' THR . 1.3 p -65.62 147.56 53.2 Favored 'General case' 0 C--N 1.382 1.98 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -166.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' P' ' 122' ' ' TYR . 36.6 ttmt -42.62 -36.0 1.26 Allowed 'General case' 0 C--N 1.381 1.963 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.489 -176.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.04 -67.78 0.23 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 123.995 1.855 . . . . 0.0 109.207 173.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.569 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.6 mt-30 -47.68 -50.56 24.49 Favored 'General case' 0 C--N 1.382 2.014 0 CA-C-N 112.47 -2.15 . . . . 0.0 110.217 176.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.592 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.1 m -49.44 -58.73 4.61 Favored 'General case' 0 C--N 1.383 2.026 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 169.586 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.575 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 1.2 t80 -52.97 -47.2 68.33 Favored 'General case' 0 C--N 1.384 2.071 0 CA-C-O 122.435 1.112 . . . . 0.0 109.825 -169.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.977 ' CD ' HG22 ' P' ' 146' ' ' ILE . 3.2 mt-10 -66.81 -36.7 82.99 Favored 'General case' 0 C--O 1.265 1.91 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.063 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.794 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.7 mt -60.56 -52.19 66.21 Favored 'General case' 0 C--N 1.382 1.984 0 O-C-N 119.521 -1.987 . . . . 0.0 109.88 169.033 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.47 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.2 mt-10 -53.77 -51.35 63.71 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-O 122.245 1.021 . . . . 0.0 109.213 178.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.575 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.6 -69.68 0.12 Allowed 'General case' 0 C--N 1.379 1.874 0 CA-C-N 111.767 -2.47 . . . . 0.0 108.69 175.045 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.657 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.4 OUTLIER -58.2 -38.09 76.07 Favored 'General case' 0 C--N 1.391 2.398 0 CA-C-N 112.999 -1.91 . . . . 0.0 108.288 -171.768 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.83 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 20.8 t80 -69.71 -45.5 68.1 Favored 'General case' 0 C--N 1.381 1.958 0 O-C-N 121.559 -0.713 . . . . 0.0 110.817 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' P' ' 125' ' ' GLU . 13.8 mmm180 -62.33 -15.98 51.41 Favored 'General case' 0 C--N 1.38 1.915 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 -170.263 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 130' ' ' GLN . . . . . 0.425 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 37.0 mt-30 -104.41 -37.9 7.02 Favored 'General case' 0 C--N 1.38 1.908 0 C-N-CA 126.776 2.031 . . . . 0.0 107.503 -168.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.527 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -155.34 107.75 2.69 Favored 'General case' 0 C--N 1.387 2.232 0 CA-C-N 111.914 -2.403 . . . . 0.0 108.84 -153.86 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.86 -21.12 60.22 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 112.218 -2.265 . . . . 0.0 110.873 -167.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.536 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 33.8 m-85 -159.33 112.84 2.28 Favored 'General case' 0 C--N 1.38 1.901 0 CA-C-N 113.305 -1.77 . . . . 0.0 108.14 -153.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.657 HD11 ' CD ' ' P' ' 127' ' ' ARG . 18.6 mt -124.63 135.83 53.42 Favored 'General case' 0 C--N 1.396 2.611 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 -158.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.12 155.05 26.44 Favored 'General case' 0 C--N 1.381 1.973 0 O-C-N 120.612 -1.305 . . . . 0.0 107.498 167.22 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.513 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.42 -49.62 91.51 Favored Pre-proline 0 CA--C 1.583 2.22 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 -160.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.513 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 79.7 Cg_exo -58.15 -30.03 89.21 Favored 'Trans proline' 0 C--N 1.402 3.342 0 N-CA-C 114.87 1.065 . . . . 0.0 114.87 -175.089 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.586 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.3 OUTLIER -54.37 -69.46 0.13 Allowed 'General case' 0 C--N 1.38 1.912 0 CA-C-O 124.54 2.114 . . . . 0.0 106.378 161.164 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.93 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.08 -39.5 82.91 Favored 'General case' 0 C--N 1.392 2.428 0 CA-C-N 109.942 -3.299 . . . . 0.0 108.657 -154.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.633 ' O ' ' N ' ' P' ' 144' ' ' SER . 4.0 mt-10 -53.13 -38.03 62.31 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-O 122.498 1.142 . . . . 0.0 108.568 178.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -64.22 -37.03 86.03 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-N 113.142 -1.845 . . . . 0.0 109.347 -174.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.63 ' O ' HG23 ' P' ' 146' ' ' ILE . 0.4 OUTLIER -57.86 -47.33 83.02 Favored 'General case' 0 C--N 1.385 2.151 0 CA-C-O 123.125 1.44 . . . . 0.0 108.719 164.804 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -62.73 -31.71 72.69 Favored 'General case' 0 C--N 1.387 2.208 0 CA-C-N 112.104 -2.316 . . . . 0.0 109.087 -179.376 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.633 ' N ' ' O ' ' P' ' 140' ' ' GLU . 5.9 t -74.45 -41.95 59.94 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-N 114.243 -1.344 . . . . 0.0 109.037 -178.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 145' ' ' LEU . . . . . 0.462 HD13 ' OE1' ' P' ' 123' ' ' GLU . 39.5 mt -63.86 -46.62 84.18 Favored 'General case' 0 C--N 1.381 1.962 0 CA-C-O 124.52 2.105 . . . . 0.0 108.269 -167.043 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 1.022 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -101.41 -12.67 8.55 Favored 'Isoleucine or valine' 0 C--N 1.388 2.25 0 CA-C-N 110.739 -2.937 . . . . 0.0 108.155 -165.437 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 82.08 34.42 0.08 Allowed 'General case' 0 C--N 1.383 2.047 0 CA-C-O 125.547 2.594 . . . . 0.0 108.147 153.294 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 1.022 HD12 HD11 ' P' ' 146' ' ' ILE . 7.6 mt -96.49 169.47 9.88 Favored 'General case' 0 C--N 1.397 2.637 0 CA-C-N 111.652 -2.522 . . . . 0.0 109.475 169.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.613 ' O ' ' N ' ' P' ' 152' ' ' GLN . 21.5 p -91.31 145.29 31.17 Favored Pre-proline 0 CA--C 1.588 2.435 0 CA-C-O 122.91 1.338 . . . . 0.0 108.735 171.144 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.426 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 2.2 Cg_endo -62.07 -37.43 64.1 Favored 'Trans proline' 1 C--N 1.414 4.021 0 C-N-CA 122.682 2.255 . . . . 0.0 113.128 -155.864 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.92 -35.62 61.86 Favored 'General case' 0 C--N 1.384 2.066 0 C-N-CA 119.676 -0.81 . . . . 0.0 109.671 165.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.613 ' N ' ' O ' ' P' ' 149' ' ' THR . 44.3 mt-30 -70.48 -27.42 64.2 Favored 'General case' 0 C--N 1.389 2.296 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 -177.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.612 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.3 t -64.68 -71.84 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.105 0 CA-C-N 121.487 1.949 . . . . 0.0 109.666 163.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.93 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.8 -59.61 0.4 Allowed 'General case' 0 C--N 1.386 2.188 0 CA-C-O 122.668 1.223 . . . . 0.0 110.656 -178.163 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 10.2 mm -56.25 -41.89 71.85 Favored 'Isoleucine or valine' 0 C--N 1.381 1.948 0 CA-C-N 113.114 -1.857 . . . . 0.0 108.984 -174.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.794 ' HB3' HD22 ' P' ' 124' ' ' LEU . 7.4 t90 -68.24 -32.24 72.3 Favored 'General case' 0 C--N 1.382 1.98 0 O-C-N 120.962 -1.086 . . . . 0.0 109.637 173.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.83 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 59.6 m-85 -74.81 -40.48 61.07 Favored 'General case' 0 C--O 1.276 2.484 0 O-C-N 120.932 -1.105 . . . . 0.0 112.074 174.342 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' P' ' 154' ' ' LYS . 25.3 mt-30 -48.94 -64.19 0.88 Allowed 'General case' 0 C--N 1.377 1.795 0 O-C-N 119.543 -1.973 . . . . 0.0 106.674 167.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -55.94 -23.34 31.37 Favored 'General case' 0 C--N 1.389 2.285 0 CA-C-O 117.579 -1.2 . . . . 0.0 109.706 -163.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.527 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 3.6 t-160 -76.34 -47.64 22.78 Favored 'General case' 0 C--O 1.281 2.758 0 CA-C-N 121.239 1.836 . . . . 0.0 110.949 177.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.609 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -66.69 -36.36 82.34 Favored 'General case' 0 C--O 1.266 1.933 0 CA-C-N 122.815 2.552 . . . . 0.0 110.619 -161.925 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 162' ' ' TYR . . . . . 0.487 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 58.3 t80 -68.88 -35.79 77.31 Favored 'General case' 0 C--N 1.38 1.913 0 O-C-N 120.081 -1.637 . . . . 0.0 109.588 171.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -63.83 -39.27 93.83 Favored 'General case' 0 C--N 1.382 2.004 0 O-C-N 121.608 -0.683 . . . . 0.0 109.432 -169.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.609 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -54.95 -60.98 2.62 Favored 'General case' 0 C--N 1.378 1.836 0 CA-C-O 125.008 2.337 . . . . 0.0 106.416 -173.159 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.458 ' HG2' HG23 ' P' ' 164' ' ' THR . 7.7 mmmt -58.97 -46.56 87.8 Favored 'General case' 0 C--N 1.387 2.215 1 CA-C-N 108.171 -4.104 . . . . 0.0 108.1 -161.026 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 10.9 ttt180 -56.82 -42.52 79.73 Favored 'General case' 0 C--N 1.38 1.92 0 CA-C-N 112.274 -2.239 . . . . 0.0 109.23 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -58.97 -33.19 70.37 Favored 'General case' 0 C--N 1.383 2.047 0 CA-C-O 124.283 1.992 . . . . 0.0 109.167 -177.201 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -84.58 -22.61 29.98 Favored 'General case' 0 C--N 1.393 2.494 0 CA-C-N 112.062 -2.336 . . . . 0.0 110.064 -173.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -50.39 -32.27 17.08 Favored 'General case' 0 C--N 1.379 1.875 0 CA-C-O 122.932 1.349 . . . . 0.0 109.705 167.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -78.2 -34.23 49.54 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.137 -1.847 . . . . 0.0 107.879 -159.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 16.1 mttt -73.21 87.19 1.44 Allowed 'General case' 0 C--N 1.382 1.978 0 CA-C-N 113.653 -1.612 . . . . 0.0 108.809 -157.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 172' ' ' GLY . . . . . 0.459 ' C ' ' CG ' ' P' ' 173' ' ' TYR . . . 102.09 -94.47 1.2 Allowed Glycine 0 C--N 1.382 3.088 0 N-CA-C 108.333 -1.907 . . . . 0.0 108.333 -154.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 173' ' ' TYR . . . . . 0.459 ' CG ' ' C ' ' P' ' 172' ' ' GLY . 0.0 OUTLIER 172.26 141.27 0.03 OUTLIER 'General case' 0 C--N 1.381 1.96 0 CA-C-N 113.107 -1.546 . . . . 0.0 109.116 -177.655 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -167.38 174.37 8.06 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-N 113.314 -1.767 . . . . 0.0 107.343 154.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 109.55 38.49 1.75 Allowed Glycine 0 C--N 1.38 3.025 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 160.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -147.11 131.16 8.48 Favored Pre-proline 0 CA--C 1.58 2.127 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 167.08 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo . . . . . 0 CA--C 1.593 3.466 0 C-N-CA 121.457 1.438 . . . . 0.0 111.606 -170.838 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.779 0 O5'-C5'-C4' 114.381 2.986 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.543 ' N1 ' ' N3 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.317 1 P-O3'-C3' 127.247 6.289 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.531 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.568 3.965 0 P-O3'-C3' 122.582 2.402 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.531 ' C8 ' H2'' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.626 0 P-O3'-C3' 123.301 3.001 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.518 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.855 0 O4'-C4'-C3' 107.977 2.377 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.534 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.951 0 P-O3'-C3' 123.031 2.776 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.749 " H4'" ' HG2' ' P' ' 113' ' ' ARG . . . . . . . . 0 C4'--C3' 1.566 3.847 0 P-O3'-C3' 123.924 3.52 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.565 ' C6 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.582 0 P-O3'-C3' 123.893 3.494 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.636 ' N1 ' ' N3 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.562 3.361 0 P-O3'-C3' 123.802 3.419 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.606 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.935 0 P-O3'-C3' 123.937 3.531 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.523 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.398 0 P-O3'-C3' 122.816 2.597 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.388 0 O4'-C4'-C3' 108.176 2.576 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.529 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.734 1 P-O3'-C3' 125.739 5.033 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.529 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.706 0 P-O3'-C3' 122.441 2.284 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.76 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.543 4.005 1 O4'-C1'-N19 111.059 4.074 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.76 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.559 1 P-O3'-C3' 124.564 4.054 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . 0.442 " H1'" " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.542 3.866 0 O5'-C5'-C4' 115.023 3.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.442 " H5'" " H1'" ' B' ' 17' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.974 1 P-O3'-C3' 126.507 5.672 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.419 ' C8 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.427 0 O4'-C4'-C3' 108.005 2.405 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.431 " H1'" ' N3 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.3 0 O4'-C4'-C3' 108.203 2.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.513 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.572 4.406 0 N19-C1'-C2' 119.13 3.081 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.513 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.558 3.996 1 P-O3'-C3' 126.598 5.748 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.602 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.562 3.445 1 P-O3'-C3' 125.098 4.499 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.636 ' N3 ' ' N1 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.702 0 O4'-C4'-C3' 108.28 2.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.447 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.225 1 P-O3'-C3' 126.477 5.648 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.545 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.223 0 P-O3'-C3' 124.389 3.907 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.554 H2'' ' C8 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.675 0 P-O3'-C3' 124.104 3.67 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.554 ' C8 ' H2'' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.635 0 C4'-C3'-C2' 100.167 -3.033 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.427 ' O2 ' ' N2 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.568 4.028 0 P-O3'-C3' 123.506 3.172 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.586 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.31 0 O4'-C4'-C3' 107.874 2.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.586 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.587 0 O4'-C4'-C3' 108.285 2.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.927 0 O4'-C1'-N19 109.341 1.926 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.528 3.473 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 12.7 m 81.83 89.28 0.04 OUTLIER 'General case' 0 C--N 1.381 1.973 0 CA-C-N 113.639 -1.619 . . . . 0.0 108.647 164.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 1.2 p30 169.36 -26.08 0.0 OUTLIER 'General case' 0 C--N 1.391 2.371 0 CA-C-N 113.496 -1.684 . . . . 0.0 108.098 176.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -134.53 142.41 13.87 Favored Glycine 0 C--N 1.382 3.085 0 N-CA-C 108.914 -1.675 . . . . 0.0 108.914 171.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.559 HD23 ' HD2' ' P' ' 106' ' ' PRO . 0.2 OUTLIER -105.99 -176.18 0.41 Allowed Pre-proline 0 CA--C 1.582 2.175 0 CA-C-N 113.702 -1.249 . . . . 0.0 108.779 172.871 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.559 ' HD2' HD23 ' P' ' 105' ' ' LEU . 94.9 Cg_exo -54.0 91.52 0.04 OUTLIER 'Trans proline' 0 C--N 1.397 3.092 0 C-N-CA 122.823 2.348 . . . . 0.0 110.297 155.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -127.98 155.41 44.31 Favored 'General case' 0 C--N 1.381 1.967 0 CA-C-O 122.45 1.119 . . . . 0.0 109.202 167.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 108' ' ' LYS . . . . . 0.601 ' H ' ' HD2' ' P' ' 108' ' ' LYS . 0.0 OUTLIER -109.26 168.11 9.62 Favored 'General case' 0 C--N 1.382 2.013 0 CA-C-N 113.703 -1.59 . . . . 0.0 108.239 159.273 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.465 ' HG3' ' N ' ' P' ' 110' ' ' ARG . 0.1 OUTLIER -80.62 152.83 28.33 Favored 'General case' 0 C--N 1.381 1.935 0 CA-C-N 113.761 -1.563 . . . . 0.0 109.317 -176.065 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.538 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.6 OUTLIER -144.57 89.56 2.01 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 113.646 -1.615 . . . . 0.0 109.208 -155.447 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.473 ' HD3' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -27.68 92.45 0.01 OUTLIER 'General case' 0 C--N 1.381 1.966 0 CA-C-N 113.328 -1.76 . . . . 0.0 110.273 174.907 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 70.5 mtt85 -65.28 172.87 2.84 Favored 'General case' 0 C--N 1.39 2.342 0 CA-C-N 111.855 -2.429 . . . . 0.0 108.839 155.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.882 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.3 OUTLIER -93.28 117.49 30.14 Favored 'General case' 0 C--N 1.382 2.015 0 CA-C-N 113.902 -1.499 . . . . 0.0 107.163 167.645 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 114' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -108.32 64.76 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.162 0 CA-C-O 125.817 2.722 . . . . 0.0 107.911 -161.173 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.882 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.17 110.29 10.54 Favored 'General case' 0 C--N 1.391 2.407 0 CA-C-N 111.206 -2.724 . . . . 0.0 109.123 -158.069 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.668 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 1.1 m-85 -76.05 143.53 41.34 Favored 'General case' 0 C--N 1.389 2.321 0 CA-C-N 112.799 -2.0 . . . . 0.0 107.832 -167.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.41 148.03 52.42 Favored 'General case' 0 C--N 1.382 1.99 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -168.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' P' ' 122' ' ' TYR . 37.2 ttmt -42.15 -36.02 1.08 Allowed 'General case' 0 C--N 1.381 1.966 0 CA-C-N 114.037 -1.438 . . . . 0.0 109.29 -177.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.93 -67.72 0.24 Allowed 'General case' 0 C--N 1.382 1.982 0 CA-C-O 124.217 1.961 . . . . 0.0 109.104 173.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.541 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.7 mt-30 -48.56 -48.05 39.02 Favored 'General case' 0 C--N 1.382 2.008 0 CA-C-N 112.419 -2.173 . . . . 0.0 110.052 177.188 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.666 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.9 m -52.05 -56.37 14.78 Favored 'General case' 0 C--N 1.383 2.027 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 169.42 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.663 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.2 t80 -53.16 -46.68 68.99 Favored 'General case' 0 C--N 1.383 2.023 0 CA-C-O 122.325 1.059 . . . . 0.0 110.15 -170.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.648 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.1 OUTLIER -66.29 -39.17 89.19 Favored 'General case' 0 C--N 1.38 1.894 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.219 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.805 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -60.16 -49.74 76.42 Favored 'General case' 0 C--N 1.385 2.142 0 O-C-N 120.691 -1.255 . . . . 0.0 109.727 172.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.54 ' O ' ' N ' ' P' ' 129' ' ' ARG . 13.3 mt-10 -55.17 -53.3 57.78 Favored 'General case' 0 C--N 1.38 1.909 0 CA-C-O 122.509 1.147 . . . . 0.0 109.461 176.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.663 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.9 -69.23 0.14 Allowed 'General case' 0 C--N 1.378 1.825 0 CA-C-N 111.897 -2.41 . . . . 0.0 108.665 177.862 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.848 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -57.49 -37.25 72.62 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 112.686 -2.052 . . . . 0.0 108.342 -173.334 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.827 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 24.7 t80 -70.0 -45.98 66.13 Favored 'General case' 0 C--N 1.38 1.927 0 CA-C-O 121.58 0.705 . . . . 0.0 110.752 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.54 ' N ' ' O ' ' P' ' 125' ' ' GLU . 7.6 mmm180 -62.54 -14.45 42.16 Favored 'General case' 0 C--N 1.381 1.941 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -169.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 130' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' P' ' 126' ' ' ARG . 39.4 mt-30 -107.67 -37.84 6.04 Favored 'General case' 0 C--N 1.38 1.91 0 C-N-CA 126.607 1.963 . . . . 0.0 107.687 -167.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.493 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -154.2 105.78 2.73 Favored 'General case' 0 C--N 1.388 2.273 0 CA-C-N 112.018 -2.355 . . . . 0.0 108.83 -153.552 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 132' ' ' ARG . . . . . 0.745 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 3.2 mtt85 -77.36 -18.31 57.48 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 111.841 -2.436 . . . . 0.0 110.474 -169.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.745 ' HD1' ' O ' ' P' ' 132' ' ' ARG . 4.1 m-30 -154.66 111.25 3.28 Favored 'General case' 0 C--N 1.38 1.921 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.3 -154.198 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.614 HD22 ' HG3' ' P' ' 138' ' ' GLU . 31.5 mt -126.13 136.66 53.15 Favored 'General case' 0 C--N 1.397 2.65 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -161.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.54 155.31 25.8 Favored 'General case' 0 C--N 1.382 1.989 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 166.009 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.509 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.59 -49.43 92.09 Favored Pre-proline 0 CA--C 1.583 2.228 0 C-N-CA 120.049 -0.661 . . . . 0.0 109.347 -161.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 82.9 Cg_exo -58.15 -28.64 84.62 Favored 'Trans proline' 0 C--N 1.401 3.31 0 C-N-CA 121.001 1.134 . . . . 0.0 114.969 -175.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.614 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -53.85 -71.06 0.08 Allowed 'General case' 0 C--N 1.38 1.933 0 CA-C-O 124.524 2.107 . . . . 0.0 106.44 160.201 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.91 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.33 -39.66 81.87 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 109.969 -3.287 . . . . 0.0 108.79 -154.928 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.653 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.5 mt-10 -53.28 -39.3 63.82 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-O 123.177 1.465 . . . . 0.0 108.42 177.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -63.67 -35.29 80.04 Favored 'General case' 0 C--N 1.379 1.885 0 CA-C-N 112.846 -1.979 . . . . 0.0 108.633 -171.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.848 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.4 tp -65.95 -42.7 89.65 Favored 'General case' 0 C--N 1.383 2.056 0 CA-C-O 123.333 1.54 . . . . 0.0 109.186 169.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.76 -34.33 67.47 Favored 'General case' 0 C--N 1.39 2.334 0 CA-C-N 112.287 -2.233 . . . . 0.0 108.378 174.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.578 ' N ' ' O ' ' P' ' 140' ' ' GLU . 2.6 t -73.35 -43.6 60.4 Favored 'General case' 0 C--N 1.387 2.237 0 CA-C-N 114.242 -1.344 . . . . 0.0 110.296 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.99 -47.72 73.59 Favored 'General case' 0 C--N 1.378 1.847 0 CA-C-O 124.895 2.283 . . . . 0.0 107.922 -163.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.985 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.66 -16.83 7.17 Favored 'Isoleucine or valine' 0 C--N 1.385 2.125 0 CA-C-N 110.482 -3.054 . . . . 0.0 107.761 -171.767 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 6.4 mmt180 81.31 37.36 0.08 Allowed 'General case' 0 C--N 1.384 2.095 0 CA-C-N 111.566 -2.561 . . . . 0.0 108.111 152.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.985 HD12 HD11 ' P' ' 146' ' ' ILE . 6.4 mt -95.27 167.99 11.01 Favored 'General case' 0 C--N 1.391 2.391 0 CA-C-N 112.179 -2.282 . . . . 0.0 109.46 168.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.647 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -88.51 144.07 33.15 Favored Pre-proline 0 CA--C 1.588 2.404 0 CA-C-O 122.95 1.357 . . . . 0.0 108.299 173.139 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.409 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 1.8 Cg_endo -60.28 -38.38 75.93 Favored 'Trans proline' 1 C--N 1.414 4.02 0 C-N-CA 122.736 2.291 . . . . 0.0 112.416 -155.436 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 151' ' ' THR . . . . . 0.504 HG22 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -57.05 -29.37 63.35 Favored 'General case' 0 C--N 1.384 2.103 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.203 167.255 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.647 ' N ' ' O ' ' P' ' 149' ' ' THR . 43.9 mt-30 -74.08 -28.36 61.35 Favored 'General case' 0 C--N 1.388 2.28 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.628 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.1 t -64.29 -71.44 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.077 0 CA-C-N 122.074 2.215 . . . . 0.0 109.399 164.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.91 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.36 -59.35 0.45 Allowed 'General case' 0 C--N 1.386 2.154 0 CA-C-O 122.969 1.366 . . . . 0.0 110.853 -177.518 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.504 HG12 HG22 ' P' ' 151' ' ' THR . 0.5 OUTLIER -52.43 -47.19 47.49 Favored 'Isoleucine or valine' 0 C--N 1.389 2.309 0 CA-C-N 112.653 -2.067 . . . . 0.0 108.7 -176.121 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.805 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.2 t90 -66.58 -32.13 73.28 Favored 'General case' 0 C--N 1.382 2.013 0 O-C-N 121.432 -0.792 . . . . 0.0 109.144 177.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.827 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 63.7 m-85 -75.57 -40.04 57.26 Favored 'General case' 0 C--O 1.275 2.419 0 O-C-N 120.962 -1.086 . . . . 0.0 112.275 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -46.91 -66.62 0.38 Allowed 'General case' 0 C--N 1.376 1.737 0 O-C-N 119.44 -2.038 . . . . 0.0 107.171 165.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -56.01 -23.81 35.26 Favored 'General case' 0 C--N 1.391 2.403 0 CA-C-N 113.994 -1.457 . . . . 0.0 109.324 -161.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.557 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.9 OUTLIER -78.87 -40.11 33.38 Favored 'General case' 0 C--O 1.288 3.116 0 CA-C-N 121.249 1.84 . . . . 0.0 111.78 174.377 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.686 ' CD ' ' HE1' ' P' ' 133' ' ' TYR 0.278 40.0 mtm180 -68.49 -25.23 64.87 Favored 'General case' 0 C--O 1.271 2.213 0 CA-C-N 123.588 2.904 . . . . 0.0 110.531 -176.619 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 162' ' ' TYR . . . . . 0.44 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 5.1 t80 -68.3 -44.57 75.15 Favored 'General case' 0 C--N 1.379 1.866 0 CA-C-N 121.893 2.133 . . . . 0.0 109.055 170.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt -65.68 -39.08 90.93 Favored 'General case' 0 C--N 1.381 1.963 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 -167.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.578 ' O ' ' HB3' ' P' ' 167' ' ' ALA . 0.5 OUTLIER -54.41 -59.59 4.48 Favored 'General case' 0 C--N 1.378 1.82 0 CA-C-O 124.857 2.265 . . . . 0.0 106.64 -172.208 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.474 ' HG2' HG23 ' P' ' 164' ' ' THR . 0.3 OUTLIER -58.77 -42.22 88.42 Favored 'General case' 0 C--N 1.385 2.149 0 CA-C-N 108.558 -3.928 . . . . 0.0 108.573 -164.977 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -52.64 -48.71 66.23 Favored 'General case' 0 C--N 1.38 1.906 0 CA-C-N 113.313 -1.767 . . . . 0.0 110.252 176.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.578 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -45.12 -41.56 8.03 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.585 -2.098 . . . . 0.0 108.731 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -80.71 -27.06 37.06 Favored 'General case' 0 C--N 1.388 2.266 0 CA-C-N 111.886 -2.415 . . . . 0.0 110.723 -167.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -51.64 -30.23 20.76 Favored 'General case' 0 C--N 1.389 2.306 0 CA-C-N 113.509 -1.678 . . . . 0.0 109.462 169.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 170' ' ' GLU . . . . . 0.603 ' OE2' ' HE1' ' P' ' 173' ' ' TYR . 5.4 tm-20 -74.21 -34.79 63.81 Favored 'General case' 0 C--N 1.385 2.152 0 CA-C-N 113.376 -1.738 . . . . 0.0 108.142 -163.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -88.6 88.18 7.52 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-N 113.99 -1.459 . . . . 0.0 109.189 -158.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 123.52 -64.86 0.53 Allowed Glycine 0 C--N 1.383 3.139 0 N-CA-C 108.7 -1.76 . . . . 0.0 108.7 -163.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 173' ' ' TYR . . . . . 0.603 ' HE1' ' OE2' ' P' ' 170' ' ' GLU . 26.7 m-85 108.22 149.75 0.0 OUTLIER 'General case' 0 C--N 1.385 2.124 0 CA-C-N 112.753 -1.724 . . . . 0.0 109.07 169.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.44 72.15 5.18 Favored 'General case' 0 C--N 1.387 2.238 0 CA-C-N 111.796 -2.456 . . . . 0.0 109.331 167.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -48.93 115.6 2.77 Favored Glycine 0 C--N 1.379 2.954 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 170.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -70.69 147.64 94.59 Favored Pre-proline 0 CA--C 1.58 2.128 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 171.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo . . . . . 0 CA--C 1.594 3.524 0 C-N-CA 121.463 1.442 . . . . 0.0 111.59 163.704 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . 0.596 ' C4 ' ' C2 ' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.743 0 O5'-C5'-C4' 114.272 2.908 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.731 " C2'" ' H71' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.299 0 O4'-C4'-C3' 108.171 2.571 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.731 ' H71' " C2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.784 0 P-O3'-C3' 122.528 2.357 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.609 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.393 0 P-O3'-C3' 122.84 2.616 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.534 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.556 3.782 1 P-O3'-C3' 125.651 4.96 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.576 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.004 1 P-O3'-C3' 127.536 6.53 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.688 H5'' HD22 ' P' ' 115' ' ' LEU . . . . . . . . 0 C4'--C3' 1.564 3.633 1 O4'-C1'-N19 111.276 4.345 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.82 H2'' " C5'" ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.711 0 O5'-C5'-C4' 114.23 2.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.82 " C5'" H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.517 0 O5'-C5'-C4' 113.898 2.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.611 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.809 1 P-O3'-C3' 126.902 6.002 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.541 H2'' ' C8 ' ' A' ' 12' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.445 0 O4'-C4'-C3' 108.17 2.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . 0.541 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.4 0 P-O3'-C3' 122.501 2.334 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.504 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.633 0 O4'-C4'-C3' 108.418 2.818 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.852 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.71 0 C4'-C3'-C2' 100.964 -2.236 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.852 H5'' H2'' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.838 1 O4'-C1'-N19 111.207 4.259 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.556 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.563 0 P-O3'-C3' 122.195 2.079 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.65 0 O5'-C5'-C4' 115.075 3.482 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.55 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.622 0 O4'-C4'-C3' 108.215 2.615 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.55 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.424 0 P-O3'-C3' 124.28 3.817 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.473 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.412 0 O4'-C4'-C3' 108.09 2.49 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.65 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.57 4.232 0 N19-C1'-C2' 119.12 3.075 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.65 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.557 3.886 0 N19-C1'-C2' 118.692 2.808 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.549 ' N3 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.568 3.976 1 P-O3'-C3' 124.81 4.259 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.549 ' C2 ' ' N3 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.699 0 P-O3'-C3' 123.219 2.932 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.462 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.782 0 P-O3'-C3' 124.375 3.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.479 " C2'" ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.557 3.932 0 N19-C1'-C2' 119.2 3.125 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.603 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.725 0 P-O3'-C3' 122.852 2.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.624 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.338 0 P-O3'-C3' 122.612 2.427 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.624 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.623 0 O4'-C4'-C3' 108.284 2.684 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.599 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.319 0 O4'-C4'-C3' 107.906 2.306 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.599 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.69 0 O4'-C4'-C3' 108.566 2.966 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . 0.596 ' C2 ' ' C4 ' ' A' ' 1' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.543 4.022 1 P-O3'-C3' 125.052 4.46 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.475 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.58 128.5 56.06 Favored 'General case' 0 C--N 1.383 2.025 0 CA-C-N 113.669 -1.605 . . . . 0.0 108.632 173.09 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 170.28 -38.38 0.0 OUTLIER 'General case' 0 C--N 1.388 2.258 0 CA-C-N 113.565 -1.652 . . . . 0.0 107.996 -178.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 104' ' ' GLY . . . . . 0.586 ' O ' HD23 ' P' ' 105' ' ' LEU . . . -91.03 -35.34 7.16 Favored Glycine 0 C--N 1.381 3.065 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 -163.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.586 HD23 ' O ' ' P' ' 104' ' ' GLY . 0.2 OUTLIER -133.03 162.37 58.05 Favored Pre-proline 0 CA--C 1.582 2.193 0 CA-C-N 113.705 -1.248 . . . . 0.0 108.779 -178.551 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.424 ' HD2' ' HB3' ' P' ' 105' ' ' LEU . 0.2 OUTLIER -95.19 76.41 0.15 Allowed 'Trans proline' 0 C--N 1.394 2.946 0 C-N-CA 123.692 2.928 . . . . 0.0 110.273 -160.304 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 29.7 m-20 -65.38 158.39 26.74 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.745 -1.57 . . . . 0.0 109.174 -171.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.88 85.7 7.05 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.701 -1.591 . . . . 0.0 108.178 -172.235 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.621 ' HE3' ' H ' ' P' ' 110' ' ' ARG . 0.1 OUTLIER -68.04 168.92 11.02 Favored 'General case' 0 C--N 1.381 1.972 0 CA-C-N 113.668 -1.606 . . . . 0.0 109.054 177.986 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.621 ' H ' ' HE3' ' P' ' 109' ' ' LYS . 0.3 OUTLIER -124.73 79.06 1.74 Allowed 'General case' 0 C--N 1.382 2.008 0 CA-C-N 113.652 -1.613 . . . . 0.0 108.646 -156.306 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -25.64 89.63 0.0 OUTLIER 'General case' 0 C--N 1.381 1.964 0 C-N-CA 126.456 1.902 . . . . 0.0 110.501 177.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 3.7 mtp-105 -53.79 -173.13 0.0 OUTLIER 'General case' 0 C--N 1.383 2.024 0 CA-C-N 112.684 -2.053 . . . . 0.0 109.447 155.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.866 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.5 OUTLIER -99.53 120.7 40.07 Favored 'General case' 0 C--N 1.382 2.009 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 154.917 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.529 ' O ' HG13 ' P' ' 114' ' ' VAL . 14.4 p -111.06 59.61 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.1 0 CA-C-O 124.911 2.291 . . . . 0.0 107.769 -156.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.866 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.12 139.63 40.02 Favored 'General case' 0 C--N 1.39 2.349 0 CA-C-N 111.106 -2.77 . . . . 0.0 109.923 -155.072 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.518 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.5 OUTLIER -91.4 147.07 23.3 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-N 114.213 -1.358 . . . . 0.0 108.273 178.529 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.16 149.07 51.0 Favored 'General case' 0 C--N 1.383 2.06 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 -175.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.43 ' O ' ' N ' ' P' ' 122' ' ' TYR . 35.4 ttmt -44.85 -36.35 3.23 Favored 'General case' 0 C--N 1.382 1.981 0 CA-C-N 113.165 -1.834 . . . . 0.0 109.219 -178.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.0 -63.78 1.03 Allowed 'General case' 0 C--N 1.382 2.008 0 CA-C-O 124.266 1.984 . . . . 0.0 109.22 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.56 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.0 mt-30 -52.33 -43.17 64.42 Favored 'General case' 0 C--N 1.382 1.989 0 CA-C-N 112.407 -2.179 . . . . 0.0 109.734 177.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.592 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.9 m -54.39 -55.49 28.09 Favored 'General case' 0 C--N 1.381 1.965 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 169.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.672 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.6 OUTLIER -53.04 -47.57 68.28 Favored 'General case' 0 C--N 1.383 2.045 0 CA-C-O 122.622 1.201 . . . . 0.0 110.003 -169.805 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.715 ' HB2' HD11 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -66.52 -38.38 87.08 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 113.864 -1.516 . . . . 0.0 108.004 179.936 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.795 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.1 mt -61.05 -50.56 72.82 Favored 'General case' 0 C--N 1.385 2.12 0 O-C-N 120.169 -1.582 . . . . 0.0 109.544 171.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.546 ' O ' ' N ' ' P' ' 129' ' ' ARG . 13.4 mt-10 -55.14 -44.65 75.29 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 122.756 1.265 . . . . 0.0 109.4 178.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.672 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -49.23 -66.77 0.34 Allowed 'General case' 0 C--N 1.377 1.795 0 CA-C-N 112.08 -2.327 . . . . 0.0 108.405 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.673 ' HB3' HD11 ' P' ' 134' ' ' LEU . 4.0 mmt85 -58.47 -36.01 73.07 Favored 'General case' 0 C--N 1.381 1.97 0 CA-C-N 113.29 -1.777 . . . . 0.0 109.61 -177.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.688 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 11.5 t80 -67.44 -51.81 47.12 Favored 'General case' 0 C--N 1.385 2.141 0 CA-C-N 119.627 1.103 . . . . 0.0 110.266 174.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' P' ' 125' ' ' GLU . 0.2 OUTLIER -62.79 -14.82 49.71 Favored 'General case' 0 C--N 1.379 1.889 0 CA-C-N 112.815 -1.993 . . . . 0.0 108.203 -164.466 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -104.61 -40.09 6.14 Favored 'General case' 0 C--N 1.378 1.846 0 C-N-CA 126.327 1.851 . . . . 0.0 106.966 -171.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.519 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.5 OUTLIER -155.74 98.73 1.95 Allowed 'General case' 0 C--N 1.385 2.145 0 CA-C-N 111.952 -2.385 . . . . 0.0 110.003 -153.2 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 132' ' ' ARG . . . . . 0.5 ' HG2' ' CD2' ' P' ' 133' ' ' TYR . 0.1 OUTLIER -76.53 -6.72 53.06 Favored 'General case' 0 C--N 1.394 2.523 0 CA-C-N 112.133 -2.303 . . . . 0.0 110.985 -162.164 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.515 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 6.0 m-85 -162.68 108.51 1.19 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.0 -156.282 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.673 HD11 ' HB3' ' P' ' 127' ' ' ARG . 15.0 mt -122.44 135.65 54.72 Favored 'General case' 0 C--N 1.4 2.764 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -154.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.23 154.52 25.37 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 169.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.511 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.92 -49.23 94.5 Favored Pre-proline 0 CA--C 1.583 2.249 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.438 -161.144 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.511 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 81.9 Cg_exo -58.7 -29.61 90.0 Favored 'Trans proline' 0 C--N 1.401 3.341 0 N-CA-C 115.016 1.122 . . . . 0.0 115.016 -173.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.591 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -54.89 -70.48 0.1 Allowed 'General case' 0 C--N 1.382 2.006 0 CA-C-O 124.754 2.216 . . . . 0.0 106.31 161.905 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 1.004 ' NH2' ' HG3' ' P' ' 154' ' ' LYS . 2.0 ptt85 -66.85 -40.63 87.98 Favored 'General case' 0 C--N 1.393 2.476 0 CA-C-N 109.97 -3.287 . . . . 0.0 108.684 -155.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.627 ' O ' ' N ' ' P' ' 144' ' ' SER . 3.5 mt-10 -53.57 -41.01 66.09 Favored 'General case' 0 C--N 1.38 1.931 0 O-C-N 120.68 -1.262 . . . . 0.0 108.486 176.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -63.71 -37.89 89.05 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 112.933 -1.939 . . . . 0.0 109.15 -172.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.715 HD11 ' HB2' ' P' ' 123' ' ' GLU . 0.8 OUTLIER -58.1 -45.78 86.65 Favored 'General case' 0 C--N 1.386 2.172 0 CA-C-O 123.136 1.446 . . . . 0.0 109.056 167.278 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.597 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -62.87 -33.18 74.74 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 112.175 -2.284 . . . . 0.0 109.093 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.627 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.6 OUTLIER -73.66 -39.76 64.2 Favored 'General case' 0 C--N 1.384 2.101 0 CA-C-N 114.071 -1.422 . . . . 0.0 109.471 -177.52 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 40.1 mt -66.87 -47.41 71.97 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-O 124.57 2.128 . . . . 0.0 108.491 -166.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.999 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -98.41 -12.74 8.29 Favored 'Isoleucine or valine' 0 C--N 1.389 2.312 0 CA-C-N 110.87 -2.877 . . . . 0.0 107.954 -166.932 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 82.34 35.43 0.07 Allowed 'General case' 0 C--N 1.381 1.959 0 CA-C-O 125.774 2.702 . . . . 0.0 107.788 153.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.999 HD12 HD11 ' P' ' 146' ' ' ILE . 7.7 mt -96.17 170.28 9.37 Favored 'General case' 0 C--N 1.397 2.642 0 CA-C-N 111.54 -2.573 . . . . 0.0 109.42 168.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.618 ' O ' ' N ' ' P' ' 152' ' ' GLN . 19.2 p -92.93 144.65 28.79 Favored Pre-proline 0 CA--C 1.59 2.484 0 CA-C-O 123.168 1.461 . . . . 0.0 108.977 171.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.483 ' HB2' ' NH1' ' P' ' 139' ' ' ARG . 1.2 Cg_endo -58.76 -38.98 86.13 Favored 'Trans proline' 1 C--N 1.416 4.096 0 C-N-CA 122.616 2.211 . . . . 0.0 113.064 -156.093 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -34.89 62.75 Favored 'General case' 0 C--N 1.383 2.048 0 C-N-CA 119.945 -0.702 . . . . 0.0 109.755 167.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.618 ' N ' ' O ' ' P' ' 149' ' ' THR . 46.1 mt-30 -69.89 -27.92 65.2 Favored 'General case' 0 C--N 1.389 2.295 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 -176.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.602 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.4 t -64.39 -72.37 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.122 0 CA-C-N 121.273 1.852 . . . . 0.0 109.629 164.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 1.004 ' HG3' ' NH2' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.26 -55.3 0.51 Allowed 'General case' 0 C--N 1.383 2.065 0 C-N-CA 124.975 1.31 . . . . 0.0 110.536 -176.402 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 11.3 mm -61.49 -40.57 86.87 Favored 'Isoleucine or valine' 0 C--N 1.383 2.041 0 CA-C-N 113.999 -1.455 . . . . 0.0 109.481 -173.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.795 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.3 t90 -67.37 -31.53 71.83 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 121.168 -0.957 . . . . 0.0 109.195 172.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.688 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 30.1 m-85 -75.42 -42.85 52.59 Favored 'General case' 0 C--O 1.274 2.383 0 O-C-N 121.132 -0.98 . . . . 0.0 111.871 175.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -49.27 -60.37 2.87 Favored 'General case' 0 C--N 1.378 1.807 0 O-C-N 119.51 -1.994 . . . . 0.0 107.117 169.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -56.01 -24.99 42.44 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-O 117.677 -1.154 . . . . 0.0 109.494 -166.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.552 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 3.3 t-160 -77.15 -45.45 26.74 Favored 'General case' 0 C--O 1.284 2.88 0 CA-C-N 121.374 1.897 . . . . 0.0 111.479 178.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.734 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -67.55 -39.89 84.95 Favored 'General case' 0 C--O 1.267 1.988 0 CA-C-N 122.586 2.448 . . . . 0.0 109.513 -164.007 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 162' ' ' TYR . . . . . 0.43 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 49.3 t80 -65.12 -35.19 80.35 Favored 'General case' 0 C--N 1.38 1.931 0 O-C-N 120.176 -1.578 . . . . 0.0 108.694 170.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.2 -28.93 69.13 Favored 'General case' 0 C--N 1.381 1.962 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -170.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.734 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -71.65 -56.42 5.87 Favored 'General case' 0 CA--C 1.573 1.844 0 CA-C-O 125.685 2.66 . . . . 0.0 105.844 -166.128 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.407 ' CD ' ' O ' ' P' ' 161' ' ' ARG . 9.5 mtpt -59.13 -45.05 91.94 Favored 'General case' 0 C--N 1.391 2.395 1 CA-C-N 107.772 -4.286 . . . . 0.0 109.157 -169.604 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 -62.1 -36.37 81.52 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-N 112.571 -2.104 . . . . 0.0 109.297 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -47.42 -40.98 19.24 Favored 'General case' 0 C--N 1.385 2.113 0 CA-C-O 123.541 1.639 . . . . 0.0 108.301 176.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -80.97 -24.0 38.37 Favored 'General case' 0 C--N 1.391 2.399 0 CA-C-N 111.609 -2.541 . . . . 0.0 109.96 -166.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -58.7 -28.02 65.39 Favored 'General case' 0 C--N 1.383 2.059 0 CA-C-N 113.591 -1.64 . . . . 0.0 109.494 170.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -73.56 -43.5 59.7 Favored 'General case' 0 C--N 1.386 2.156 0 CA-C-N 113.648 -1.615 . . . . 0.0 108.175 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.36 94.86 8.04 Favored 'General case' 0 C--N 1.38 1.924 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.273 -161.455 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 127.67 -62.22 0.63 Allowed Glycine 0 C--N 1.382 3.108 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 -164.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 117.61 165.65 0.0 OUTLIER 'General case' 0 C--N 1.381 1.959 0 CA-C-N 113.009 -1.596 . . . . 0.0 109.013 163.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -83.26 69.48 9.96 Favored 'General case' 0 C--N 1.381 1.978 0 CA-C-N 112.195 -2.275 . . . . 0.0 108.821 174.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -126.48 106.4 0.84 Allowed Glycine 0 C--N 1.383 3.185 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 161.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -158.96 124.01 2.26 Favored Pre-proline 0 CA--C 1.58 2.125 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo . . . . . 0 CA--C 1.594 3.5 0 C-N-CA 121.482 1.454 . . . . 0.0 111.61 173.443 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.844 0 O5'-C5'-C4' 114.357 2.969 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.634 ' O6 ' ' N4 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.369 1 P-O3'-C3' 127.127 6.189 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.519 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.886 0 P-O3'-C3' 123.115 2.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.626 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 P-O3'-C3' 123.565 3.221 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.551 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.905 1 P-O3'-C3' 125.592 4.91 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.551 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.567 3.894 1 P-O3'-C3' 126.348 5.54 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 1.047 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 C3'-C2'-C1' 106.731 2.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 1.047 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.566 0 O5'-C5'-C4' 113.785 2.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.56 ' C5 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.537 0 O5'-C5'-C4' 113.906 2.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.56 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.781 0 P-O3'-C3' 124.017 3.597 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.521 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.561 3.348 0 P-O3'-C3' 122.718 2.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.411 0 P-O3'-C3' 123.742 3.368 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.502 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.583 0 O4'-C4'-C3' 108.4 2.8 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.502 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.595 0 C4'-C3'-C2' 100.817 -2.383 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.828 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.861 1 O4'-C1'-N19 111.327 4.409 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.828 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.544 0 P-O3'-C3' 122.173 2.061 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.764 0 O5'-C5'-C4' 115.069 3.478 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.589 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.658 1 P-O3'-C3' 125.459 4.799 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.589 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.607 0 P-O3'-C3' 122.685 2.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.31 0 O4'-C4'-C3' 108.063 2.463 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.528 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.571 4.336 0 N19-C1'-C2' 119.243 3.152 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.528 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.561 4.319 1 P-O3'-C3' 126.688 5.823 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.628 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.437 1 P-O3'-C3' 127.137 6.197 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.628 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.449 0 O4'-C4'-C3' 108.559 2.959 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.593 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.237 0 C2'-C3'-O3' 117.057 2.392 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.576 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.242 0 P-O3'-C3' 124.08 3.65 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.606 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.645 0 P-O3'-C3' 124.295 3.829 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.61 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.595 0 C4'-C3'-C2' 100.539 -2.661 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.626 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.653 1 P-O3'-C3' 124.578 4.065 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.588 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.361 0 O4'-C4'-C3' 108.161 2.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.634 ' N4 ' ' O6 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.68 0 P-O3'-C3' 123.549 3.208 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.968 0 O4'-C1'-N19 109.321 1.901 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.528 3.463 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 4.6 m -161.54 164.36 29.58 Favored 'General case' 0 C--N 1.382 1.986 0 CA-C-N 113.677 -1.601 . . . . 0.0 108.617 -170.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 170.38 -38.33 0.0 OUTLIER 'General case' 0 C--N 1.389 2.288 0 CA-C-N 113.498 -1.683 . . . . 0.0 107.949 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -176.96 127.58 1.23 Allowed Glycine 0 C--N 1.381 3.067 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 -163.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.506 HD23 ' HD2' ' P' ' 106' ' ' PRO . 0.2 OUTLIER -139.72 170.8 9.06 Favored Pre-proline 0 CA--C 1.582 2.19 0 CA-C-N 113.751 -1.224 . . . . 0.0 108.804 -171.98 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.506 ' HD2' HD23 ' P' ' 105' ' ' LEU . 0.2 OUTLIER -94.73 75.76 0.19 Allowed 'Trans proline' 0 C--N 1.395 2.974 0 C-N-CA 123.871 3.047 . . . . 0.0 110.239 -166.099 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 56.34 -164.17 0.15 Allowed 'General case' 0 C--N 1.382 1.982 0 CA-C-N 113.713 -1.585 . . . . 0.0 109.141 -170.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 108' ' ' LYS . . . . . 0.642 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -133.08 -68.37 0.59 Allowed 'General case' 0 C--N 1.382 1.986 0 CA-C-N 113.696 -1.593 . . . . 0.0 108.107 176.056 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.701 ' HE3' ' CA ' ' P' ' 109' ' ' LYS . 0.0 OUTLIER -72.9 162.46 29.46 Favored 'General case' 0 C--N 1.382 1.984 0 CA-C-N 113.576 -1.647 . . . . 0.0 109.269 175.627 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.642 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 2.1 mmt-85 -125.08 83.26 2.14 Favored 'General case' 0 C--N 1.383 2.052 0 CA-C-N 113.645 -1.616 . . . . 0.0 108.912 -157.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.513 ' HD3' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -27.68 92.43 0.01 OUTLIER 'General case' 0 C--N 1.381 1.942 0 CA-C-N 113.15 -1.841 . . . . 0.0 109.975 172.949 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 23.7 mtt-85 -61.25 -173.11 0.03 OUTLIER 'General case' 0 C--N 1.388 2.264 0 CA-C-N 112.0 -2.364 . . . . 0.0 108.889 155.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.884 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.5 OUTLIER -93.94 120.38 34.11 Favored 'General case' 0 C--N 1.383 2.058 0 CA-C-N 113.986 -1.461 . . . . 0.0 107.217 156.21 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.443 HG13 ' OP1' ' A' ' 8' ' ' ' DA' . 8.4 p -113.3 61.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.111 0 CA-C-O 124.937 2.303 . . . . 0.0 107.668 -157.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.884 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.06 142.18 39.95 Favored 'General case' 0 C--N 1.388 2.281 0 CA-C-N 111.129 -2.759 . . . . 0.0 110.056 -154.452 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.585 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.7 OUTLIER -93.19 146.21 23.85 Favored 'General case' 0 C--N 1.381 1.967 0 CA-C-N 113.404 -1.725 . . . . 0.0 108.447 178.214 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.84 148.58 50.99 Favored 'General case' 0 C--N 1.384 2.105 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 -174.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.405 ' O ' ' N ' ' P' ' 122' ' ' TYR . 22.9 ttmt -44.9 -36.72 3.47 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-N 113.134 -1.848 . . . . 0.0 109.17 -177.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 119' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' P' ' 122' ' ' TYR . . . -53.35 -62.06 1.89 Allowed 'General case' 0 C--N 1.383 2.046 0 CA-C-O 124.242 1.973 . . . . 0.0 109.242 174.57 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 82.0 mt-30 -54.48 -45.55 73.24 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 112.538 -2.119 . . . . 0.0 109.872 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.58 ' HA ' HD12 ' P' ' 124' ' ' LEU . 10.7 m -49.74 -56.68 9.35 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 168.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.722 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.4 OUTLIER -52.94 -48.27 67.47 Favored 'General case' 0 C--N 1.382 2.01 0 CA-C-O 122.609 1.195 . . . . 0.0 110.052 -168.985 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.705 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.75 -37.1 83.96 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.113 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.755 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.9 mt -60.52 -51.86 67.66 Favored 'General case' 0 C--N 1.384 2.086 0 O-C-N 120.281 -1.512 . . . . 0.0 109.493 170.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' P' ' 129' ' ' ARG . 10.2 mt-10 -55.35 -48.97 73.44 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-O 122.686 1.231 . . . . 0.0 109.598 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.722 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.92 -67.52 0.25 Allowed 'General case' 0 C--N 1.378 1.814 0 CA-C-N 112.191 -2.277 . . . . 0.0 109.14 174.954 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.575 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.5 OUTLIER -60.33 -37.87 81.98 Favored 'General case' 0 C--N 1.39 2.37 0 CA-C-N 112.388 -2.187 . . . . 0.0 108.191 -171.345 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.807 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 15.7 t80 -69.94 -47.59 61.74 Favored 'General case' 0 C--N 1.381 1.976 0 O-C-N 121.409 -0.807 . . . . 0.0 110.183 177.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.552 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 4.6 mmm180 -62.35 -20.04 63.98 Favored 'General case' 0 C--N 1.38 1.927 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -168.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -91.58 -42.55 10.16 Favored 'General case' 0 C--N 1.379 1.85 0 CA-C-O 124.126 1.917 . . . . 0.0 106.935 -174.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.438 ' HG2' ' CD2' ' P' ' 134' ' ' LEU . 2.6 tp-100 -152.81 123.87 7.5 Favored 'General case' 0 C--N 1.386 2.169 0 CA-C-N 111.422 -2.626 . . . . 0.0 110.313 -155.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 132' ' ' ARG . . . . . 0.526 ' HG2' ' CG ' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -79.29 -23.83 43.31 Favored 'General case' 0 C--N 1.386 2.166 0 CA-C-N 112.784 -2.007 . . . . 0.0 110.8 -173.172 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.657 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 1.0 OUTLIER -155.22 112.21 3.28 Favored 'General case' 0 C--N 1.377 1.798 0 CA-C-O 123.472 1.606 . . . . 0.0 108.986 -152.987 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.613 HD22 ' HG3' ' P' ' 138' ' ' GLU . 27.3 mt -123.22 134.79 54.1 Favored 'General case' 0 C--N 1.405 3.011 0 CA-C-N 112.598 -2.092 . . . . 0.0 108.042 -160.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.08 155.24 26.39 Favored 'General case' 0 C--N 1.382 1.988 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 167.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.537 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.46 -49.42 92.44 Favored Pre-proline 0 CA--C 1.583 2.244 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.233 -160.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.537 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 76.7 Cg_exo -58.63 -29.23 88.6 Favored 'Trans proline' 0 C--N 1.401 3.332 0 C-N-CA 121.057 1.171 . . . . 0.0 115.041 -175.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.613 ' HG3' HD22 ' P' ' 134' ' ' LEU . 2.4 mm-40 -54.02 -70.43 0.1 Allowed 'General case' 0 C--N 1.38 1.896 0 CA-C-O 124.624 2.154 . . . . 0.0 106.456 160.022 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.875 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.18 -39.15 82.6 Favored 'General case' 0 C--N 1.39 2.368 0 CA-C-N 109.907 -3.315 . . . . 0.0 108.75 -154.592 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.62 ' O ' ' N ' ' P' ' 144' ' ' SER . 5.1 mt-10 -53.36 -39.02 63.83 Favored 'General case' 0 C--N 1.38 1.91 0 CA-C-O 122.61 1.195 . . . . 0.0 108.505 177.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -63.54 -37.13 86.13 Favored 'General case' 0 C--N 1.379 1.879 0 CA-C-N 113.016 -1.902 . . . . 0.0 109.322 -173.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.635 ' CD1' HD13 ' P' ' 146' ' ' ILE . 0.7 OUTLIER -58.7 -46.12 87.98 Favored 'General case' 0 C--N 1.387 2.201 0 CA-C-O 122.974 1.368 . . . . 0.0 108.87 166.287 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.38 -31.71 72.93 Favored 'General case' 0 C--N 1.385 2.139 0 CA-C-N 112.339 -2.21 . . . . 0.0 109.217 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.62 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.9 OUTLIER -74.25 -41.56 61.08 Favored 'General case' 0 C--N 1.384 2.08 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.666 179.552 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 145' ' ' LEU . . . . . 0.561 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 43.5 mt -65.13 -48.44 73.57 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-O 124.906 2.289 . . . . 0.0 108.039 -165.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.991 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.51 -16.94 7.02 Favored 'Isoleucine or valine' 0 C--N 1.386 2.153 0 CA-C-N 110.316 -3.129 . . . . 0.0 107.739 -170.828 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 147' ' ' ARG . . . . . 0.599 ' HG3' ' O ' ' P' ' 144' ' ' SER . 0.1 OUTLIER 81.21 37.71 0.08 Allowed 'General case' 0 C--N 1.386 2.188 0 CA-C-N 111.375 -2.648 . . . . 0.0 108.055 153.008 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.991 HD12 HD11 ' P' ' 146' ' ' ILE . 5.7 mt -95.03 168.5 10.74 Favored 'General case' 0 C--N 1.39 2.354 0 CA-C-N 112.224 -2.262 . . . . 0.0 109.294 168.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.65 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.9 p -88.6 143.03 31.44 Favored Pre-proline 0 CA--C 1.588 2.415 0 CA-C-O 122.854 1.311 . . . . 0.0 108.01 173.128 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -60.19 -37.41 83.47 Favored 'Trans proline' 0 C--N 1.413 3.953 0 C-N-CA 122.652 2.235 . . . . 0.0 112.054 -155.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.35 -29.06 65.67 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.67 167.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.65 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.9 mt-30 -73.52 -28.33 61.83 Favored 'General case' 0 C--N 1.39 2.333 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.613 HG13 ' CD2' ' P' ' 157' ' ' PHE . 1.2 t -64.48 -71.14 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.077 0 CA-C-N 121.901 2.137 . . . . 0.0 109.597 165.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.875 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.95 -57.98 0.45 Allowed 'General case' 0 C--N 1.385 2.139 0 C-N-CA 124.762 1.225 . . . . 0.0 110.531 -176.916 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.58 HD12 ' OE1' ' P' ' 158' ' ' GLN . 0.2 OUTLIER -58.59 -42.39 84.63 Favored 'Isoleucine or valine' 0 C--N 1.383 2.057 0 CA-C-N 113.389 -1.732 . . . . 0.0 108.994 -172.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.755 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.4 t90 -66.68 -32.23 73.42 Favored 'General case' 0 C--N 1.385 2.11 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.807 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 49.0 m-85 -74.35 -40.56 62.06 Favored 'General case' 0 C--O 1.272 2.261 0 O-C-N 121.072 -1.018 . . . . 0.0 111.998 173.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.58 ' OE1' HD12 ' P' ' 155' ' ' ILE . 73.2 mt-30 -50.97 -59.32 4.27 Favored 'General case' 0 C--N 1.378 1.813 0 O-C-N 119.664 -1.898 . . . . 0.0 106.77 169.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -56.04 -25.01 43.02 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.923 -166.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.559 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.0 t-160 -77.39 -47.58 19.47 Favored 'General case' 0 C--O 1.281 2.736 0 CA-C-N 121.714 2.052 . . . . 0.0 111.327 175.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.657 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -67.89 -34.14 76.07 Favored 'General case' 0 C--O 1.266 1.957 0 CA-C-N 122.985 2.63 . . . . 0.0 110.762 -160.694 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 162' ' ' TYR . . . . . 0.508 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 14.2 t80 -69.0 -35.9 77.21 Favored 'General case' 0 C--N 1.38 1.928 0 O-C-N 119.967 -1.708 . . . . 0.0 109.51 171.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 4.0 mmmt -65.16 -42.87 93.3 Favored 'General case' 0 C--N 1.382 2.0 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -169.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.599 ' O ' ' HB3' ' P' ' 167' ' ' ALA . 0.5 OUTLIER -54.2 -60.59 3.14 Favored 'General case' 0 CA--C 1.573 1.831 0 CA-C-O 124.733 2.206 . . . . 0.0 106.472 -170.633 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.489 ' HG2' HG23 ' P' ' 164' ' ' THR . 8.6 mmmt -59.33 -45.0 92.56 Favored 'General case' 0 C--N 1.386 2.156 1 CA-C-N 108.221 -4.081 . . . . 0.0 108.81 -163.67 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 166' ' ' ARG . . . . . 0.465 ' NH1' ' HA ' ' P' ' 167' ' ' ALA . 0.0 OUTLIER -61.29 -37.19 82.29 Favored 'General case' 0 C--N 1.383 2.022 0 CA-C-N 112.289 -2.232 . . . . 0.0 108.596 -175.73 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -50.81 -41.19 57.08 Favored 'General case' 0 C--N 1.386 2.196 0 CA-C-N 113.581 -1.645 . . . . 0.0 108.862 177.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -81.82 -21.53 37.6 Favored 'General case' 0 C--N 1.388 2.278 0 CA-C-N 111.715 -2.493 . . . . 0.0 110.297 -168.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.94 -31.19 66.6 Favored 'General case' 0 C--N 1.386 2.169 0 CA-C-N 113.931 -1.486 . . . . 0.0 109.533 169.008 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -68.52 -33.53 74.29 Favored 'General case' 0 C--N 1.387 2.225 0 CA-C-N 112.874 -1.966 . . . . 0.0 108.235 -167.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 49.1 mttp -91.92 88.03 6.45 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-N 113.992 -1.458 . . . . 0.0 109.257 -155.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 132.29 -61.76 0.65 Allowed Glycine 0 C--N 1.383 3.145 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 -157.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 20.8 m-30 120.64 166.97 0.0 OUTLIER 'General case' 0 C--N 1.382 1.982 0 CA-C-N 113.092 -1.554 . . . . 0.0 108.883 160.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.03 54.32 2.89 Favored 'General case' 0 C--N 1.387 2.197 0 CA-C-N 112.162 -2.29 . . . . 0.0 109.472 175.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -64.44 100.45 0.42 Allowed Glycine 0 C--N 1.38 2.996 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 -160.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -173.54 138.65 0.77 Allowed Pre-proline 0 CA--C 1.581 2.155 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 -171.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo . . . . . 0 CA--C 1.593 3.443 0 C-N-CA 121.507 1.471 . . . . 0.0 111.631 176.924 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.77 0 O5'-C5'-C4' 114.35 2.965 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.65 ' N1 ' ' N3 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.322 1 P-O3'-C3' 126.845 5.955 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.528 ' H71' H2'' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.858 0 P-O3'-C3' 123.008 2.757 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.615 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.387 0 P-O3'-C3' 123.716 3.347 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.545 ' C2 ' ' C2 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.746 0 P-O3'-C3' 122.981 2.734 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.555 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.998 0 N19-C1'-C2' 119.406 3.254 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.665 H5'' HD22 ' P' ' 115' ' ' LEU . . . . . . . . 0 C4'--C3' 1.562 3.391 0 O4'-C1'-N19 110.631 3.539 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.816 H2'' H5'' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.398 0 C4'-C3'-C2' 100.272 -2.928 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.816 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.561 3.337 0 P-O3'-C3' 122.962 2.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.601 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.822 0 P-O3'-C3' 123.016 2.763 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.504 H2'' ' C8 ' ' A' ' 12' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.456 0 P-O3'-C3' 122.877 2.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . 0.504 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.561 3.308 0 P-O3'-C3' 122.513 2.344 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.5 " H2'" ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.596 0 P-O3'-C3' 122.693 2.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.93 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.61 0 P-O3'-C3' 123.49 3.158 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.93 H5'' H2'' ' A' ' 14' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.544 4.073 0 O4'-C1'-N19 110.985 3.981 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.861 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.6 0 P-O3'-C3' 124.209 3.757 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.782 0 O5'-C5'-C4' 115.056 3.468 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.6 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.565 1 P-O3'-C3' 125.941 5.201 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.6 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.314 0 P-O3'-C3' 124.094 3.662 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.42 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.296 0 O4'-C4'-C3' 108.116 2.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.547 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.571 4.341 0 N19-C1'-C2' 119.245 3.153 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.547 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.558 4.016 1 P-O3'-C3' 124.52 4.017 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.546 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.747 0 O4'-C1'-N19 110.053 2.817 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.546 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.721 0 P-O3'-C3' 123.767 3.389 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.518 " H5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.805 0 O4'-C4'-C3' 107.897 2.297 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.534 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.559 4.052 0 N19-C1'-C2' 118.689 2.805 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.606 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.553 3.508 1 P-O3'-C3' 127.373 6.394 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.609 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.553 0 C4'-C3'-C2' 100.354 -2.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.615 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.568 1 P-O3'-C3' 124.52 4.017 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.59 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.401 0 O4'-C4'-C3' 107.984 2.384 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.65 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.586 0 O4'-C4'-C3' 108.367 2.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.886 0 O4'-C1'-N19 109.371 1.964 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.481 0 N-CA-C 107.807 -1.182 . . . . 0.0 107.807 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.42 162.26 13.38 Favored 'General case' 0 C--N 1.382 1.989 0 CA-C-N 113.709 -1.587 . . . . 0.0 108.67 -164.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 170.19 -38.39 0.0 OUTLIER 'General case' 0 C--N 1.388 2.282 0 CA-C-N 113.538 -1.665 . . . . 0.0 108.02 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -129.18 -71.69 0.13 Allowed Glycine 0 C--N 1.382 3.093 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 -167.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.44 ' HB3' ' HD2' ' P' ' 106' ' ' PRO . 1.2 mp -149.13 178.14 1.57 Allowed Pre-proline 0 CA--C 1.583 2.233 0 CA-C-N 113.699 -1.25 . . . . 0.0 108.871 155.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.44 ' HD2' ' HB3' ' P' ' 105' ' ' LEU . 0.8 OUTLIER -50.48 93.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.396 3.032 0 C-N-CA 123.92 3.08 . . . . 0.0 110.552 162.732 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -98.6 139.1 34.82 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-O 122.368 1.08 . . . . 0.0 109.138 155.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 108' ' ' LYS . . . . . 0.47 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.3 OUTLIER -136.06 35.99 2.81 Favored 'General case' 0 C--N 1.382 1.979 0 CA-C-N 113.781 -1.554 . . . . 0.0 108.221 173.307 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.708 ' HE3' ' H ' ' P' ' 112' ' ' ARG . 0.0 OUTLIER -59.4 153.74 18.45 Favored 'General case' 0 C--N 1.38 1.926 0 CA-C-N 113.75 -1.568 . . . . 0.0 109.567 171.615 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.583 ' HD3' ' O ' ' P' ' 109' ' ' LYS . 2.1 mmt85 -143.32 54.46 1.35 Allowed 'General case' 0 C--N 1.384 2.104 0 CA-C-N 113.605 -1.634 . . . . 0.0 109.519 -170.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.696 ' HD2' " O3'" ' A' ' 8' ' ' ' DA' . 1.6 ttpp 47.99 91.04 0.02 OUTLIER 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.712 -1.586 . . . . 0.0 109.002 -174.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 112' ' ' ARG . . . . . 0.708 ' H ' ' HE3' ' P' ' 109' ' ' LYS . 2.0 mtp-105 -59.63 -169.61 0.01 OUTLIER 'General case' 0 C--N 1.382 2.012 0 CA-C-N 113.388 -1.733 . . . . 0.0 108.744 155.107 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.875 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.3 OUTLIER -98.38 119.08 36.46 Favored 'General case' 0 C--N 1.382 2.019 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 154.958 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.465 ' O ' HG13 ' P' ' 114' ' ' VAL . 12.9 p -111.63 59.71 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.13 0 CA-C-O 124.991 2.329 . . . . 0.0 107.651 -156.157 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.875 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.25 139.99 39.98 Favored 'General case' 0 C--N 1.39 2.344 0 CA-C-N 110.962 -2.835 . . . . 0.0 109.832 -155.043 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.618 ' CD1' HD22 ' P' ' 148' ' ' LEU . 0.4 OUTLIER -91.11 148.11 22.6 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.268 178.087 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.45 149.48 50.17 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -175.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.417 ' O ' ' N ' ' P' ' 122' ' ' TYR . 31.8 ttmt -44.94 -36.06 3.18 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.538 -1.665 . . . . 0.0 109.252 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -52.88 -62.73 1.46 Allowed 'General case' 0 C--N 1.383 2.033 0 CA-C-O 124.305 2.003 . . . . 0.0 109.128 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.554 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.4 mt-30 -54.85 -43.99 73.57 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-N 112.42 -2.173 . . . . 0.0 109.709 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.554 ' HA ' HD12 ' P' ' 124' ' ' LEU . 9.8 m -51.18 -57.68 8.12 Favored 'General case' 0 C--N 1.385 2.129 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 166.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.717 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.7 OUTLIER -53.04 -48.15 67.86 Favored 'General case' 0 C--N 1.382 2.021 0 CA-C-O 122.487 1.136 . . . . 0.0 110.051 -168.5 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.749 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.5 OUTLIER -66.33 -37.85 86.31 Favored 'General case' 0 C--N 1.378 1.834 0 CA-C-N 114.562 -1.199 . . . . 0.0 107.878 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.792 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.6 mt -60.46 -50.82 72.07 Favored 'General case' 0 C--N 1.384 2.084 0 O-C-N 120.536 -1.352 . . . . 0.0 109.615 171.505 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' P' ' 129' ' ' ARG . 20.0 mt-10 -54.39 -52.76 60.66 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-O 122.384 1.088 . . . . 0.0 109.21 177.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.717 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.98 -67.78 0.22 Allowed 'General case' 0 C--N 1.378 1.818 0 CA-C-N 111.872 -2.422 . . . . 0.0 108.754 177.378 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.413 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.3 OUTLIER -59.21 -36.81 76.05 Favored 'General case' 0 C--N 1.397 2.634 0 CA-C-N 112.032 -2.349 . . . . 0.0 108.373 -172.478 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.85 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 12.6 t80 -69.21 -48.85 60.91 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-N 119.1 0.864 . . . . 0.0 109.679 178.127 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' P' ' 125' ' ' GLU . 27.3 mtm180 -62.96 -15.96 57.71 Favored 'General case' 0 C--N 1.38 1.931 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -166.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -101.66 -39.86 7.26 Favored 'General case' 0 C--N 1.379 1.862 0 C-N-CA 126.669 1.988 . . . . 0.0 107.374 -170.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.492 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.1 OUTLIER -153.2 104.49 2.8 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 111.723 -2.489 . . . . 0.0 108.64 -153.963 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 132' ' ' ARG . . . . . 0.492 ' HB3' ' CD2' ' P' ' 133' ' ' TYR . 3.2 mtt85 -74.48 -15.79 60.87 Favored 'General case' 0 C--N 1.391 2.41 0 CA-C-N 112.197 -2.274 . . . . 0.0 110.721 -166.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.492 ' CD2' ' HB3' ' P' ' 132' ' ' ARG . 66.8 m-85 -160.16 112.14 2.0 Favored 'General case' 0 C--N 1.378 1.835 0 CA-C-N 113.842 -1.526 . . . . 0.0 108.289 -153.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.559 HD22 ' HB3' ' P' ' 138' ' ' GLU . 19.1 mt -129.45 133.33 47.25 Favored 'General case' 0 C--N 1.396 2.595 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.028 -155.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . 0.338 1.3 t -92.6 166.57 12.43 Favored 'General case' 0 C--N 1.394 2.533 0 CA-C-N 122.103 2.229 . . . . 0.0 107.372 174.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.536 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.75 -46.47 98.45 Favored Pre-proline 0 CA--C 1.582 2.188 0 CA-C-N 113.573 -1.648 . . . . 0.0 108.684 -155.004 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 0.1 OUTLIER -53.64 -46.49 33.34 Favored 'Trans proline' 0 C--N 1.395 2.982 0 N-CA-C 116.73 1.781 . . . . 0.0 116.73 177.413 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.559 ' HB3' HD22 ' P' ' 134' ' ' LEU . 1.6 mm-40 -51.86 -65.68 0.52 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 123.726 1.727 . . . . 0.0 106.813 170.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.946 ' NH2' ' HG3' ' P' ' 154' ' ' LYS . 1.7 ptt180 -69.62 -32.18 70.74 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 109.942 -3.299 . . . . 0.0 108.718 -160.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.628 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 2.4 mt-10 -52.81 -47.02 67.93 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 122.987 1.375 . . . . 0.0 108.131 170.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -64.78 -37.85 89.01 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-N 112.416 -2.175 . . . . 0.0 109.608 -166.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.493 HD13 HD13 ' P' ' 146' ' ' ILE . 1.3 tm? -59.29 -44.5 92.51 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-O 123.169 1.461 . . . . 0.0 108.913 169.308 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.628 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.89 -34.27 77.58 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-N 112.037 -2.347 . . . . 0.0 109.095 177.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.581 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -72.5 -37.69 68.33 Favored 'General case' 0 C--N 1.388 2.243 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.451 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 45.7 mt -67.25 -52.48 40.35 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 124.777 2.227 . . . . 0.0 108.337 -167.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.973 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -91.61 -16.6 7.94 Favored 'Isoleucine or valine' 0 C--N 1.386 2.194 0 CA-C-N 110.498 -3.046 . . . . 0.0 107.959 -172.831 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 147' ' ' ARG . . . . . 0.516 ' HD3' ' O ' ' P' ' 144' ' ' SER . 3.2 mmt-85 81.3 38.54 0.07 Allowed 'General case' 0 C--N 1.385 2.144 0 CA-C-N 111.464 -2.607 . . . . 0.0 107.822 153.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.973 HD12 HD11 ' P' ' 146' ' ' ILE . 5.8 mt -94.19 171.79 8.62 Favored 'General case' 0 C--N 1.39 2.335 0 CA-C-N 112.023 -2.353 . . . . 0.0 109.055 166.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.64 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.4 p -89.99 139.86 27.49 Favored Pre-proline 0 CA--C 1.588 2.432 0 CA-C-O 123.148 1.451 . . . . 0.0 108.061 171.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.43 ' HB3' HH11 ' P' ' 139' ' ' ARG . 0.6 OUTLIER -46.34 -48.6 13.05 Favored 'Trans proline' 0 C--N 1.406 3.566 0 C-N-CA 124.935 3.757 . . . . 0.0 115.286 -165.436 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.41 -29.61 35.88 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 118.347 -0.835 . . . . 0.0 110.06 169.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.64 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -74.85 -27.67 60.36 Favored 'General case' 0 C--N 1.39 2.347 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.802 HG13 ' CD2' ' P' ' 157' ' ' PHE . 1.5 t -64.69 -72.86 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.382 2.007 0 CA-C-N 122.069 2.213 . . . . 0.0 109.883 162.322 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.946 ' HG3' ' NH2' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.47 -54.93 0.54 Allowed 'General case' 0 C--N 1.386 2.154 0 C-N-CA 124.896 1.278 . . . . 0.0 110.409 -175.504 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 16.5 mm -60.98 -41.7 90.12 Favored 'Isoleucine or valine' 0 C--N 1.387 2.199 0 CA-C-N 114.072 -1.422 . . . . 0.0 109.498 -174.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.792 ' HB3' HD22 ' P' ' 124' ' ' LEU . 7.7 t90 -66.81 -32.08 73.12 Favored 'General case' 0 C--N 1.382 2.0 0 O-C-N 121.228 -0.92 . . . . 0.0 109.076 172.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.85 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 52.2 m-85 -74.9 -42.2 58.24 Favored 'General case' 0 C--O 1.276 2.463 0 O-C-N 121.376 -0.827 . . . . 0.0 111.815 176.073 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.436 ' N ' ' O ' ' P' ' 154' ' ' LYS . 60.5 mt-30 -50.57 -60.25 3.22 Favored 'General case' 0 C--N 1.377 1.778 0 O-C-N 119.571 -1.956 . . . . 0.0 107.28 169.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -56.25 -23.42 36.0 Favored 'General case' 0 C--N 1.391 2.374 0 CA-C-O 117.358 -1.306 . . . . 0.0 109.629 -166.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.564 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 1.2 t-160 -75.28 -50.64 15.43 Favored 'General case' 0 C--O 1.281 2.744 0 CA-C-N 121.307 1.867 . . . . 0.0 110.128 175.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.629 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -66.67 -35.84 81.13 Favored 'General case' 0 C--O 1.267 2.018 0 CA-C-N 122.538 2.427 . . . . 0.0 110.732 -158.373 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 162' ' ' TYR . . . . . 0.438 ' CZ ' ' HG3' ' P' ' 166' ' ' ARG . 9.3 t80 -69.03 -38.37 79.13 Favored 'General case' 0 C--N 1.38 1.92 0 O-C-N 119.973 -1.704 . . . . 0.0 109.252 172.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.41 -38.23 90.31 Favored 'General case' 0 C--N 1.382 1.996 0 O-C-N 121.345 -0.847 . . . . 0.0 109.136 -168.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.629 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.6 OUTLIER -52.81 -60.32 3.41 Favored 'General case' 0 C--N 1.38 1.897 0 CA-C-O 125.47 2.557 . . . . 0.0 106.504 -174.208 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.419 ' HA ' ' HE3' ' P' ' 165' ' ' LYS . 0.3 OUTLIER -58.32 -43.07 88.05 Favored 'General case' 0 C--N 1.388 2.246 1 CA-C-N 108.33 -4.032 . . . . 0.0 108.065 -163.591 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' P' P ' 166' ' ' ARG . . . . . 0.438 ' HG3' ' CZ ' ' P' ' 162' ' ' TYR . 1.2 ttt180 -54.05 -45.91 71.8 Favored 'General case' 0 C--N 1.379 1.882 0 CA-C-N 113.051 -1.886 . . . . 0.0 110.146 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.67 -34.08 72.39 Favored 'General case' 0 C--N 1.385 2.126 0 CA-C-N 112.727 -2.033 . . . . 0.0 108.662 -175.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.04 -23.35 41.49 Favored 'General case' 0 C--N 1.388 2.263 0 CA-C-N 111.847 -2.433 . . . . 0.0 109.498 -174.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -56.35 -32.44 64.71 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-O 122.796 1.284 . . . . 0.0 109.749 168.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -66.96 -34.96 78.91 Favored 'General case' 0 C--N 1.386 2.179 0 CA-C-N 113.031 -1.895 . . . . 0.0 108.057 -166.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.02 86.81 5.95 Favored 'General case' 0 C--N 1.38 1.93 0 CA-C-N 113.824 -1.535 . . . . 0.0 109.32 -159.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 132.65 -60.45 0.67 Allowed Glycine 0 C--N 1.382 3.088 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 -157.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 102.2 147.62 0.01 OUTLIER 'General case' 0 C--N 1.388 2.272 0 CA-C-N 112.553 -1.824 . . . . 0.0 108.499 173.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -162.76 174.14 12.89 Favored 'General case' 0 C--N 1.393 2.486 0 CA-C-N 112.983 -1.917 . . . . 0.0 107.438 156.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 171.41 174.29 38.99 Favored Glycine 0 C--N 1.379 2.95 0 CA-C-O 122.971 1.317 . . . . 0.0 110.049 166.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -146.82 129.32 7.79 Favored Pre-proline 0 CA--C 1.58 2.125 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 155.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo . . . . . 0 CA--C 1.594 3.49 0 C-N-CA 121.58 1.52 . . . . 0.0 111.62 -161.958 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.831 0 O5'-C5'-C4' 114.346 2.961 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.803 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.562 3.387 0 O4'-C4'-C3' 108.176 2.576 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.803 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.843 0 P-O3'-C3' 122.684 2.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.624 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.578 0 C4'-C3'-C2' 100.437 -2.763 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.552 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.568 3.957 1 P-O3'-C3' 125.391 4.742 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.536 ' C6 ' H2'' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.824 1 P-O3'-C3' 124.732 4.193 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.869 H2'' " H5'" ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.56 0 C3'-C2'-C1' 106.788 2.92 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.869 " H5'" H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.542 3.916 0 O5'-C5'-C4' 115.32 3.657 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.834 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.502 1 P-O3'-C3' 128.17 7.058 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.605 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.827 1 P-O3'-C3' 127.927 6.856 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.574 ' C6 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.407 0 O4'-C4'-C3' 108.15 2.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . 0.459 H2'' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.434 0 P-O3'-C3' 122.709 2.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.545 " H2'" ' H71' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.558 0 O4'-C4'-C3' 108.448 2.848 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.69 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.529 0 O4'-C4'-C3' 108.24 2.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.734 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.541 3.728 1 O4'-C1'-N19 111.304 4.379 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.734 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.588 0 P-O3'-C3' 122.248 2.123 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . 0.414 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.661 0 O5'-C5'-C4' 115.06 3.472 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.501 ' C4 ' ' N6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.603 0 C3'-C2'-C1' 106.802 2.93 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.501 ' N6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.473 1 P-O3'-C3' 127.441 6.45 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.556 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.302 1 P-O3'-C3' 124.84 4.284 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.556 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.571 4.321 0 N19-C1'-C2' 119.372 3.233 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.56 H2'' ' C8 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.525 1 P-O3'-C3' 127.534 6.529 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.627 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.472 0 O4'-C4'-C3' 108.247 2.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.627 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.512 0 O4'-C4'-C3' 108.606 3.006 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.456 " C5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.636 0 P-O3'-C3' 123.75 3.375 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.551 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.208 0 N19-C1'-C2' 119.309 3.193 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.604 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.739 0 P-O3'-C3' 123.664 3.304 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.604 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.643 0 C4'-C3'-C2' 100.404 -2.796 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.624 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.615 1 P-O3'-C3' 125.023 4.436 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.512 ' C8 ' H2'' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.301 0 O4'-C4'-C3' 107.966 2.366 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.533 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.609 0 O4'-C4'-C3' 108.385 2.785 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.911 0 O4'-C1'-N19 109.284 1.856 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.505 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.59 -40.5 6.29 Favored 'General case' 0 C--N 1.382 2.006 0 CA-C-N 113.663 -1.608 . . . . 0.0 108.706 -177.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 170.51 -38.41 0.0 OUTLIER 'General case' 0 C--N 1.389 2.3 0 CA-C-N 113.54 -1.664 . . . . 0.0 107.98 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -149.0 -144.87 4.03 Favored Glycine 0 C--N 1.381 3.065 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -160.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.796 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.0 OUTLIER -115.78 170.03 6.21 Favored Pre-proline 0 CA--C 1.581 2.136 0 CA-C-N 113.672 -1.264 . . . . 0.0 108.6 170.619 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.796 ' HD2' HD13 ' P' ' 105' ' ' LEU . 48.3 Cg_exo -46.59 93.09 0.02 OUTLIER 'Trans proline' 0 C--N 1.399 3.195 0 C-N-CA 123.029 2.486 . . . . 0.0 110.361 155.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -112.18 89.66 3.13 Favored 'General case' 0 C--N 1.381 1.97 0 CA-C-O 122.358 1.075 . . . . 0.0 109.101 156.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 108' ' ' LYS . . . . . 0.495 ' C ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -102.78 -71.74 0.71 Allowed 'General case' 0 C--N 1.382 1.995 0 CA-C-N 113.779 -1.555 . . . . 0.0 108.071 -166.385 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.9 ' HE2' ' N ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -83.48 146.05 28.6 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 113.846 -1.524 . . . . 0.0 109.359 -176.725 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.9 ' N ' ' HE2' ' P' ' 109' ' ' LYS . 0.4 OUTLIER -147.51 71.68 1.21 Allowed 'General case' 0 C--N 1.383 2.06 0 CA-C-N 113.734 -1.576 . . . . 0.0 109.29 -155.423 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.768 ' HD2' " O4'" ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -26.71 89.54 0.0 OUTLIER 'General case' 0 C--N 1.38 1.934 0 C-N-CA 126.348 1.859 . . . . 0.0 110.448 -170.619 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 112' ' ' ARG . . . . . 0.555 ' HD3' ' OP1' ' B' ' 29' ' ' ' DC' . 71.1 mtt85 -76.08 178.04 6.65 Favored 'General case' 0 C--N 1.388 2.245 0 CA-C-N 112.282 -2.235 . . . . 0.0 109.001 155.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.926 ' CD ' HD21 ' P' ' 115' ' ' LEU . 1.3 ttm180 -89.08 119.09 29.28 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-N 113.415 -1.721 . . . . 0.0 107.152 164.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 114' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.23 67.16 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.159 0 CA-C-O 125.411 2.529 . . . . 0.0 108.058 -162.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.926 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.46 107.74 8.94 Favored 'General case' 0 C--N 1.391 2.376 0 CA-C-N 111.62 -2.536 . . . . 0.0 109.374 -157.892 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.546 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.6 m-85 -76.42 142.47 41.05 Favored 'General case' 0 C--N 1.389 2.285 0 CA-C-N 112.5 -2.136 . . . . 0.0 108.112 -170.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.19 147.82 52.75 Favored 'General case' 0 C--N 1.381 1.976 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -168.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.424 ' O ' ' N ' ' P' ' 122' ' ' TYR . 37.5 ttmt -42.82 -36.22 1.41 Allowed 'General case' 0 C--N 1.381 1.963 0 CA-C-N 113.716 -1.584 . . . . 0.0 109.381 -177.012 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.77 -67.39 0.26 Allowed 'General case' 0 C--N 1.383 2.025 0 CA-C-O 123.981 1.848 . . . . 0.0 109.088 173.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.1 mt-30 -48.32 -48.8 35.84 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 112.435 -2.166 . . . . 0.0 110.038 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.649 ' HA ' HD12 ' P' ' 124' ' ' LEU . 9.1 m -50.39 -58.38 5.84 Favored 'General case' 0 C--N 1.384 2.071 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.438 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.538 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 0.6 OUTLIER -52.94 -46.99 68.39 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.985 -170.246 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.688 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -67.06 -35.94 80.94 Favored 'General case' 0 C--O 1.265 1.898 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.137 177.416 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.75 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.7 mt -59.98 -53.97 51.51 Favored 'General case' 0 C--N 1.381 1.956 0 O-C-N 119.593 -1.942 . . . . 0.0 109.619 168.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.576 ' O ' ' N ' ' P' ' 129' ' ' ARG . 11.6 mt-10 -55.36 -42.37 73.81 Favored 'General case' 0 C--N 1.381 1.962 0 CA-C-O 122.564 1.173 . . . . 0.0 109.679 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.538 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -47.41 -71.6 0.07 Allowed 'General case' 0 C--N 1.38 1.912 0 CA-C-N 111.235 -2.712 . . . . 0.0 108.132 177.085 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.681 ' HD2' HD21 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -60.82 -33.3 72.81 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 113.933 -1.485 . . . . 0.0 108.405 -172.397 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.842 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 30.6 t80 -69.89 -48.9 56.9 Favored 'General case' 0 C--N 1.38 1.929 0 CA-C-N 119.623 1.102 . . . . 0.0 109.998 176.304 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.576 ' N ' ' O ' ' P' ' 125' ' ' GLU . 71.3 mtt180 -62.19 -19.08 62.75 Favored 'General case' 0 C--N 1.38 1.93 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -167.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -99.92 -40.02 7.88 Favored 'General case' 0 C--N 1.379 1.85 0 C-N-CA 126.279 1.832 . . . . 0.0 107.097 -169.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.482 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.8 OUTLIER -154.58 102.86 2.43 Favored 'General case' 0 C--N 1.384 2.102 0 CA-C-N 111.953 -2.385 . . . . 0.0 109.329 -152.61 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 132' ' ' ARG . . . . . 0.86 ' NH2' HG21 ' P' ' 164' ' ' THR . 0.6 OUTLIER -74.45 -13.89 60.76 Favored 'General case' 0 C--N 1.394 2.533 0 CA-C-N 112.244 -2.253 . . . . 0.0 111.212 -161.354 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.453 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 12.8 m-85 -159.23 111.09 2.12 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-N 113.36 -1.745 . . . . 0.0 108.089 -154.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.681 HD21 ' HD2' ' P' ' 127' ' ' ARG . 29.2 mt -123.4 132.36 53.93 Favored 'General case' 0 C--N 1.398 2.703 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -155.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.0 155.46 23.94 Favored 'General case' 0 C--N 1.38 1.934 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 171.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.533 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.17 -49.32 93.6 Favored Pre-proline 0 CA--C 1.584 2.276 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -160.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.533 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 75.5 Cg_exo -59.84 -28.8 88.02 Favored 'Trans proline' 0 C--N 1.401 3.312 0 N-CA-C 115.402 1.27 . . . . 0.0 115.402 -176.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.45 ' HB3' HD22 ' P' ' 134' ' ' LEU . 2.9 mm-40 -53.33 -72.4 0.06 Allowed 'General case' 0 C--N 1.379 1.872 0 CA-C-O 124.822 2.249 . . . . 0.0 106.795 158.397 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.906 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -66.45 -39.44 88.88 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 110.267 -3.152 . . . . 0.0 108.407 -154.318 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.635 ' O ' ' N ' ' P' ' 144' ' ' SER . 1.7 mt-10 -53.81 -43.2 69.15 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.576 1.179 . . . . 0.0 108.319 177.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -63.55 -36.81 85.03 Favored 'General case' 0 C--N 1.381 1.936 0 CA-C-N 112.693 -2.048 . . . . 0.0 109.277 -174.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.613 ' O ' HG23 ' P' ' 146' ' ' ILE . 0.8 OUTLIER -60.02 -45.65 92.07 Favored 'General case' 0 C--N 1.386 2.172 0 CA-C-O 122.79 1.281 . . . . 0.0 108.857 165.675 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.75 -30.53 71.62 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 112.606 -2.088 . . . . 0.0 109.368 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.635 ' N ' ' O ' ' P' ' 140' ' ' GLU . 8.0 t -74.81 -43.46 54.56 Favored 'General case' 0 C--N 1.383 2.04 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.327 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 145' ' ' LEU . . . . . 0.533 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 39.4 mt -62.51 -44.06 97.28 Favored 'General case' 0 C--N 1.38 1.914 0 CA-C-O 124.727 2.203 . . . . 0.0 107.794 -164.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.976 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -102.87 -17.24 7.13 Favored 'Isoleucine or valine' 0 C--N 1.385 2.135 0 CA-C-N 110.283 -3.144 . . . . 0.0 107.792 -168.766 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 147' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.0 OUTLIER 81.22 37.55 0.08 Allowed 'General case' 0 C--N 1.388 2.249 0 CA-C-N 111.249 -2.705 . . . . 0.0 108.292 153.496 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.976 HD12 HD11 ' P' ' 146' ' ' ILE . 5.7 mt -95.25 168.04 10.98 Favored 'General case' 0 C--N 1.39 2.332 0 CA-C-N 112.353 -2.203 . . . . 0.0 109.416 167.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.638 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -88.77 143.38 31.64 Favored Pre-proline 0 CA--C 1.587 2.378 0 CA-C-O 122.948 1.356 . . . . 0.0 108.25 173.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -60.74 -37.32 79.56 Favored 'Trans proline' 1 C--N 1.415 4.062 0 C-N-CA 122.621 2.214 . . . . 0.0 112.885 -155.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.79 -34.9 63.26 Favored 'General case' 0 C--N 1.384 2.092 0 C-N-CA 119.593 -0.843 . . . . 0.0 109.774 165.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.638 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.7 mt-30 -70.91 -27.67 63.96 Favored 'General case' 0 C--N 1.388 2.272 0 N-CA-C 105.639 -1.986 . . . . 0.0 105.639 -177.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.79 HG11 ' HB2' ' P' ' 139' ' ' ARG . 1.3 t -64.55 -71.99 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.096 0 CA-C-N 121.537 1.971 . . . . 0.0 109.567 164.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.906 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.75 -58.93 0.42 Allowed 'General case' 0 C--N 1.385 2.144 0 C-N-CA 124.807 1.243 . . . . 0.0 110.784 -177.8 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.444 HD13 ' OE1' ' P' ' 158' ' ' GLN . 22.7 mm -58.81 -40.86 81.03 Favored 'Isoleucine or valine' 0 C--N 1.381 1.969 0 CA-C-N 113.089 -1.869 . . . . 0.0 108.847 -172.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.75 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.9 t90 -67.71 -31.89 72.14 Favored 'General case' 0 C--N 1.382 2.011 0 O-C-N 121.419 -0.801 . . . . 0.0 109.311 173.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.842 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 72.5 m-85 -75.18 -38.76 60.69 Favored 'General case' 0 C--O 1.274 2.345 0 O-C-N 121.274 -0.891 . . . . 0.0 112.302 173.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.482 ' N ' ' O ' ' P' ' 154' ' ' LYS . 81.1 mt-30 -53.22 -62.93 1.33 Allowed 'General case' 0 C--N 1.376 1.754 0 O-C-N 119.879 -1.763 . . . . 0.0 106.465 167.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -56.53 -24.49 47.11 Favored 'General case' 0 C--N 1.39 2.331 0 CA-C-O 117.672 -1.156 . . . . 0.0 109.648 -166.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.543 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 1.1 t-80 -79.26 -38.03 36.48 Favored 'General case' 0 C--O 1.282 2.787 0 CA-C-N 121.491 1.95 . . . . 0.0 111.895 178.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.502 ' NH2' ' HB3' ' P' ' 157' ' ' PHE . 0.0 OUTLIER -68.08 -32.51 72.88 Favored 'General case' 0 C--O 1.266 1.96 0 CA-C-N 122.997 2.635 . . . . 0.0 111.225 179.748 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 162' ' ' TYR . . . . . 0.751 ' HE2' ' CZ ' ' P' ' 166' ' ' ARG . 53.9 t80 -67.46 -43.66 80.52 Favored 'General case' 0 C--N 1.381 1.953 0 CA-C-N 120.825 1.648 . . . . 0.0 108.792 172.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -65.72 -39.96 91.71 Favored 'General case' 0 C--N 1.382 1.984 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -167.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.86 HG21 ' NH2' ' P' ' 132' ' ' ARG . 0.5 OUTLIER -51.69 -59.65 4.05 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-O 125.022 2.344 . . . . 0.0 106.958 -172.892 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.519 ' HG2' HG23 ' P' ' 164' ' ' THR . 6.4 mmmt -59.35 -46.89 87.37 Favored 'General case' 0 C--N 1.387 2.203 1 CA-C-N 108.128 -4.124 . . . . 0.0 108.21 -161.568 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 166' ' ' ARG . . . . . 0.751 ' CZ ' ' HE2' ' P' ' 162' ' ' TYR . 1.6 mtt180 -46.05 -51.96 12.79 Favored 'General case' 0 C--N 1.381 1.937 0 CA-C-N 112.852 -1.976 . . . . 0.0 111.072 173.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -55.85 -33.26 64.35 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 112.568 -2.105 . . . . 0.0 108.9 -173.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.63 -27.91 28.82 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 111.929 -2.396 . . . . 0.0 110.238 -173.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.63 -31.92 39.26 Favored 'General case' 0 C--N 1.378 1.815 0 CA-C-O 123.187 1.47 . . . . 0.0 110.43 170.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -68.97 -32.96 72.92 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 112.822 -1.99 . . . . 0.0 108.343 -166.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 48.4 mttt -83.61 80.81 9.0 Favored 'General case' 0 C--N 1.382 1.999 0 CA-C-N 113.5 -1.682 . . . . 0.0 109.095 -155.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 123.66 -49.26 0.91 Allowed Glycine 0 C--N 1.382 3.11 0 N-CA-C 108.914 -1.674 . . . . 0.0 108.914 -169.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 96.32 150.65 0.02 OUTLIER 'General case' 0 C--N 1.393 2.491 0 CA-C-N 112.373 -1.914 . . . . 0.0 108.396 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -164.39 158.43 18.54 Favored 'General case' 0 C--N 1.388 2.262 0 CA-C-N 113.448 -1.705 . . . . 0.0 107.424 156.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -150.22 25.58 1.12 Allowed Glycine 0 C--N 1.379 2.968 0 O-C-N 120.562 -1.336 . . . . 0.0 110.156 -162.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 46.6 t60 179.83 140.89 0.31 Allowed Pre-proline 0 CA--C 1.58 2.115 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo . . . . . 0 CA--C 1.594 3.482 0 C-N-CA 121.55 1.5 . . . . 0.0 111.63 169.571 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.824 0 O5'-C5'-C4' 114.344 2.96 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.794 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.561 3.312 0 O4'-C4'-C3' 108.186 2.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.794 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.863 0 P-O3'-C3' 122.76 2.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.613 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.483 0 P-O3'-C3' 123.439 3.116 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.539 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.742 0 O4'-C4'-C3' 108.046 2.446 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.565 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.57 4.231 0 N19-C1'-C2' 119.473 3.296 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.813 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.872 2 P-O3'-C3' 125.575 4.895 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.813 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.423 0 O5'-C5'-C4' 114.913 3.367 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.75 " H5'" ' HD3' ' P' ' 111' ' ' LYS . . . . . . . . 0 C5'--C4' 1.539 3.523 0 O4'-C4'-C3' 108.542 2.942 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.436 ' C2 ' ' C2 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.898 1 P-O3'-C3' 125.045 4.454 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.519 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.552 1 P-O3'-C3' 127.893 6.827 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.301 0 P-O3'-C3' 123.174 2.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.505 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.523 0 O4'-C4'-C3' 108.194 2.594 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.505 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.591 0 P-O3'-C3' 124.272 3.81 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.849 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.88 1 O4'-C1'-N19 111.169 4.212 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.849 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.565 0 P-O3'-C3' 122.208 2.09 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.759 0 O5'-C5'-C4' 115.042 3.459 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.491 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.655 1 P-O3'-C3' 125.072 4.477 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.491 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.535 0 O4'-C4'-C3' 108.109 2.509 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.562 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.334 0 O4'-C4'-C3' 108.101 2.501 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.562 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.572 4.356 0 N19-C1'-C2' 119.204 3.127 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.507 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.498 1 P-O3'-C3' 126.997 6.081 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.612 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.411 0 O4'-C4'-C3' 108.529 2.929 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.612 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.499 0 O4'-C4'-C3' 108.564 2.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.578 " H2'" ' H71' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.705 0 O4'-C4'-C3' 108.294 2.694 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.578 ' H71' " H2'" ' B' ' 25' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.558 4.018 0 N19-C1'-C2' 118.868 2.918 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.618 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.6 0 C4'-C3'-C2' 100.685 -2.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.62 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.526 0 C3'-C2'-C1' 106.383 2.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.62 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.713 1 P-O3'-C3' 125.296 4.664 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.406 0 O4'-C4'-C3' 108.104 2.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.597 0 P-O3'-C3' 123.45 3.125 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.842 0 O4'-C1'-N19 109.365 1.956 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.486 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 74.88 150.11 0.11 Allowed 'General case' 0 C--N 1.381 1.968 0 CA-C-N 113.734 -1.575 . . . . 0.0 108.643 -172.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 170.94 -38.45 0.0 OUTLIER 'General case' 0 C--N 1.388 2.281 0 CA-C-N 113.527 -1.67 . . . . 0.0 107.962 -173.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 104' ' ' GLY . . . . . 0.484 ' O ' HD23 ' P' ' 105' ' ' LEU . . . -120.15 106.15 1.16 Allowed Glycine 0 C--N 1.381 3.044 0 N-CA-C 108.899 -1.68 . . . . 0.0 108.899 -161.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.513 HD22 ' HA ' ' P' ' 105' ' ' LEU . 0.0 OUTLIER -138.37 168.91 14.15 Favored Pre-proline 0 CA--C 1.583 2.227 0 CA-C-N 113.683 -1.258 . . . . 0.0 108.775 179.421 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.46 ' HD2' ' HB3' ' P' ' 105' ' ' LEU . 0.3 OUTLIER -94.25 83.0 0.15 Allowed 'Trans proline' 0 C--N 1.394 2.972 0 C-N-CA 123.857 3.038 . . . . 0.0 110.226 -164.228 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -96.72 105.19 17.26 Favored 'General case' 0 C--N 1.383 2.032 0 CA-C-N 113.645 -1.616 . . . . 0.0 109.185 174.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 108' ' ' LYS . . . . . 0.731 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -93.0 -42.4 9.46 Favored 'General case' 0 C--N 1.382 2.01 0 CA-C-N 113.73 -1.577 . . . . 0.0 108.15 -175.789 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.58 ' HG3' ' N ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -71.3 160.58 32.55 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 113.761 -1.563 . . . . 0.0 109.102 172.099 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.731 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.7 OUTLIER -137.91 -155.09 0.57 Allowed 'General case' 0 C--N 1.378 1.832 0 CA-C-O 123.226 1.488 . . . . 0.0 107.452 -154.715 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.808 ' HD2' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -96.29 90.73 5.56 Favored 'General case' 0 C--N 1.385 2.141 0 CA-C-N 111.905 -2.407 . . . . 0.0 108.297 -167.558 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 69.0 mtt85 -53.59 166.29 0.32 Allowed 'General case' 0 C--N 1.392 2.416 0 CA-C-N 111.671 -2.513 . . . . 0.0 108.71 155.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.85 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.6 OUTLIER -88.8 118.82 28.77 Favored 'General case' 0 C--N 1.384 2.085 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 155.161 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.751 HG21 ' OP1' ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -111.11 62.84 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.175 0 CA-C-O 125.839 2.733 . . . . 0.0 107.878 -157.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.85 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.1 108.15 8.82 Favored 'General case' 0 C--N 1.392 2.439 0 CA-C-N 110.94 -2.845 . . . . 0.0 109.2 -155.353 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.499 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 -75.24 142.21 43.4 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-N 112.531 -2.122 . . . . 0.0 108.057 -167.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.29 148.13 52.3 Favored 'General case' 0 C--N 1.381 1.965 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -169.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.433 ' O ' ' N ' ' P' ' 122' ' ' TYR . 31.8 ttmt -43.43 -36.15 1.86 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-N 113.384 -1.734 . . . . 0.0 109.226 -177.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.67 -66.86 0.32 Allowed 'General case' 0 C--N 1.382 2.019 0 CA-C-O 124.109 1.909 . . . . 0.0 109.138 173.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.546 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.7 mt-30 -48.71 -45.92 39.95 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-N 112.476 -2.147 . . . . 0.0 109.663 177.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.71 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.0 m -54.73 -54.75 37.83 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.359 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.614 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.6 t80 -53.18 -46.13 68.81 Favored 'General case' 0 C--N 1.382 2.014 0 CA-C-O 122.381 1.086 . . . . 0.0 110.161 -171.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.696 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.3 OUTLIER -66.35 -40.15 89.64 Favored 'General case' 0 C--N 1.38 1.893 0 CA-C-N 114.245 -1.343 . . . . 0.0 107.803 179.417 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.736 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.7 mt -60.98 -48.94 79.5 Favored 'General case' 0 C--N 1.386 2.174 0 O-C-N 120.528 -1.357 . . . . 0.0 109.607 173.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.6 mt-10 -55.18 -52.63 62.72 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.755 1.264 . . . . 0.0 109.398 176.266 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.614 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -42.28 -58.67 2.09 Favored 'General case' 0 C--N 1.379 1.848 0 CA-C-N 112.209 -2.269 . . . . 0.0 109.075 177.073 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.679 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -69.83 -32.72 71.3 Favored 'General case' 0 C--N 1.396 2.596 0 CA-C-N 112.481 -2.145 . . . . 0.0 108.467 -168.083 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.715 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.0 t80 -68.95 -52.09 32.87 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-O 121.81 0.814 . . . . 0.0 109.638 171.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.668 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 3.2 mmm180 -62.58 -14.07 38.4 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-N 113.545 -1.661 . . . . 0.0 108.302 -164.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -95.91 -47.33 6.17 Favored 'General case' 0 C--N 1.379 1.87 0 CA-C-O 123.93 1.824 . . . . 0.0 106.539 -176.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.614 ' OE1' HD23 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -159.36 123.1 3.78 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 111.919 -2.401 . . . . 0.0 110.256 -166.043 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 132' ' ' ARG . . . . . 0.5 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 1.1 ptt-85 -80.45 -7.65 59.23 Favored 'General case' 0 C--N 1.387 2.223 0 CA-C-N 112.36 -2.2 . . . . 0.0 111.243 -162.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.578 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 0.4 OUTLIER -152.84 90.6 1.48 Allowed 'General case' 0 C--N 1.378 1.837 0 CA-C-O 126.846 3.212 . . . . 0.0 109.183 -154.268 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.614 HD23 ' OE1' ' P' ' 131' ' ' GLN . 65.0 mt -97.3 137.88 35.62 Favored 'General case' 0 C--N 1.415 3.413 0 CA-C-N 111.863 -2.426 . . . . 0.0 108.528 -166.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.31 156.68 25.4 Favored 'General case' 0 C--N 1.381 1.971 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 161.184 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.521 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.11 -50.01 90.05 Favored Pre-proline 0 CA--C 1.583 2.221 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.458 -163.663 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.521 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 69.9 Cg_exo -57.05 -28.86 80.72 Favored 'Trans proline' 0 C--N 1.4 3.269 0 N-CA-C 115.011 1.12 . . . . 0.0 115.011 -172.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.564 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.1 OUTLIER -55.53 -70.88 0.1 Allowed 'General case' 0 C--N 1.384 2.093 0 CA-C-O 125.039 2.352 . . . . 0.0 105.734 164.421 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 1.015 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.59 -40.51 80.46 Favored 'General case' 0 C--N 1.391 2.388 0 CA-C-N 109.514 -3.494 . . . . 0.0 108.739 -156.047 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.647 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.8 mt-10 -53.17 -41.28 65.04 Favored 'General case' 0 C--N 1.38 1.901 0 CA-C-O 123.482 1.611 . . . . 0.0 108.368 178.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -64.03 -35.13 79.7 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.99 -172.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.679 HD13 ' CG ' ' P' ' 127' ' ' ARG . 2.5 tp -65.33 -43.04 92.21 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-O 123.282 1.515 . . . . 0.0 108.957 168.337 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.2 -34.98 66.77 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-N 112.32 -2.218 . . . . 0.0 108.37 174.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.572 ' N ' ' O ' ' P' ' 140' ' ' GLU . 3.1 t -73.49 -44.27 58.28 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.248 -179.153 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 81.2 mt -66.19 -47.01 75.31 Favored 'General case' 0 C--N 1.379 1.88 0 CA-C-O 124.897 2.284 . . . . 0.0 107.933 -163.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 1.045 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.66 -17.07 7.1 Favored 'Isoleucine or valine' 0 C--N 1.385 2.124 0 CA-C-N 110.539 -3.028 . . . . 0.0 107.688 -171.565 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 81.26 37.11 0.08 Allowed 'General case' 0 C--N 1.385 2.148 0 CA-C-N 111.44 -2.618 . . . . 0.0 108.181 152.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 1.045 HD12 HD11 ' P' ' 146' ' ' ILE . 6.0 mt -95.32 168.25 10.84 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 112.084 -2.325 . . . . 0.0 109.395 168.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.65 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.9 p -89.28 143.8 31.45 Favored Pre-proline 0 CA--C 1.588 2.407 0 CA-C-O 122.794 1.283 . . . . 0.0 108.26 172.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -60.66 -37.82 76.52 Favored 'Trans proline' 0 C--N 1.414 3.993 0 C-N-CA 122.531 2.154 . . . . 0.0 112.409 -155.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.27 -32.65 62.55 Favored 'General case' 0 C--N 1.385 2.121 0 C-N-CA 119.512 -0.875 . . . . 0.0 109.806 166.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.65 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.8 mt-30 -72.4 -29.44 63.74 Favored 'General case' 0 C--N 1.389 2.283 0 N-CA-C 105.848 -1.908 . . . . 0.0 105.848 -178.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.83 HG11 ' HB2' ' P' ' 139' ' ' ARG . 1.2 t -64.71 -69.75 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.098 0 CA-C-N 121.9 2.137 . . . . 0.0 109.562 166.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 1.015 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.68 -59.18 0.41 Allowed 'General case' 0 C--N 1.387 2.234 0 C-N-CA 124.986 1.315 . . . . 0.0 110.801 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.743 HG21 " H5'" ' A' ' 8' ' ' ' DA' . 3.4 mm -55.22 -43.15 69.49 Favored 'Isoleucine or valine' 0 C--N 1.384 2.082 0 CA-C-N 112.825 -1.989 . . . . 0.0 110.089 -176.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.736 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.0 t90 -66.83 -30.56 70.77 Favored 'General case' 0 C--N 1.382 1.981 0 O-C-N 120.912 -1.118 . . . . 0.0 108.998 174.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.715 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 45.2 m-85 -76.11 -44.39 38.8 Favored 'General case' 0 C--O 1.276 2.493 0 O-C-N 121.235 -0.916 . . . . 0.0 111.939 174.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' P' ' 154' ' ' LYS . 23.5 mt-30 -42.71 -66.3 0.38 Allowed 'General case' 0 C--N 1.378 1.807 0 O-C-N 119.078 -2.264 . . . . 0.0 107.713 167.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -56.66 -21.93 30.97 Favored 'General case' 0 C--N 1.396 2.628 0 CA-C-N 112.759 -2.019 . . . . 0.0 109.695 -165.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.509 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.3 t-160 -76.12 -49.84 16.29 Favored 'General case' 0 C--O 1.284 2.876 0 CA-C-N 120.9 1.682 . . . . 0.0 110.809 172.253 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.734 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -69.2 -41.31 77.29 Favored 'General case' 0 C--O 1.269 2.083 0 CA-C-N 122.505 2.411 . . . . 0.0 109.578 -160.062 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -66.04 -31.72 72.76 Favored 'General case' 0 C--N 1.38 1.931 0 O-C-N 119.951 -1.718 . . . . 0.0 109.359 171.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -32.67 74.26 Favored 'General case' 0 C--N 1.381 1.96 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -171.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.734 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.4 OUTLIER -69.02 -56.25 8.34 Favored 'General case' 0 C--N 1.378 1.828 0 CA-C-O 125.035 2.35 . . . . 0.0 105.556 -165.321 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 165' ' ' LYS . . . . . . . . . . . . . 7.9 mtpt -58.26 -51.65 68.86 Favored 'General case' 0 C--N 1.388 2.269 0 CA-C-N 108.437 -3.983 . . . . 0.0 109.016 -170.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -30.27 66.79 Favored 'General case' 0 C--N 1.382 1.996 0 CA-C-N 112.293 -2.231 . . . . 0.0 108.079 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.652 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -68.36 -32.25 72.2 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-O 124.237 1.97 . . . . 0.0 109.529 -174.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.21 -20.72 31.85 Favored 'General case' 0 C--N 1.392 2.425 0 CA-C-N 112.695 -2.048 . . . . 0.0 109.913 -175.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -53.42 -32.57 50.34 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-O 123.901 1.81 . . . . 0.0 109.812 167.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.19 -33.67 43.67 Favored 'General case' 0 C--N 1.38 1.923 0 CA-C-N 112.183 -2.281 . . . . 0.0 107.466 -154.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 11.0 mttt -72.5 87.59 1.2 Allowed 'General case' 0 C--N 1.381 1.965 0 CA-C-N 113.51 -1.677 . . . . 0.0 109.02 -158.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 172' ' ' GLY . . . . . 0.448 ' C ' ' CD1' ' P' ' 173' ' ' TYR . . . 111.95 -93.46 0.7 Allowed Glycine 0 C--N 1.382 3.131 0 N-CA-C 108.545 -1.822 . . . . 0.0 108.545 -155.098 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 173' ' ' TYR . . . . . 0.486 ' HD1' ' N ' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 140.31 158.4 0.0 OUTLIER 'General case' 0 C--N 1.382 1.999 0 CA-C-N 113.051 -1.575 . . . . 0.0 109.604 -175.482 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.15 70.51 10.57 Favored 'General case' 0 C--N 1.391 2.394 0 CA-C-N 111.779 -2.464 . . . . 0.0 109.11 168.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -86.21 52.46 4.52 Favored Glycine 0 C--N 1.38 2.975 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 171.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -171.94 133.36 0.79 Allowed Pre-proline 0 CA--C 1.579 2.092 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 156.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo . . . . . 0 CA--C 1.594 3.482 0 C-N-CA 121.443 1.429 . . . . 0.0 111.552 167.703 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.838 0 O5'-C5'-C4' 114.345 2.961 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.672 ' N1 ' ' N3 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.438 1 P-O3'-C3' 126.812 5.927 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.53 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.84 0 P-O3'-C3' 123.268 2.973 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.646 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.52 0 P-O3'-C3' 123.852 3.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.506 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.863 0 P-O3'-C3' 122.854 2.629 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.549 ' C5 ' ' N6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.569 4.05 0 O4'-C4'-C3' 108.152 2.552 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.765 H2'' " H5'" ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.483 0 P-O3'-C3' 123.973 3.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.765 " H5'" H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.793 0 O4'-C1'-N19 110.419 3.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.468 ' C8 ' ' C7 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.524 0 O4'-C4'-C3' 108.201 2.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.477 H2'' ' C8 ' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.925 0 N19-C1'-C2' 117.745 2.216 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.509 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.606 0 O4'-C4'-C3' 108.59 2.99 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.561 3.335 1 P-O3'-C3' 127.369 6.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.729 " H2'" ' H71' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.532 0 O4'-C4'-C3' 108.428 2.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.729 ' H71' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.525 0 O4'-C4'-C3' 108.211 2.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.682 ' N9 ' ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.898 1 O4'-C1'-N19 111.371 4.463 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.682 ' H71' ' N9 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.602 0 P-O3'-C3' 122.21 2.092 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . 0.458 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.611 0 O5'-C5'-C4' 115.061 3.472 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.592 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.601 0 O4'-C4'-C3' 108.494 2.894 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.592 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.335 0 O4'-C4'-C3' 108.09 2.49 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.487 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.386 0 O4'-C4'-C3' 107.966 2.366 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.633 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.572 4.366 0 N19-C1'-C2' 118.963 2.977 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.633 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.532 0 P-O3'-C3' 122.877 2.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.627 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.439 0 C3'-C2'-C1' 106.986 3.061 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.627 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.703 0 P-O3'-C3' 123.305 3.005 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.632 ' C2 ' ' C4 ' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.568 3.981 0 P-O3'-C3' 124.018 3.598 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.632 ' C4 ' ' C2 ' ' B' ' 25' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.56 4.198 0 P-O3'-C3' 124.124 3.686 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.603 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.617 0 C4'-C3'-C2' 100.616 -2.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.608 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.489 0 P-O3'-C3' 122.628 2.44 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.646 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.567 0 O4'-C4'-C3' 108.402 2.802 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.662 " H5'" HH12 ' P' ' 113' ' ' ARG . . . . . . . . 0 C5'--C4' 1.538 3.427 0 O4'-C4'-C3' 107.915 2.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.672 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.563 0 O4'-C4'-C3' 108.217 2.617 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.791 0 O4'-C1'-N19 109.349 1.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.485 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -101.97 163.81 12.05 Favored 'General case' 0 C--N 1.382 2.011 0 CA-C-N 113.638 -1.619 . . . . 0.0 108.647 -172.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 170.3 -38.34 0.0 OUTLIER 'General case' 0 C--N 1.389 2.292 0 CA-C-N 113.546 -1.661 . . . . 0.0 108.011 -174.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -114.35 -129.01 4.71 Favored Glycine 0 C--N 1.382 3.1 0 N-CA-C 108.879 -1.688 . . . . 0.0 108.879 -161.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.877 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.1 OUTLIER -172.12 154.78 3.44 Favored Pre-proline 0 CA--C 1.581 2.16 0 CA-C-N 113.662 -1.269 . . . . 0.0 108.632 167.357 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.877 ' HD2' HD13 ' P' ' 105' ' ' LEU . 65.9 Cg_exo -49.01 92.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.398 3.157 0 C-N-CA 122.871 2.381 . . . . 0.0 110.372 155.32 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 107' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' P' ' 108' ' ' LYS . 8.4 m-20 -107.0 148.02 29.19 Favored 'General case' 0 C--N 1.381 1.971 0 CA-C-O 122.429 1.109 . . . . 0.0 109.149 158.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 108' ' ' LYS . . . . . 0.606 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.1 OUTLIER -162.55 33.81 0.11 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-N 113.683 -1.599 . . . . 0.0 108.151 -172.311 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.436 ' HE2' ' H ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -48.22 162.32 0.09 Allowed 'General case' 0 C--N 1.381 1.951 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.083 166.487 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.606 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.6 OUTLIER -123.72 86.42 2.57 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-N 113.669 -1.605 . . . . 0.0 108.909 -155.553 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.607 ' HG3' " H4'" ' A' ' 8' ' ' ' DA' . 0.4 OUTLIER -25.01 91.97 0.01 OUTLIER 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.187 -1.824 . . . . 0.0 110.313 169.089 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 36.1 mtt85 -70.4 -175.77 1.09 Allowed 'General case' 0 C--N 1.388 2.266 0 CA-C-N 112.112 -2.313 . . . . 0.0 108.926 155.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.892 ' CD ' HD21 ' P' ' 115' ' ' LEU . 1.0 OUTLIER -95.8 118.37 32.32 Favored 'General case' 0 C--N 1.384 2.071 0 CA-C-N 113.579 -1.646 . . . . 0.0 107.164 160.125 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.434 HG23 " O3'" ' A' ' 7' ' ' ' DA' . 0.1 OUTLIER -105.65 68.08 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.388 2.249 0 CA-C-O 125.265 2.46 . . . . 0.0 108.011 -163.48 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.892 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.89 108.75 10.15 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 111.52 -2.582 . . . . 0.0 109.335 -159.669 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.581 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.9 OUTLIER -77.49 143.63 38.34 Favored 'General case' 0 C--N 1.391 2.411 0 CA-C-N 112.725 -2.034 . . . . 0.0 107.705 -170.579 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.68 148.17 52.28 Favored 'General case' 0 C--N 1.382 1.984 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 -171.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -43.78 -36.51 2.32 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-N 113.279 -1.782 . . . . 0.0 109.157 -177.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.51 -65.16 0.61 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 124.203 1.954 . . . . 0.0 109.237 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.561 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.2 mt-30 -49.32 -47.61 46.99 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 127.081 2.152 . . . . 0.0 109.722 176.189 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.649 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.5 m -51.16 -56.18 14.08 Favored 'General case' 0 C--N 1.384 2.072 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 169.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.546 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 2.6 t80 -52.96 -48.62 67.24 Favored 'General case' 0 C--N 1.381 1.975 0 CA-C-O 122.593 1.187 . . . . 0.0 110.048 -169.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.934 ' CD ' HG22 ' P' ' 146' ' ' ILE . 6.9 mt-10 -66.23 -36.97 84.42 Favored 'General case' 0 C--N 1.377 1.798 0 CA-C-N 114.253 -1.34 . . . . 0.0 107.826 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.827 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -59.98 -51.85 67.92 Favored 'General case' 0 C--N 1.384 2.079 0 O-C-N 120.76 -1.212 . . . . 0.0 109.871 170.447 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' P' ' 129' ' ' ARG . 24.2 mt-10 -54.59 -51.47 65.22 Favored 'General case' 0 C--N 1.379 1.872 0 CA-C-O 122.629 1.205 . . . . 0.0 109.294 178.209 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.608 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -41.46 -70.06 0.12 Allowed 'General case' 0 C--N 1.379 1.873 0 CA-C-N 111.683 -2.508 . . . . 0.0 108.681 177.076 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.62 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.7 OUTLIER -56.67 -38.73 72.63 Favored 'General case' 0 C--N 1.387 2.238 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.259 -173.181 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.862 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 27.5 t80 -69.47 -46.44 66.66 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-O 121.541 0.686 . . . . 0.0 110.144 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' P' ' 125' ' ' GLU . 13.2 mtp85 -62.63 -13.96 37.74 Favored 'General case' 0 C--N 1.381 1.936 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 -168.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -107.44 -37.19 6.28 Favored 'General case' 0 C--N 1.379 1.887 0 C-N-CA 126.938 2.095 . . . . 0.0 107.96 -168.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.496 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -153.43 108.37 3.17 Favored 'General case' 0 C--N 1.39 2.328 0 CA-C-N 111.971 -2.377 . . . . 0.0 108.615 -153.45 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -76.15 -19.37 58.53 Favored 'General case' 0 C--N 1.39 2.36 0 CA-C-N 112.021 -2.354 . . . . 0.0 110.508 -168.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.435 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 36.5 m-85 -162.27 112.54 1.53 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 113.875 -1.511 . . . . 0.0 108.313 -153.275 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.603 HD22 ' HG3' ' P' ' 138' ' ' GLU . 29.6 mt -120.84 142.69 49.4 Favored 'General case' 0 C--N 1.398 2.706 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -163.024 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.83 152.24 29.82 Favored 'General case' 0 C--N 1.382 2.02 0 O-C-N 121.14 -0.975 . . . . 0.0 108.408 158.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.44 ' HA ' ' CG ' ' P' ' 139' ' ' ARG . . . -58.58 -43.78 98.34 Favored Pre-proline 0 CA--C 1.583 2.216 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -161.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 137' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -49.82 -43.35 41.11 Favored 'Trans proline' 0 C--N 1.393 2.914 0 N-CA-C 116.954 1.867 . . . . 0.0 116.954 -179.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.603 ' HG3' HD22 ' P' ' 134' ' ' LEU . 7.6 mm-40 -52.79 -62.61 1.54 Allowed 'General case' 0 C--N 1.39 2.353 0 CA-C-O 124.13 1.919 . . . . 0.0 105.984 169.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 1.042 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -68.01 -46.79 70.28 Favored 'General case' 0 C--N 1.388 2.273 0 CA-C-N 109.492 -3.504 . . . . 0.0 108.331 -158.506 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.66 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 3.3 mt-10 -53.87 -35.71 61.85 Favored 'General case' 0 C--N 1.38 1.893 0 CA-C-O 122.744 1.259 . . . . 0.0 108.003 -177.36 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -65.96 -36.4 83.24 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.563 -1.653 . . . . 0.0 108.859 -173.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.635 HD21 ' C ' ' P' ' 123' ' ' GLU . 1.0 OUTLIER -65.72 -42.28 91.24 Favored 'General case' 0 C--N 1.382 1.992 0 CA-C-O 123.172 1.463 . . . . 0.0 109.072 168.163 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.66 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.18 -32.66 64.54 Favored 'General case' 0 C--N 1.389 2.308 0 CA-C-N 112.62 -2.082 . . . . 0.0 108.346 172.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.627 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -73.15 -43.63 61.26 Favored 'General case' 0 C--N 1.389 2.302 0 CA-C-N 113.468 -1.696 . . . . 0.0 109.571 -177.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 86.4 mt -69.2 -45.68 69.32 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-O 124.812 2.244 . . . . 0.0 108.262 -164.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.969 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -97.14 -13.28 8.14 Favored 'Isoleucine or valine' 0 C--N 1.39 2.36 0 CA-C-N 110.934 -2.848 . . . . 0.0 108.11 -169.245 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 83.05 34.87 0.06 Allowed 'General case' 0 C--N 1.382 1.995 0 CA-C-O 125.67 2.652 . . . . 0.0 108.249 152.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.969 HD12 HD11 ' P' ' 146' ' ' ILE . 9.2 mt -96.89 171.41 8.52 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 111.65 -2.523 . . . . 0.0 109.736 169.357 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.569 ' O ' ' N ' ' P' ' 152' ' ' GLN . 20.7 p -95.2 143.19 25.68 Favored Pre-proline 0 CA--C 1.588 2.442 0 CA-C-O 122.361 1.077 . . . . 0.0 108.773 168.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.475 ' HG3' ' HA ' ' P' ' 140' ' ' GLU . 77.5 Cg_exo -55.37 -36.45 93.85 Favored 'Trans proline' 0 C--N 1.41 3.787 0 C-N-CA 122.059 1.84 . . . . 0.0 114.475 -165.085 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.73 -9.26 13.35 Favored 'General case' 0 C--N 1.38 1.93 0 CA-C-N 119.992 1.269 . . . . 0.0 111.687 167.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.569 ' N ' ' O ' ' P' ' 149' ' ' THR . 42.5 mt-30 -88.56 -34.22 17.43 Favored 'General case' 0 C--O 1.285 2.952 0 CA-C-O 117.169 -1.396 . . . . 0.0 108.471 168.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.971 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -65.0 -70.5 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.941 0 CA-C-N 124.65 3.386 . . . . 0.0 109.731 165.806 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 1.042 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.4 -54.2 0.52 Allowed 'General case' 0 C--N 1.386 2.17 0 C-N-CA 125.796 1.638 . . . . 0.0 108.865 -178.315 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.579 HD13 ' OE1' ' P' ' 158' ' ' GLN . 7.4 mm -56.89 -61.74 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.956 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.827 ' HB3' HD22 ' P' ' 124' ' ' LEU . 3.4 t90 -49.82 -30.19 9.33 Favored 'General case' 0 C--N 1.382 2.019 0 O-C-N 120.2 -1.562 . . . . 0.0 109.187 -178.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.971 ' CE2' HG13 ' P' ' 153' ' ' VAL . 74.1 m-85 -75.51 -43.88 46.65 Favored 'General case' 0 C--O 1.282 2.779 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 170.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.579 ' OE1' HD13 ' P' ' 155' ' ' ILE . 13.6 mt-30 -41.95 -70.94 0.09 Allowed 'General case' 0 C--N 1.378 1.808 0 O-C-N 118.517 -2.614 . . . . 0.0 106.533 161.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -18.92 22.82 Favored 'General case' 0 C--N 1.385 2.15 0 CA-C-O 117.684 -1.151 . . . . 0.0 111.187 -165.425 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.558 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.8 OUTLIER -74.95 -48.87 22.21 Favored 'General case' 0 C--O 1.281 2.72 0 CA-C-N 120.964 1.711 . . . . 0.0 110.186 177.073 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.805 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -68.63 -38.66 80.68 Favored 'General case' 0 C--O 1.269 2.079 0 CA-C-N 122.443 2.383 . . . . 0.0 110.59 -159.035 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -69.02 -30.95 69.44 Favored 'General case' 0 C--N 1.38 1.908 0 O-C-N 119.836 -1.79 . . . . 0.0 109.63 171.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -64.99 -37.52 87.91 Favored 'General case' 0 C--N 1.381 1.948 0 O-C-N 121.58 -0.7 . . . . 0.0 109.411 -173.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.805 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -59.0 -57.69 11.94 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-O 124.675 2.179 . . . . 0.0 106.092 -170.655 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.402 ' H ' ' HG3' ' P' ' 165' ' ' LYS . 17.0 mtpt -58.78 -45.37 89.99 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-N 108.564 -3.926 . . . . 0.0 109.123 -167.096 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -42.55 -51.18 5.19 Favored 'General case' 0 C--N 1.383 2.065 0 CA-C-N 113.339 -1.755 . . . . 0.0 111.278 170.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.64 -33.82 74.61 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-N 111.647 -2.524 . . . . 0.0 108.504 -171.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -80.15 -23.19 41.28 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 111.862 -2.426 . . . . 0.0 109.479 -174.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -54.78 -30.23 56.26 Favored 'General case' 0 C--N 1.384 2.101 0 CA-C-O 122.791 1.281 . . . . 0.0 109.337 169.046 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -74.33 -35.18 63.6 Favored 'General case' 0 C--N 1.387 2.198 0 CA-C-N 113.044 -1.889 . . . . 0.0 108.211 -164.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 12.0 mttt -85.2 89.62 7.69 Favored 'General case' 0 C--N 1.381 1.957 0 CA-C-N 113.821 -1.536 . . . . 0.0 109.14 -155.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 116.8 -87.51 0.44 Allowed Glycine 0 C--N 1.382 3.139 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 -155.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 173' ' ' TYR . . . . . 0.532 ' HD1' ' N ' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 155.62 151.08 0.01 OUTLIER 'General case' 0 C--N 1.381 1.953 0 CA-C-N 113.335 -1.433 . . . . 0.0 108.887 171.144 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -165.65 158.14 15.19 Favored 'General case' 0 C--N 1.39 2.333 0 CA-C-N 112.645 -2.07 . . . . 0.0 107.357 156.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 53.75 27.55 36.06 Favored Glycine 0 C--N 1.38 3.008 0 O-C-N 120.479 -1.388 . . . . 0.0 110.305 -160.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -130.1 134.33 25.99 Favored Pre-proline 0 CA--C 1.58 2.116 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 174.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo . . . . . 0 CA--C 1.593 3.465 0 C-N-CA 121.474 1.449 . . . . 0.0 111.604 172.63 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.769 0 O5'-C5'-C4' 114.385 2.989 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.701 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.561 3.314 0 O4'-C4'-C3' 108.144 2.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.701 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.94 0 P-O3'-C3' 122.728 2.524 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.627 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.408 0 P-O3'-C3' 123.295 2.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.555 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.843 0 O4'-C4'-C3' 108.1 2.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.536 H2'' ' C8 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.018 0 N19-C1'-C2' 118.941 2.963 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.768 " C5'" ' HG2' ' P' ' 113' ' ' ARG . . . . . . . . 0 C4'--C3' 1.562 3.434 1 O4'-C1'-N19 111.569 4.711 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.595 ' C6 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.412 0 C3'-C2'-C1' 106.284 2.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.595 ' C5 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.563 0 O4'-C4'-C3' 108.483 2.883 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.595 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.798 0 P-O3'-C3' 123.997 3.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.464 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.595 0 O4'-C4'-C3' 108.546 2.946 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.489 1 P-O3'-C3' 125.653 4.96 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.504 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 O4'-C4'-C3' 108.426 2.826 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.504 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.696 0 C2'-C3'-O3' 116.659 2.244 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.619 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.878 1 O4'-C1'-N19 111.32 4.399 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.619 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.553 0 P-O3'-C3' 122.227 2.106 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . 0.443 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.671 0 O5'-C5'-C4' 115.038 3.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.601 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.531 0 O4'-C4'-C3' 108.336 2.736 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.601 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.347 0 P-O3'-C3' 123.121 2.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.526 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.355 0 O4'-C4'-C3' 108.077 2.477 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.609 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.571 4.311 0 N19-C1'-C2' 118.917 2.948 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.609 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.559 0 P-O3'-C3' 123.257 2.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.443 0 C3'-C2'-C1' 107.11 3.15 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.865 0 O4'-C4'-C3' 108.209 2.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.593 " C5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.572 4.374 1 P-O3'-C3' 124.981 4.401 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.515 " C2'" ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.212 0 P-O3'-C3' 124.293 3.828 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.543 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.588 0 P-O3'-C3' 123.744 3.37 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.629 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.483 0 C4'-C3'-C2' 100.667 -2.533 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.629 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.58 0 P-O3'-C3' 123.294 2.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.639 " C5'" HH12 ' P' ' 113' ' ' ARG . . . . . . . . 0 C5'--C4' 1.538 3.37 0 O4'-C4'-C3' 107.843 2.243 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.466 H2'' ' C8 ' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.595 0 O4'-C4'-C3' 108.186 2.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . 0.466 ' C8 ' H2'' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.542 3.899 0 O4'-C1'-N19 109.404 2.004 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.502 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.9 t -80.53 -59.49 2.67 Favored 'General case' 0 C--N 1.382 1.983 0 CA-C-N 113.669 -1.605 . . . . 0.0 108.635 175.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 169.65 37.74 0.0 OUTLIER 'General case' 0 C--N 1.396 2.602 0 CA-C-N 113.383 -1.735 . . . . 0.0 109.483 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . 95.28 151.88 28.74 Favored Glycine 0 C--N 1.381 3.063 0 N-CA-C 108.738 -1.745 . . . . 0.0 108.738 161.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.7 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.1 OUTLIER -157.27 145.59 14.36 Favored Pre-proline 0 CA--C 1.58 2.122 0 CA-C-N 113.679 -1.26 . . . . 0.0 108.775 -165.801 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.7 ' HD2' HD13 ' P' ' 105' ' ' LEU . 0.1 OUTLIER -82.15 45.88 2.06 Favored 'Trans proline' 0 C--N 1.394 2.957 0 C-N-CA 123.142 2.561 . . . . 0.0 110.524 163.863 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -52.69 153.44 3.18 Favored 'General case' 0 C--N 1.382 1.981 0 CA-C-N 113.928 -1.487 . . . . 0.0 109.171 -174.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.6 -165.75 1.1 Allowed 'General case' 0 C--N 1.382 1.998 0 CA-C-N 113.715 -1.584 . . . . 0.0 108.132 -173.096 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.709 ' HE2' ' O ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -69.75 135.21 49.49 Favored 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.705 -1.589 . . . . 0.0 109.093 179.445 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.709 ' O ' ' HE2' ' P' ' 109' ' ' LYS . 1.1 mmt85 -96.03 -145.28 0.28 Allowed 'General case' 0 C--N 1.377 1.793 0 CA-C-O 123.915 1.816 . . . . 0.0 108.151 -169.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' P' ' 111' ' ' LYS . 0.1 OUTLIER -146.77 115.86 6.94 Favored 'General case' 0 C--N 1.39 2.365 0 CA-C-N 111.68 -2.509 . . . . 0.0 107.979 158.706 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 112' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' P' ' 111' ' ' LYS . 70.2 mtt85 -62.92 170.96 2.38 Favored 'General case' 0 C--N 1.382 1.979 0 CA-C-N 114.145 -1.389 . . . . 0.0 108.799 160.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.867 ' CD ' HD21 ' P' ' 115' ' ' LEU . 1.2 ttm180 -87.13 117.27 25.75 Favored 'General case' 0 C--N 1.384 2.081 0 CA-C-N 113.569 -1.65 . . . . 0.0 106.917 163.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.501 HG23 " O3'" ' A' ' 7' ' ' ' DA' . 0.1 OUTLIER -105.63 69.2 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.387 2.217 0 CA-C-O 125.107 2.384 . . . . 0.0 108.004 -163.486 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.867 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.62 108.12 9.4 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 111.697 -2.501 . . . . 0.0 109.469 -156.369 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.413 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.5 m-85 -76.81 141.42 40.72 Favored 'General case' 0 C--N 1.389 2.287 0 CA-C-N 112.97 -1.923 . . . . 0.0 108.026 -170.376 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.1 p -67.37 148.08 52.09 Favored 'General case' 0 C--N 1.381 1.967 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -171.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.43 ' O ' ' N ' ' P' ' 122' ' ' TYR . 35.0 ttmt -43.17 -36.17 1.63 Allowed 'General case' 0 C--N 1.382 2.012 0 CA-C-N 113.271 -1.786 . . . . 0.0 109.258 -178.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.56 -66.67 0.35 Allowed 'General case' 0 C--N 1.383 2.032 0 CA-C-O 124.172 1.939 . . . . 0.0 109.078 173.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.9 mt-30 -49.12 -48.24 44.71 Favored 'General case' 0 C--N 1.382 2.005 0 CA-C-N 112.421 -2.172 . . . . 0.0 109.491 177.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.707 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.9 m -52.38 -55.07 24.15 Favored 'General case' 0 C--N 1.385 2.143 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 170.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.509 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 2.3 t80 -53.05 -45.69 68.19 Favored 'General case' 0 C--N 1.383 2.057 0 CA-C-O 122.237 1.018 . . . . 0.0 109.985 -171.481 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.715 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.8 -39.64 87.84 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-N 114.321 -1.309 . . . . 0.0 107.834 179.664 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.745 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.3 mt -60.55 -49.49 77.33 Favored 'General case' 0 C--N 1.385 2.111 0 O-C-N 120.532 -1.355 . . . . 0.0 109.599 172.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.5 mt-10 -55.68 -51.79 66.06 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-O 122.575 1.179 . . . . 0.0 109.639 177.058 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.594 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -40.65 -70.24 0.11 Allowed 'General case' 0 C--N 1.378 1.822 0 CA-C-N 111.851 -2.431 . . . . 0.0 109.022 177.245 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.735 ' HD2' HD21 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -62.82 -31.44 72.43 Favored 'General case' 0 C--N 1.379 1.866 0 CA-C-N 113.702 -1.59 . . . . 0.0 108.244 -171.185 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.813 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 19.9 t80 -70.13 -49.02 54.93 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-N 119.786 1.176 . . . . 0.0 109.971 175.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.5 mmm180 -62.65 -16.12 55.41 Favored 'General case' 0 C--N 1.38 1.909 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -166.643 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -105.29 -41.29 5.57 Favored 'General case' 0 C--N 1.378 1.84 0 CA-C-O 124.07 1.891 . . . . 0.0 107.217 -168.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.459 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.7 OUTLIER -152.94 96.67 2.12 Favored 'General case' 0 C--N 1.386 2.175 0 CA-C-N 111.752 -2.477 . . . . 0.0 109.54 -152.012 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 132' ' ' ARG . . . . . 0.487 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -77.48 -5.85 51.44 Favored 'General case' 0 C--N 1.394 2.52 0 CA-C-N 111.59 -2.55 . . . . 0.0 110.779 -158.406 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.726 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 2.5 m-30 -163.85 113.04 1.23 Allowed 'General case' 0 C--N 1.38 1.923 0 CA-C-N 114.516 -1.22 . . . . 0.0 108.356 -154.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.735 HD21 ' HD2' ' P' ' 127' ' ' ARG . 43.3 mt -120.67 139.6 52.79 Favored 'General case' 0 C--N 1.397 2.664 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -161.064 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.85 157.63 25.63 Favored 'General case' 0 C--N 1.382 2.022 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 160.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.522 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.22 -49.81 90.9 Favored Pre-proline 0 CA--C 1.583 2.222 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.465 -164.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 50.9 Cg_exo -55.99 -29.73 75.03 Favored 'Trans proline' 0 C--N 1.399 3.187 0 C-N-CA 121.002 1.135 . . . . 0.0 114.649 -173.146 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.445 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -55.87 -69.45 0.14 Allowed 'General case' 0 C--N 1.385 2.121 0 CA-C-O 124.176 1.941 . . . . 0.0 106.09 165.535 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.632 ' CZ ' ' HG3' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.67 -35.79 75.44 Favored 'General case' 0 C--N 1.391 2.408 0 CA-C-N 109.858 -3.337 . . . . 0.0 108.85 -156.275 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.668 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.0 mt-10 -52.25 -44.8 65.08 Favored 'General case' 0 C--N 1.381 1.944 0 CA-C-O 123.628 1.68 . . . . 0.0 107.786 174.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -67.12 -36.3 81.6 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 112.396 -2.184 . . . . 0.0 109.121 -166.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.573 ' O ' HG23 ' P' ' 146' ' ' ILE . 1.0 OUTLIER -65.95 -42.1 90.42 Favored 'General case' 0 C--N 1.382 1.995 0 CA-C-O 123.158 1.456 . . . . 0.0 109.049 169.401 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.3 -35.69 67.81 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.54 -2.118 . . . . 0.0 108.094 172.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.596 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.5 t -70.9 -43.14 68.92 Favored 'General case' 0 C--N 1.389 2.305 0 CA-C-N 113.231 -1.804 . . . . 0.0 110.592 -178.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.73 -46.96 67.55 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-O 124.863 2.268 . . . . 0.0 108.09 -164.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.992 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.37 -13.16 8.23 Favored 'Isoleucine or valine' 0 C--N 1.39 2.351 0 CA-C-N 110.815 -2.902 . . . . 0.0 108.042 -168.291 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 147' ' ' ARG . . . . . 0.568 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 7.4 tpt180 82.32 35.28 0.07 Allowed 'General case' 0 C--N 1.382 1.998 0 CA-C-O 125.635 2.636 . . . . 0.0 107.837 153.116 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.992 HD12 HD11 ' P' ' 146' ' ' ILE . 9.8 mt -95.89 172.32 8.09 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 111.473 -2.603 . . . . 0.0 109.145 168.611 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.477 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.3 p -88.98 146.43 36.54 Favored Pre-proline 0 CA--C 1.587 2.371 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 165.422 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.554 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 85.0 Cg_exo -50.45 -49.39 16.68 Favored 'Trans proline' 0 C--N 1.408 3.71 0 C-N-CA 123.78 2.986 . . . . 0.0 114.127 -167.355 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 151' ' ' THR . . . . . 0.427 HG22 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -58.26 -20.66 44.04 Favored 'General case' 0 C--N 1.386 2.194 0 CA-C-N 112.759 -2.019 . . . . 0.0 110.79 173.847 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.4 mt-30 -78.07 -32.48 50.8 Favored 'General case' 0 C--O 1.277 2.522 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 171.302 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.762 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.7 t -64.27 -75.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.381 1.972 0 CA-C-N 122.967 2.621 . . . . 0.0 109.718 162.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.632 ' HG3' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -40.65 -42.84 1.8 Allowed 'General case' 0 C--N 1.387 2.212 0 C-N-CA 124.881 1.273 . . . . 0.0 109.971 -171.108 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.427 HG12 HG22 ' P' ' 151' ' ' THR . 0.7 OUTLIER -60.3 -63.05 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.956 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 -179.381 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.745 ' HB3' HD22 ' P' ' 124' ' ' LEU . 2.7 t90 -49.5 -29.03 6.08 Favored 'General case' 0 C--N 1.384 2.078 0 O-C-N 121.415 -0.803 . . . . 0.0 109.311 -177.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.813 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 52.1 m-85 -75.19 -43.06 54.17 Favored 'General case' 0 C--O 1.275 2.437 0 O-C-N 121.629 -0.669 . . . . 0.0 112.37 173.127 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -46.58 -65.32 0.58 Allowed 'General case' 0 C--N 1.376 1.759 0 O-C-N 119.131 -2.231 . . . . 0.0 107.028 165.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -56.0 -19.77 13.93 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-O 117.868 -1.063 . . . . 0.0 111.073 -164.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.559 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 2.3 t-160 -79.19 -46.59 17.59 Favored 'General case' 0 C--O 1.286 3.019 0 CA-C-N 121.055 1.752 . . . . 0.0 111.752 173.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.726 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -65.97 -37.48 86.09 Favored 'General case' 0 C--O 1.266 1.939 0 CA-C-N 123.603 2.91 . . . . 0.0 110.192 -163.854 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 162' ' ' TYR . . . . . 0.451 ' CZ ' ' HB2' ' P' ' 166' ' ' ARG . 86.7 t80 -68.93 -35.2 76.52 Favored 'General case' 0 C--N 1.38 1.934 0 O-C-N 120.035 -1.666 . . . . 0.0 109.621 170.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.47 -37.46 87.61 Favored 'General case' 0 C--N 1.382 2.0 0 O-C-N 121.598 -0.689 . . . . 0.0 109.394 -169.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.612 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.6 OUTLIER -56.69 -61.31 2.51 Favored 'General case' 0 C--N 1.378 1.845 0 CA-C-O 124.828 2.252 . . . . 0.0 106.297 -173.473 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.451 ' HG2' HG23 ' P' ' 164' ' ' THR . 7.5 mmmt -59.19 -48.15 82.67 Favored 'General case' 0 C--N 1.387 2.197 1 CA-C-N 108.184 -4.098 . . . . 0.0 108.121 -160.901 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 166' ' ' ARG . . . . . 0.451 ' HB2' ' CZ ' ' P' ' 162' ' ' TYR . 23.8 ttt180 -54.63 -42.42 71.19 Favored 'General case' 0 C--N 1.381 1.97 0 CA-C-N 112.268 -2.242 . . . . 0.0 109.196 -179.233 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -60.07 -34.53 73.56 Favored 'General case' 0 C--N 1.384 2.07 0 CA-C-N 113.392 -1.731 . . . . 0.0 108.983 -175.625 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -80.94 -22.58 39.52 Favored 'General case' 0 C--N 1.389 2.296 0 CA-C-N 112.079 -2.328 . . . . 0.0 109.235 -173.222 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -56.73 -29.87 62.95 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-O 122.689 1.233 . . . . 0.0 109.981 168.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 170' ' ' GLU . . . . . 0.44 ' OE2' ' HE1' ' P' ' 173' ' ' TYR . 0.7 OUTLIER -71.18 -34.96 71.4 Favored 'General case' 0 C--N 1.385 2.151 0 CA-C-N 113.565 -1.652 . . . . 0.0 108.085 -167.936 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -89.34 85.13 6.51 Favored 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.922 -1.49 . . . . 0.0 109.231 -157.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 128.2 -64.02 0.6 Allowed Glycine 0 C--N 1.383 3.143 0 N-CA-C 108.829 -1.708 . . . . 0.0 108.829 -166.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 173' ' ' TYR . . . . . 0.44 ' HE1' ' OE2' ' P' ' 170' ' ' GLU . 18.6 m-85 122.72 160.51 0.0 OUTLIER 'General case' 0 C--N 1.381 1.936 0 CA-C-N 113.18 -1.51 . . . . 0.0 108.964 160.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -82.06 51.4 1.76 Allowed 'General case' 0 C--N 1.379 1.888 0 CA-C-N 112.211 -2.268 . . . . 0.0 110.363 174.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 146.75 -153.48 25.38 Favored Glycine 0 C--N 1.382 3.125 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -163.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 54.8 t60 -150.45 128.7 5.91 Favored Pre-proline 0 CA--C 1.58 2.124 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -174.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo . . . . . 0 CA--C 1.593 3.47 0 C-N-CA 121.533 1.489 . . . . 0.0 111.589 -168.847 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . 0.483 ' H71' ' N6 ' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.566 3.813 0 O5'-C5'-C4' 114.362 2.973 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.503 H2'' ' H71' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.331 1 P-O3'-C3' 126.833 5.944 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.503 ' H71' H2'' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.902 0 C2'-C3'-O3' 117.07 2.396 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.654 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.525 0 P-O3'-C3' 123.369 3.058 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.52 ' C2 ' ' C2 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.739 0 O4'-C4'-C3' 108.13 2.53 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.596 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.569 4.111 0 N19-C1'-C2' 119.679 3.424 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.804 H5'' HD22 ' P' ' 115' ' ' LEU . . . . . . . . 0 C4'--C3' 1.565 3.655 2 P-O3'-C3' 124.903 4.336 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.843 " O4'" ' HE3' ' P' ' 111' ' ' LYS . . . . . . . . 0 C5'--C4' 1.538 3.415 0 P-O5'-C5' 116.541 -2.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.592 ' C5 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.564 0 O4'-C4'-C3' 108.496 2.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.592 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.871 1 P-O3'-C3' 125.402 4.751 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.49 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.453 0 P-O3'-C3' 122.827 2.606 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . 0.508 H2'' ' C5 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.306 0 P-O3'-C3' 122.597 2.414 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.515 " H2'" ' H71' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.59 0 O4'-C4'-C3' 108.174 2.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.515 ' H71' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.634 0 P-O3'-C3' 123.646 3.289 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.653 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.927 1 O4'-C1'-N19 111.613 4.767 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.653 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.517 0 P-O3'-C3' 122.18 2.066 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . 0.413 H2'' H5'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.749 0 O5'-C5'-C4' 115.067 3.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.475 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.649 1 P-O3'-C3' 126.406 5.589 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.475 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.326 0 O4'-C4'-C3' 108.175 2.575 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.571 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.321 0 O4'-C4'-C3' 107.845 2.245 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.571 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.571 4.337 0 O4'-C1'-N19 105.249 -3.188 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.535 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.559 4.149 1 P-O3'-C3' 126.539 5.699 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.568 3.983 1 P-O3'-C3' 126.22 5.433 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.566 3.811 0 P-O3'-C3' 124.285 3.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.5 " C5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.891 0 P-O3'-C3' 123.675 3.312 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.561 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C3'--C2' 1.559 4.096 0 N19-C1'-C2' 119.12 3.075 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.632 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.696 0 P-O3'-C3' 123.69 3.325 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.632 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.561 3.343 0 P-O3'-C3' 122.523 2.352 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.654 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.666 0 O4'-C4'-C3' 108.275 2.675 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.503 ' C8 ' H2'' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.378 0 O4'-C4'-C3' 107.867 2.267 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.572 0 O4'-C4'-C3' 108.207 2.607 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . 0.483 ' N6 ' ' H71' ' A' ' 1' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.935 0 O4'-C1'-N19 109.392 1.99 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.512 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.5 m -162.5 -45.7 0.04 OUTLIER 'General case' 0 C--N 1.382 2.013 0 CA-C-N 113.664 -1.607 . . . . 0.0 108.612 168.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 169.97 23.29 0.0 OUTLIER 'General case' 0 C--N 1.396 2.595 0 CA-C-N 113.319 -1.764 . . . . 0.0 109.413 173.509 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 104' ' ' GLY . . . . . 0.759 ' O ' HD22 ' P' ' 105' ' ' LEU . . . 108.6 -80.73 0.27 Allowed Glycine 0 C--N 1.38 2.974 0 N-CA-C 108.806 -1.718 . . . . 0.0 108.806 -164.272 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.759 HD22 ' O ' ' P' ' 104' ' ' GLY . 0.2 OUTLIER -177.45 153.14 0.98 Allowed Pre-proline 0 CA--C 1.582 2.182 0 CA-C-N 113.735 -1.232 . . . . 0.0 108.637 -161.697 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 106' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.8 92.77 0.02 OUTLIER 'Trans proline' 0 C--N 1.398 3.151 0 C-N-CA 122.883 2.389 . . . . 0.0 110.373 155.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -100.96 -175.22 2.82 Favored 'General case' 0 C--N 1.382 1.998 0 CA-C-O 122.441 1.115 . . . . 0.0 109.159 165.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 108' ' ' LYS . . . . . 0.79 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.2 OUTLIER -153.58 127.14 8.69 Favored 'General case' 0 C--N 1.382 1.982 0 CA-C-N 113.688 -1.596 . . . . 0.0 108.195 -175.242 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.652 ' HE3' ' H ' ' P' ' 110' ' ' ARG . 0.1 OUTLIER -66.03 162.59 19.11 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-N 113.747 -1.57 . . . . 0.0 109.132 -164.777 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.79 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.8 OUTLIER -126.19 92.74 3.64 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 113.826 -1.533 . . . . 0.0 109.267 -155.277 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.843 ' HE3' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -123.59 108.37 12.53 Favored 'General case' 0 C--N 1.381 1.941 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.666 154.85 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 112' ' ' ARG . . . . . 0.575 ' O ' HG22 ' P' ' 114' ' ' VAL . 1.9 mtp85 -103.35 -176.45 3.09 Favored 'General case' 0 C--N 1.381 1.961 0 CA-C-N 113.595 -1.639 . . . . 0.0 108.915 166.027 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 1.064 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.0 OUTLIER -69.57 88.99 0.51 Allowed 'General case' 0 C--N 1.394 2.54 0 N-CA-C 105.112 -2.181 . . . . 0.0 105.112 155.439 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.575 ' N ' HD23 ' P' ' 115' ' ' LEU . 0.1 OUTLIER -98.13 54.46 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.39 2.328 0 CA-C-O 126.0 2.809 . . . . 0.0 107.834 -167.343 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 1.064 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.1 OUTLIER -77.51 107.55 10.04 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 110.453 -3.067 . . . . 0.0 109.524 -155.249 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.55 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.2 m-85 -76.07 140.96 42.14 Favored 'General case' 0 C--N 1.392 2.441 0 CA-C-N 112.315 -2.221 . . . . 0.0 107.905 -163.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.55 147.41 53.46 Favored 'General case' 0 C--N 1.381 1.964 0 N-CA-C 107.543 -1.281 . . . . 0.0 107.543 -166.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' P' ' 122' ' ' TYR . 33.7 ttmt -41.72 -36.24 0.95 Allowed 'General case' 0 C--N 1.381 1.957 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.283 -176.694 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.1 -68.75 0.16 Allowed 'General case' 0 C--N 1.382 2.013 0 CA-C-O 124.329 2.014 . . . . 0.0 109.14 173.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.552 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.8 mt-30 -46.79 -50.11 18.81 Favored 'General case' 0 C--N 1.383 2.056 0 CA-C-N 112.356 -2.202 . . . . 0.0 109.855 176.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.628 ' HA ' HD12 ' P' ' 124' ' ' LEU . 18.7 m -51.18 -55.92 15.44 Favored 'General case' 0 C--N 1.383 2.05 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 170.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.616 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.8 t80 -52.99 -46.38 68.29 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-O 122.34 1.067 . . . . 0.0 110.194 -171.203 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.691 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.3 OUTLIER -66.42 -39.5 88.99 Favored 'General case' 0 C--N 1.379 1.88 0 CA-C-N 114.455 -1.248 . . . . 0.0 107.759 179.494 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.856 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.7 mt -60.84 -49.11 78.8 Favored 'General case' 0 C--N 1.385 2.136 0 O-C-N 120.592 -1.317 . . . . 0.0 109.953 173.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' P' ' 129' ' ' ARG . 17.8 mt-10 -53.74 -55.37 26.87 Favored 'General case' 0 C--N 1.38 1.895 0 CA-C-O 122.354 1.073 . . . . 0.0 108.841 175.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.616 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.82 -66.56 0.29 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 111.918 -2.401 . . . . 0.0 108.677 178.785 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.555 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.7 OUTLIER -61.09 -33.31 73.14 Favored 'General case' 0 C--N 1.394 2.503 0 CA-C-N 112.427 -2.17 . . . . 0.0 108.384 -173.416 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.727 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 13.8 t80 -67.5 -50.99 56.34 Favored 'General case' 0 C--N 1.387 2.23 0 O-C-N 121.195 -0.941 . . . . 0.0 110.29 174.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.493 ' HA ' ' NE ' ' P' ' 129' ' ' ARG . 0.1 OUTLIER -62.58 -12.56 23.59 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-N 112.916 -1.947 . . . . 0.0 108.158 -165.996 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -108.62 -39.67 5.32 Favored 'General case' 0 C--N 1.38 1.909 0 C-N-CA 126.383 1.873 . . . . 0.0 108.251 -170.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.481 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -151.79 110.24 3.77 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 112.051 -2.34 . . . . 0.0 108.861 -153.237 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -76.78 -20.28 56.63 Favored 'General case' 0 C--N 1.392 2.441 0 CA-C-N 112.23 -2.259 . . . . 0.0 110.738 -168.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.411 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 33.0 m-85 -161.02 114.18 1.97 Allowed 'General case' 0 C--N 1.379 1.887 0 CA-C-N 113.812 -1.54 . . . . 0.0 108.298 -153.255 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.627 HD22 ' HG3' ' P' ' 138' ' ' GLU . 26.4 mt -124.91 137.04 54.29 Favored 'General case' 0 C--N 1.399 2.753 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -159.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.35 154.84 26.27 Favored 'General case' 0 C--N 1.381 1.95 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 166.266 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.513 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.68 -49.36 92.28 Favored Pre-proline 0 CA--C 1.583 2.242 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.248 -161.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.513 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 82.7 Cg_exo -58.05 -28.89 85.09 Favored 'Trans proline' 0 C--N 1.4 3.286 0 C-N-CA 121.183 1.255 . . . . 0.0 114.956 -174.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.627 ' HG3' HD22 ' P' ' 134' ' ' LEU . 1.4 mm-40 -54.04 -70.78 0.09 Allowed 'General case' 0 C--N 1.379 1.883 0 CA-C-O 124.786 2.231 . . . . 0.0 106.308 160.509 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.903 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.25 -40.47 81.93 Favored 'General case' 0 C--N 1.39 2.328 0 CA-C-N 109.88 -3.327 . . . . 0.0 108.794 -155.14 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.649 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 5.0 mt-10 -53.24 -38.24 62.8 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-O 123.125 1.441 . . . . 0.0 108.294 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -65.18 -35.6 81.6 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 112.955 -1.93 . . . . 0.0 108.728 -172.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.583 ' O ' HG23 ' P' ' 146' ' ' ILE . 2.9 tp -64.37 -43.14 95.44 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-O 123.277 1.513 . . . . 0.0 108.976 167.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.649 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.86 -34.61 67.99 Favored 'General case' 0 C--N 1.39 2.351 0 CA-C-N 112.29 -2.232 . . . . 0.0 108.613 176.249 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.59 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.9 OUTLIER -73.83 -44.04 56.89 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.142 -179.587 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 74.7 mt -65.54 -46.75 78.33 Favored 'General case' 0 C--N 1.379 1.859 0 CA-C-O 124.866 2.27 . . . . 0.0 107.88 -163.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 1.029 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.99 -17.65 6.85 Favored 'Isoleucine or valine' 0 C--N 1.384 2.108 0 CA-C-N 110.435 -3.075 . . . . 0.0 107.664 -171.101 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 80.93 37.44 0.09 Allowed 'General case' 0 C--N 1.385 2.141 0 CA-C-N 111.397 -2.638 . . . . 0.0 108.158 152.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 1.029 HD12 HD11 ' P' ' 146' ' ' ILE . 6.0 mt -95.05 168.71 10.6 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-N 112.121 -2.308 . . . . 0.0 109.308 168.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.648 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.4 p -88.29 143.48 32.69 Favored Pre-proline 0 CA--C 1.587 2.375 0 CA-C-O 122.862 1.315 . . . . 0.0 108.137 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -37.35 86.91 Favored 'Trans proline' 1 C--N 1.414 4.001 0 C-N-CA 122.634 2.223 . . . . 0.0 111.926 -155.743 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 151' ' ' THR . . . . . 0.422 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.2 OUTLIER -56.69 -33.1 66.09 Favored 'General case' 0 C--N 1.386 2.174 0 C-N-CA 119.657 -0.817 . . . . 0.0 110.059 167.644 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.648 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.8 mt-30 -72.8 -26.97 61.7 Favored 'General case' 0 C--N 1.388 2.269 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.619 HG12 ' N ' ' P' ' 154' ' ' LYS . 0.9 OUTLIER -64.29 -69.78 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.084 0 CA-C-N 121.789 2.086 . . . . 0.0 109.229 164.39 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.903 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -35.55 -60.13 0.52 Allowed 'General case' 0 C--N 1.386 2.153 0 C-N-CA 125.194 1.398 . . . . 0.0 110.462 -176.852 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.667 HG21 " H5'" ' A' ' 8' ' ' ' DA' . 4.3 mm -58.95 -37.38 66.99 Favored 'Isoleucine or valine' 0 C--N 1.384 2.106 0 CA-C-N 112.889 -1.96 . . . . 0.0 110.841 -174.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.856 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.5 t90 -67.38 -32.17 72.91 Favored 'General case' 0 C--N 1.381 1.959 0 O-C-N 120.369 -1.457 . . . . 0.0 109.21 169.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.727 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 44.0 m-85 -75.51 -43.79 47.18 Favored 'General case' 0 C--O 1.276 2.497 0 O-C-N 120.713 -1.242 . . . . 0.0 111.823 175.138 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' P' ' 154' ' ' LYS . 46.3 mt-30 -50.68 -58.25 6.33 Favored 'General case' 0 C--N 1.377 1.784 0 O-C-N 118.994 -2.316 . . . . 0.0 107.292 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -54.93 -29.92 57.38 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-O 117.957 -1.02 . . . . 0.0 108.917 -169.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.552 ' HB3' ' CE1' ' P' ' 128' ' ' PHE . 0.6 OUTLIER -77.58 -41.12 39.91 Favored 'General case' 0 C--O 1.285 2.972 0 CA-C-N 121.562 1.983 . . . . 0.0 111.667 -174.892 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.783 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -65.99 -42.38 89.85 Favored 'General case' 0 C--O 1.266 1.963 0 CA-C-N 122.995 2.634 . . . . 0.0 108.482 -170.715 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 162' ' ' TYR . . . . . 0.429 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 40.6 t80 -66.47 -28.02 68.25 Favored 'General case' 0 C--N 1.381 1.962 0 O-C-N 119.957 -1.715 . . . . 0.0 110.109 171.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 163' ' ' LYS . . . . . 0.415 ' HD2' ' CD2' ' P' ' 160' ' ' HIS . 7.7 ttmm -65.63 -34.54 78.45 Favored 'General case' 0 C--N 1.382 1.986 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 -174.744 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.783 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.4 OUTLIER -70.38 -57.48 4.78 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 125.808 2.718 . . . . 0.0 105.576 -165.917 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.414 ' CD ' ' O ' ' P' ' 161' ' ' ARG . 8.8 mtpt -57.58 -45.42 85.25 Favored 'General case' 0 C--N 1.389 2.312 1 CA-C-N 108.368 -4.015 . . . . 0.0 108.903 -171.14 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 166' ' ' ARG . . . . . 0.408 ' HG2' HH11 ' P' ' 166' ' ' ARG . 0.0 OUTLIER -56.52 -40.59 75.31 Favored 'General case' 0 C--N 1.38 1.892 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.817 -178.351 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -61.69 -33.47 74.06 Favored 'General case' 0 C--N 1.384 2.072 0 CA-C-O 124.157 1.932 . . . . 0.0 109.319 -177.384 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -85.31 -18.33 34.2 Favored 'General case' 0 C--N 1.39 2.357 0 CA-C-N 112.119 -2.31 . . . . 0.0 109.744 -174.297 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -51.51 -32.06 26.25 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 122.98 1.372 . . . . 0.0 109.372 166.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -80.04 -31.65 39.51 Favored 'General case' 0 C--N 1.379 1.885 0 CA-C-N 112.719 -2.037 . . . . 0.0 107.946 -161.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 3.6 mttm -101.38 14.69 31.2 Favored 'General case' 0 C--N 1.38 1.924 0 CA-C-O 125.045 2.355 . . . . 0.0 110.691 -176.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . -151.55 65.39 0.36 Allowed Glycine 0 C--N 1.39 3.542 0 CA-C-N 110.254 -3.157 . . . . 0.0 108.734 152.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -47.34 143.77 3.24 Favored 'General case' 0 C--N 1.384 2.077 0 CA-C-O 124.259 1.981 . . . . 0.0 108.12 -176.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -148.9 97.08 2.66 Favored 'General case' 0 C--N 1.403 2.905 0 CA-C-N 111.188 -2.733 . . . . 0.0 107.586 -158.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -168.77 -99.29 0.13 Allowed Glycine 0 C--N 1.377 2.859 0 CA-C-N 122.833 2.56 . . . . 0.0 109.961 155.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 17.7 t60 -55.78 116.9 13.34 Favored Pre-proline 0 C--N 1.386 2.194 0 CA-C-N 113.12 -1.54 . . . . 0.0 107.252 -156.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo . . . . . 0 CA--C 1.593 3.459 0 C-N-CA 121.736 1.624 . . . . 0.0 111.627 179.746 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.638 0 O5'-C5'-C4' 114.322 2.944 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.772 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.635 0 O4'-C4'-C3' 108.159 2.559 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.772 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.569 4.12 1 P-O3'-C3' 130.652 9.127 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.561 ' C8 ' H2'' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.562 3.363 1 P-O3'-C3' 134.433 12.277 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.515 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.806 0 P-O3'-C3' 123.712 3.344 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.566 H2'' ' C8 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.918 0 N19-C1'-C2' 118.893 2.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 1.058 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.659 0 O4'-C4'-C3' 108.484 2.884 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 1.058 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.442 0 C4'-C3'-C2' 99.719 -3.481 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.714 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.669 0 C4'-C3'-C2' 99.849 -3.351 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.631 ' H71' " H2'" ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.842 1 P-O3'-C3' 125.255 4.629 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.533 H2'' ' C8 ' ' A' ' 12' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.345 0 P-O3'-C3' 122.863 2.636 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . 0.533 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.332 0 P-O3'-C3' 122.786 2.572 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.504 H2'' " H5'" ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.525 0 O4'-C4'-C3' 108.293 2.693 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.806 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.597 0 O4'-C4'-C3' 108.369 2.769 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.809 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.92 0 O4'-C1'-N19 110.969 3.962 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.809 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.547 0 P-O3'-C3' 124.452 3.96 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . 0.434 " H1'" " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.676 0 O5'-C5'-C4' 115.031 3.451 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.442 H2'' H5'' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.884 1 P-O3'-C3' 126.486 5.655 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.442 H5'' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.562 3.419 0 P-O3'-C3' 122.738 2.531 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.48 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.365 0 O4'-C4'-C3' 107.972 2.372 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.889 H2'' H5'' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.572 4.416 0 O4'-C1'-N19 105.093 -3.384 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.889 H5'' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.561 4.28 1 P-O3'-C3' 127.538 6.531 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.568 ' OP2' ' HD1' ' P' ' 162' ' ' TYR . . . . . . . . 0 C5'--C4' 1.538 3.361 0 P-O3'-C3' 123.654 3.295 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.503 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.602 0 O4'-C4'-C3' 108.569 2.969 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.493 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.569 4.116 0 P-O3'-C3' 123.499 3.166 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.553 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.22 0 N19-C1'-C2' 119.354 3.221 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.553 ' C8 ' H2'' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.554 3.649 0 P-O3'-C3' 123.506 3.172 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.545 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.452 0 C4'-C3'-C2' 100.716 -2.484 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.402 ' O2 ' ' N2 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.568 4.009 0 P-O3'-C3' 123.232 2.943 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.601 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.318 0 O4'-C4'-C3' 107.921 2.321 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.601 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.478 0 O4'-C4'-C3' 108.611 3.011 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.852 0 O4'-C1'-N19 109.364 1.955 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.487 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 2.9 p -132.68 162.06 32.36 Favored 'General case' 0 C--N 1.382 2.018 0 CA-C-N 113.675 -1.602 . . . . 0.0 108.653 -174.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 170.27 -38.37 0.0 OUTLIER 'General case' 0 C--N 1.388 2.272 0 CA-C-N 113.542 -1.663 . . . . 0.0 107.976 -171.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -174.09 -143.07 4.2 Favored Glycine 0 C--N 1.381 3.04 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -162.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.794 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.0 OUTLIER -131.5 174.8 4.27 Favored Pre-proline 0 CA--C 1.582 2.203 0 CA-C-N 113.69 -1.255 . . . . 0.0 108.738 175.328 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.794 ' HD2' HD13 ' P' ' 105' ' ' LEU . 59.1 Cg_exo -48.04 92.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.126 0 C-N-CA 122.986 2.457 . . . . 0.0 110.322 155.37 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.53 167.52 12.3 Favored 'General case' 0 C--N 1.382 1.981 0 CA-C-O 122.424 1.107 . . . . 0.0 109.13 158.002 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 108' ' ' LYS . . . . . 0.569 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -154.6 -48.12 0.09 Allowed 'General case' 0 C--N 1.383 2.031 0 CA-C-N 113.78 -1.554 . . . . 0.0 108.164 -166.666 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.55 ' C ' ' HD3' ' P' ' 110' ' ' ARG . 2.2 tptt -86.68 161.32 18.51 Favored 'General case' 0 C--N 1.379 1.891 0 CA-C-N 113.76 -1.564 . . . . 0.0 109.434 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.569 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.0 OUTLIER -143.43 108.04 4.85 Favored 'General case' 0 C--N 1.382 2.008 0 CA-C-N 113.72 -1.582 . . . . 0.0 108.656 -163.246 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.626 ' HG2' ' O ' ' P' ' 111' ' ' LYS . 0.1 OUTLIER -103.45 97.86 7.84 Favored 'General case' 0 C--N 1.381 1.957 0 CA-C-N 113.651 -1.613 . . . . 0.0 107.771 166.276 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 68.0 mtt85 -52.93 162.78 0.57 Allowed 'General case' 0 C--N 1.384 2.107 0 CA-C-N 113.25 -1.795 . . . . 0.0 108.664 155.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.949 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.6 OUTLIER -84.96 116.47 23.39 Favored 'General case' 0 C--N 1.384 2.104 0 CA-C-N 113.779 -1.555 . . . . 0.0 107.014 161.849 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 114' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.4 67.39 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.171 0 CA-C-O 125.555 2.597 . . . . 0.0 107.975 -161.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.949 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.08 108.44 8.99 Favored 'General case' 0 C--N 1.391 2.387 0 CA-C-N 111.534 -2.575 . . . . 0.0 109.378 -158.824 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.664 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 0.6 OUTLIER -76.57 144.98 39.29 Favored 'General case' 0 C--N 1.391 2.384 0 CA-C-N 112.593 -2.094 . . . . 0.0 107.8 -171.996 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.93 148.97 50.53 Favored 'General case' 0 C--N 1.383 2.024 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 -171.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' P' ' 122' ' ' TYR . 19.8 ttmt -33.21 -50.07 0.28 Allowed 'General case' 0 C--N 1.383 2.063 0 O-C-N 126.883 2.614 . . . . 0.0 108.268 174.259 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.66 -58.11 5.92 Favored 'General case' 0 C--N 1.385 2.109 0 CA-C-N 111.424 -2.625 . . . . 0.0 109.165 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.542 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.7 mt-30 -59.83 -46.57 88.83 Favored 'General case' 0 C--N 1.381 1.969 0 CA-C-N 112.434 -2.166 . . . . 0.0 109.464 -178.148 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.575 ' HA ' HD12 ' P' ' 124' ' ' LEU . 3.3 m -47.64 -57.6 5.29 Favored 'General case' 0 C--N 1.386 2.155 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 166.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.667 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.34 -48.52 68.44 Favored 'General case' 0 C--N 1.382 1.997 0 CA-C-O 122.587 1.184 . . . . 0.0 109.904 -167.573 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.703 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.6 OUTLIER -66.2 -37.95 86.79 Favored 'General case' 0 C--N 1.378 1.83 0 CA-C-N 114.032 -1.44 . . . . 0.0 107.856 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.81 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.0 mt -60.7 -50.88 71.69 Favored 'General case' 0 C--N 1.384 2.105 0 O-C-N 120.52 -1.362 . . . . 0.0 109.604 171.378 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' P' ' 129' ' ' ARG . 9.3 mt-10 -55.47 -50.18 70.57 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-O 122.418 1.104 . . . . 0.0 109.48 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.667 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.65 -69.79 0.12 Allowed 'General case' 0 C--N 1.378 1.845 0 CA-C-N 111.872 -2.422 . . . . 0.0 108.719 176.211 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.724 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.5 OUTLIER -59.31 -36.0 74.83 Favored 'General case' 0 C--N 1.391 2.373 0 CA-C-N 112.778 -2.01 . . . . 0.0 108.343 -171.969 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.813 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 25.7 t80 -70.31 -46.92 63.27 Favored 'General case' 0 C--N 1.381 1.966 0 CA-C-N 119.148 0.886 . . . . 0.0 110.338 178.099 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.5 mmp_? -62.51 -15.95 53.15 Favored 'General case' 0 C--N 1.381 1.937 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -168.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -104.51 -39.44 6.41 Favored 'General case' 0 C--N 1.379 1.878 0 C-N-CA 126.592 1.957 . . . . 0.0 107.383 -169.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.503 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -156.21 98.71 1.88 Allowed 'General case' 0 C--N 1.388 2.24 0 CA-C-N 111.759 -2.473 . . . . 0.0 109.223 -153.5 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 132' ' ' ARG . . . . . 0.519 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 0.4 OUTLIER -77.32 -11.79 59.88 Favored 'General case' 0 C--N 1.388 2.257 0 CA-C-N 111.784 -2.462 . . . . 0.0 110.466 -164.845 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.677 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 3.4 m-30 -154.12 110.81 3.34 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.362 -162.161 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.724 HD11 ' CD ' ' P' ' 127' ' ' ARG . 19.5 mt -121.33 140.01 52.66 Favored 'General case' 0 C--N 1.396 2.63 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -162.413 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.46 160.56 23.95 Favored 'General case' 0 C--N 1.382 1.983 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 164.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.558 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.35 -51.63 80.42 Favored Pre-proline 0 CA--C 1.585 2.312 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -166.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 71.4 Cg_exo -58.16 -29.99 89.1 Favored 'Trans proline' 0 C--N 1.399 3.229 0 N-CA-C 115.387 1.264 . . . . 0.0 115.387 -172.679 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.629 ' CB ' HD22 ' P' ' 134' ' ' LEU . 15.7 mp0 -58.72 -66.18 0.54 Allowed 'General case' 0 C--N 1.381 1.942 0 CA-C-O 124.866 2.27 . . . . 0.0 105.468 163.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.765 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -67.64 -41.66 83.53 Favored 'General case' 0 C--N 1.391 2.382 0 CA-C-N 109.659 -3.428 . . . . 0.0 108.71 -153.797 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.611 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 0.7 OUTLIER -53.19 -38.05 62.49 Favored 'General case' 0 C--N 1.381 1.94 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.915 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -65.39 -39.08 91.78 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.226 -1.807 . . . . 0.0 109.051 -172.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.63 ' O ' HG23 ' P' ' 146' ' ' ILE . 0.5 OUTLIER -55.57 -46.21 77.23 Favored 'General case' 0 C--N 1.387 2.212 0 CA-C-O 123.256 1.503 . . . . 0.0 108.515 167.447 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.611 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.44 -35.69 81.27 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 111.738 -2.483 . . . . 0.0 108.967 -178.604 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.579 ' N ' ' O ' ' P' ' 140' ' ' GLU . 4.0 m -73.37 -37.6 65.98 Favored 'General case' 0 C--N 1.387 2.217 0 CA-C-N 114.087 -1.415 . . . . 0.0 109.651 -176.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 37.7 mt -67.3 -49.05 65.77 Favored 'General case' 0 C--N 1.382 1.995 0 CA-C-O 124.492 2.092 . . . . 0.0 108.694 -167.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.974 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.43 -13.54 8.21 Favored 'Isoleucine or valine' 0 C--N 1.389 2.308 0 CA-C-N 110.943 -2.844 . . . . 0.0 108.031 -167.649 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 147' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' P' ' 147' ' ' ARG . 0.0 OUTLIER 82.41 35.62 0.07 Allowed 'General case' 0 C--N 1.382 2.019 0 CA-C-O 125.853 2.74 . . . . 0.0 107.668 153.549 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.974 HD12 HD11 ' P' ' 146' ' ' ILE . 7.6 mt -95.95 172.44 8.01 Favored 'General case' 0 C--N 1.396 2.63 0 CA-C-N 111.472 -2.604 . . . . 0.0 109.352 166.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.565 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -89.09 143.59 31.4 Favored Pre-proline 0 CA--C 1.586 2.333 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 167.605 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.594 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 72.4 Cg_exo -51.4 -46.05 33.76 Favored 'Trans proline' 0 C--N 1.408 3.689 0 C-N-CA 124.252 3.301 . . . . 0.0 114.673 -165.083 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.71 -33.69 48.92 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-N 112.163 -2.29 . . . . 0.0 109.507 170.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.565 ' N ' ' O ' ' P' ' 149' ' ' THR . 48.1 mt-30 -72.5 -28.27 62.77 Favored 'General case' 0 C--N 1.392 2.43 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.73 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.2 t -64.61 -71.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.026 0 CA-C-N 121.798 2.09 . . . . 0.0 109.814 163.301 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.765 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.23 -57.78 0.4 Allowed 'General case' 0 C--N 1.388 2.254 0 C-N-CA 124.466 1.106 . . . . 0.0 110.364 -177.581 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.532 HG21 " H5'" ' A' ' 8' ' ' ' DA' . 9.9 mm -59.89 -40.22 82.21 Favored 'Isoleucine or valine' 0 C--N 1.382 1.995 0 CA-C-N 113.311 -1.768 . . . . 0.0 109.47 -173.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.81 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.3 t90 -67.45 -31.33 71.43 Favored 'General case' 0 C--N 1.381 1.965 0 O-C-N 121.182 -0.949 . . . . 0.0 109.231 172.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.813 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 66.3 m-85 -74.65 -40.19 61.61 Favored 'General case' 0 C--O 1.273 2.34 0 O-C-N 121.526 -0.734 . . . . 0.0 111.956 173.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.451 ' N ' ' O ' ' P' ' 154' ' ' LYS . 23.8 mt-30 -49.86 -63.62 1.06 Allowed 'General case' 0 C--N 1.378 1.823 0 O-C-N 119.47 -2.018 . . . . 0.0 106.821 167.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -56.7 -19.29 15.84 Favored 'General case' 0 C--N 1.388 2.28 0 CA-C-O 117.907 -1.044 . . . . 0.0 110.446 -164.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.528 ' ND1' ' CZ ' ' P' ' 128' ' ' PHE . 14.7 t-80 -76.48 -52.51 9.67 Favored 'General case' 0 C--O 1.279 2.639 0 CA-C-N 120.743 1.61 . . . . 0.0 111.084 171.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.677 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -66.52 -36.31 82.39 Favored 'General case' 0 C--O 1.266 1.921 0 CA-C-N 122.535 2.425 . . . . 0.0 111.06 -158.726 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 162' ' ' TYR . . . . . 0.568 ' HD1' ' OP2' ' B' ' 23' ' ' ' DA' . 21.9 t80 -68.51 -36.15 78.49 Favored 'General case' 0 C--N 1.38 1.934 0 O-C-N 120.022 -1.674 . . . . 0.0 109.381 174.161 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -65.75 -42.92 90.35 Favored 'General case' 0 C--N 1.381 1.957 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -170.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.593 ' O ' ' HB3' ' P' ' 167' ' ' ALA . 0.5 OUTLIER -57.09 -60.34 3.75 Favored 'General case' 0 C--N 1.379 1.87 0 CA-C-O 124.534 2.112 . . . . 0.0 106.7 -170.142 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.417 ' HG2' HG23 ' P' ' 164' ' ' THR . 9.1 mmmt -59.45 -49.61 77.12 Favored 'General case' 0 C--N 1.385 2.121 0 CA-C-N 108.499 -3.955 . . . . 0.0 109.256 -165.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 166' ' ' ARG . . . . . 0.456 ' HB2' ' CE1' ' P' ' 162' ' ' TYR . 0.0 OUTLIER -58.77 -29.26 66.65 Favored 'General case' 0 C--N 1.382 2.007 0 CA-C-N 112.221 -2.263 . . . . 0.0 108.152 -178.749 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.593 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -67.6 -35.88 79.8 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.079 -176.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.68 -19.86 44.25 Favored 'General case' 0 C--N 1.387 2.224 0 CA-C-N 112.208 -2.269 . . . . 0.0 109.204 -173.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.1 -32.78 71.3 Favored 'General case' 0 C--N 1.382 1.98 0 CA-C-O 122.717 1.246 . . . . 0.0 108.799 169.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -64.09 -35.85 82.1 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.88 -169.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -96.19 93.16 6.76 Favored 'General case' 0 C--N 1.381 1.961 0 CA-C-N 113.638 -1.619 . . . . 0.0 109.388 -162.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 121.05 -49.15 0.9 Allowed Glycine 0 C--N 1.382 3.119 0 N-CA-C 108.737 -1.745 . . . . 0.0 108.737 -161.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 119.04 172.77 0.0 OUTLIER 'General case' 0 C--N 1.382 2.004 0 CA-C-N 113.011 -1.594 . . . . 0.0 108.834 161.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -82.84 67.76 9.04 Favored 'General case' 0 C--N 1.38 1.929 0 CA-C-N 112.343 -2.208 . . . . 0.0 109.015 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 80.08 135.46 1.4 Allowed Glycine 0 C--N 1.384 3.223 0 O-C-N 120.065 -1.647 . . . . 0.0 109.954 155.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 44.4 p-80 -128.55 141.93 43.14 Favored Pre-proline 0 C--N 1.385 2.133 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 -165.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo . . . . . 0 CA--C 1.594 3.496 0 C-N-CA 121.518 1.479 . . . . 0.0 111.535 174.582 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.794 0 O5'-C5'-C4' 114.374 2.982 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.721 ' N1 ' ' N3 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.334 0 O4'-C4'-C3' 108.378 2.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.556 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.861 0 P-O3'-C3' 123.038 2.781 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.617 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.305 0 P-O3'-C3' 123.245 2.954 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.589 ' H73' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.838 0 N19-C1'-C2' 118.359 2.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.533 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.039 0 N19-C1'-C2' 118.729 2.831 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.916 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.552 1 P-O3'-C3' 124.861 4.301 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.916 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.448 0 C4'-C3'-C2' 100.233 -2.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.8 " C5'" H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.405 0 P-O3'-C3' 123.379 3.065 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.591 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.927 1 P-O3'-C3' 127.172 6.226 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.486 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.356 0 P-O3'-C3' 123.204 2.92 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . 0.473 H2'' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.354 0 P-O3'-C3' 122.704 2.503 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.861 " H2'" ' H71' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.561 0 O4'-C4'-C3' 108.418 2.818 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.861 ' H71' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.565 0 O4'-C4'-C3' 108.209 2.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.942 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.926 1 O4'-C1'-N19 111.301 4.376 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.942 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.516 0 P-O3'-C3' 122.217 2.098 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.764 0 O5'-C5'-C4' 115.045 3.461 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.534 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.595 1 P-O3'-C3' 125.11 4.509 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.534 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.417 0 O4'-C4'-C3' 108.211 2.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.552 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.409 0 O4'-C4'-C3' 108.042 2.442 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.552 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.571 4.336 0 N19-C1'-C2' 119.289 3.181 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.468 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.555 3.714 1 P-O3'-C3' 126.925 6.021 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.486 ' C2 ' ' C2 ' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.528 1 P-O3'-C3' 128.413 7.261 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.51 " C2'" " H5'" ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.477 0 O4'-C4'-C3' 108.228 2.628 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.631 ' C2 ' ' C4 ' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.802 0 O4'-C4'-C3' 107.992 2.392 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.631 ' C4 ' ' C2 ' ' B' ' 25' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.558 4.029 0 P-O3'-C3' 124.126 3.689 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.633 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.58 1 P-O3'-C3' 127.689 6.658 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.633 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.562 3.43 0 C4'-C3'-C2' 100.593 -2.607 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.617 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.922 0 O4'-C4'-C3' 108.602 3.002 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.598 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.366 1 P-O3'-C3' 127.822 6.768 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.721 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.587 0 O4'-C4'-C3' 108.218 2.618 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.933 0 O4'-C1'-N19 109.333 1.916 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.528 3.449 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 11.3 p -151.94 138.53 18.71 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 113.647 -1.615 . . . . 0.0 108.605 -170.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 170.64 -38.34 0.0 OUTLIER 'General case' 0 C--N 1.388 2.267 0 CA-C-N 113.531 -1.668 . . . . 0.0 108.037 172.11 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -121.48 66.77 0.45 Allowed Glycine 0 C--N 1.381 3.073 0 N-CA-C 108.914 -1.674 . . . . 0.0 108.914 -162.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 1.115 HD22 ' HD3' ' P' ' 106' ' ' PRO . 0.3 OUTLIER -173.84 172.29 1.43 Allowed Pre-proline 0 CA--C 1.583 2.231 0 CA-C-N 113.71 -1.245 . . . . 0.0 108.861 170.078 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 1.115 ' HD3' HD22 ' P' ' 105' ' ' LEU . 2.4 Cg_endo -83.49 73.06 5.31 Favored 'Trans proline' 0 C--N 1.395 3.008 0 C-N-CA 124.817 3.678 . . . . 0.0 111.2 -153.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 70.51 155.19 0.14 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-N 114.678 -1.147 . . . . 0.0 109.191 -170.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.88 68.04 0.76 Allowed 'General case' 0 C--N 1.382 2.01 0 CA-C-N 113.692 -1.594 . . . . 0.0 108.135 175.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.616 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 11.4 tttt -65.93 150.51 48.51 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-N 113.685 -1.598 . . . . 0.0 109.92 -171.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.616 ' HD3' ' O ' ' P' ' 109' ' ' LYS . 2.0 mmt85 -144.57 67.88 1.25 Allowed 'General case' 0 C--N 1.384 2.099 0 CA-C-N 113.666 -1.606 . . . . 0.0 109.555 -170.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.876 ' HD2' " H1'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -80.5 87.86 5.68 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-O 123.587 1.66 . . . . 0.0 108.073 163.365 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -81.32 -175.93 5.73 Favored 'General case' 0 C--N 1.39 2.361 0 CA-C-N 111.789 -2.46 . . . . 0.0 108.814 159.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 1.144 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.0 OUTLIER -76.07 108.01 8.67 Favored 'General case' 0 C--N 1.389 2.319 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 156.021 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.805 HG11 ' P ' ' A' ' 8' ' ' ' DA' . 0.8 OUTLIER -96.73 42.37 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.384 2.074 0 CA-C-O 126.649 3.119 . . . . 0.0 109.234 -159.072 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 1.144 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.1 OUTLIER -79.69 118.28 21.37 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 111.891 -2.413 . . . . 0.0 109.651 -155.52 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.496 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 3.2 m-85 -93.37 143.57 26.15 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-N 113.754 -1.566 . . . . 0.0 107.986 -173.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.24 148.11 52.32 Favored 'General case' 0 C--N 1.383 2.035 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 -171.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' P' ' 122' ' ' TYR . 34.4 ttmt -42.71 -36.09 1.33 Allowed 'General case' 0 C--N 1.382 2.003 0 CA-C-N 113.923 -1.489 . . . . 0.0 109.446 -177.422 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.87 -67.8 0.23 Allowed 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.148 -1.842 . . . . 0.0 109.161 173.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.561 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.2 mt-30 -49.9 -50.77 44.83 Favored 'General case' 0 C--N 1.382 1.986 0 CA-C-N 112.437 -2.165 . . . . 0.0 109.399 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.761 ' HA ' HD12 ' P' ' 124' ' ' LEU . 21.5 m -49.75 -56.86 8.68 Favored 'General case' 0 C--N 1.382 1.994 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 170.543 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.544 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 1.0 OUTLIER -53.23 -45.51 68.74 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 122.29 1.043 . . . . 0.0 109.74 -170.996 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.968 ' CD ' HG22 ' P' ' 146' ' ' ILE . 6.9 mt-10 -66.9 -38.56 86.48 Favored 'General case' 0 C--N 1.379 1.853 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.607 178.218 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.829 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.4 mt -60.71 -50.01 75.22 Favored 'General case' 0 C--N 1.382 2.005 0 O-C-N 119.62 -1.925 . . . . 0.0 109.9 171.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' P' ' 129' ' ' ARG . 20.1 mt-10 -55.75 -52.18 64.8 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-O 122.613 1.197 . . . . 0.0 109.55 177.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.544 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.38 -60.18 1.15 Allowed 'General case' 0 C--N 1.38 1.898 0 CA-C-N 112.128 -2.305 . . . . 0.0 109.362 176.032 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.817 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -70.5 -32.04 69.38 Favored 'General case' 0 C--N 1.397 2.638 0 CA-C-N 112.274 -2.239 . . . . 0.0 108.343 -167.097 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.765 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.3 t80 -67.94 -53.04 29.36 Favored 'General case' 0 C--N 1.384 2.072 0 CA-C-O 121.832 0.825 . . . . 0.0 109.397 170.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.411 ' N ' ' O ' ' P' ' 125' ' ' GLU . 19.6 mmm180 -62.72 -17.77 61.35 Favored 'General case' 0 C--N 1.379 1.888 0 CA-C-N 113.213 -1.812 . . . . 0.0 108.239 -163.462 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 130' ' ' GLN . . . . . 0.42 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 35.9 mt-30 -88.22 -51.68 5.63 Favored 'General case' 0 C--N 1.379 1.882 0 CA-C-O 123.811 1.767 . . . . 0.0 106.482 -179.494 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.31 125.5 4.43 Favored 'General case' 0 C--N 1.394 2.522 0 CA-C-N 112.19 -2.277 . . . . 0.0 110.843 -168.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 132' ' ' ARG . . . . . 0.657 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 3.7 ptt-85 -80.02 -6.52 57.74 Favored 'General case' 0 C--N 1.393 2.47 0 CA-C-N 111.774 -2.467 . . . . 0.0 111.318 -160.247 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.723 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 3.0 m-30 -148.27 115.01 6.03 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 125.297 2.475 . . . . 0.0 109.768 -161.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.553 HD22 ' HG3' ' P' ' 138' ' ' GLU . 67.2 mt -125.3 133.91 52.45 Favored 'General case' 0 C--N 1.415 3.425 0 O-C-N 119.851 -1.781 . . . . 0.0 108.826 -162.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.33 158.2 21.24 Favored 'General case' 0 C--N 1.381 1.978 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 168.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.575 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.15 -50.36 88.17 Favored Pre-proline 0 CA--C 1.584 2.285 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -161.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 77.7 Cg_exo -58.66 -28.86 87.61 Favored 'Trans proline' 0 C--N 1.401 3.338 0 N-CA-C 115.185 1.186 . . . . 0.0 115.185 -175.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.553 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -53.45 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.379 1.864 0 CA-C-O 124.295 1.997 . . . . 0.0 106.483 159.895 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 1.028 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.51 -34.87 74.93 Favored 'General case' 0 C--N 1.387 2.226 0 CA-C-N 109.919 -3.31 . . . . 0.0 109.159 -155.124 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.651 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 2.7 mt-10 -52.42 -42.94 64.52 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-O 123.493 1.616 . . . . 0.0 108.137 175.284 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -64.76 -35.67 81.82 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 112.501 -2.136 . . . . 0.0 108.97 -169.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.817 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.1 tp -65.91 -43.03 89.36 Favored 'General case' 0 C--N 1.382 1.998 0 CA-C-O 123.201 1.477 . . . . 0.0 109.163 168.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -55.34 -35.82 65.62 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.036 174.214 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.581 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.7 OUTLIER -72.43 -43.17 64.2 Favored 'General case' 0 C--N 1.389 2.29 0 CA-C-N 113.762 -1.563 . . . . 0.0 110.407 -178.113 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 81.3 mt -66.11 -44.87 83.05 Favored 'General case' 0 C--N 1.379 1.89 0 CA-C-O 124.838 2.256 . . . . 0.0 108.301 -164.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 1.01 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -98.83 -13.42 8.09 Favored 'Isoleucine or valine' 0 C--N 1.39 2.344 0 CA-C-N 110.905 -2.861 . . . . 0.0 108.064 -166.249 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 81.8 34.98 0.08 Allowed 'General case' 0 C--N 1.381 1.975 0 CA-C-O 125.586 2.612 . . . . 0.0 107.946 153.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 1.01 HD12 HD11 ' P' ' 146' ' ' ILE . 8.6 mt -95.63 172.36 8.1 Favored 'General case' 0 C--N 1.396 2.593 0 CA-C-N 111.47 -2.605 . . . . 0.0 109.078 167.31 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.586 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.1 p -91.27 141.53 26.29 Favored Pre-proline 0 CA--C 1.589 2.454 0 CA-C-O 122.795 1.283 . . . . 0.0 108.264 166.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.538 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 0.3 OUTLIER -48.21 -46.99 20.94 Favored 'Trans proline' 0 C--N 1.403 3.429 0 C-N-CA 124.934 3.756 . . . . 0.0 115.404 -167.289 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 151' ' ' THR . . . . . 0.465 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -52.85 -30.55 34.39 Favored 'General case' 0 C--N 1.383 2.065 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.112 169.278 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.586 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.3 mt-30 -73.87 -30.58 62.72 Favored 'General case' 0 C--N 1.391 2.401 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 179.407 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.696 HG13 ' CD2' ' P' ' 157' ' ' PHE . 0.9 OUTLIER -64.07 -67.05 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.382 2.018 0 CA-C-N 122.011 2.187 . . . . 0.0 109.743 165.803 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 1.028 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -32.93 -60.08 0.33 Allowed 'General case' 0 C--N 1.387 2.201 0 C-N-CA 124.615 1.166 . . . . 0.0 110.845 -177.254 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.697 HG21 " C5'" ' A' ' 8' ' ' ' DA' . 37.5 mm -64.78 -34.94 73.5 Favored 'Isoleucine or valine' 0 C--N 1.382 2.01 0 CA-C-N 112.794 -2.003 . . . . 0.0 108.756 -169.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.829 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.1 t90 -67.47 -33.07 74.37 Favored 'General case' 0 C--N 1.384 2.109 0 O-C-N 121.691 -0.631 . . . . 0.0 109.353 168.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.765 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 39.2 m-85 -74.89 -41.71 59.24 Favored 'General case' 0 C--O 1.272 2.272 0 O-C-N 120.966 -1.084 . . . . 0.0 111.94 174.599 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' P' ' 154' ' ' LYS . 77.3 mt-30 -50.98 -59.8 3.77 Favored 'General case' 0 C--N 1.377 1.77 0 O-C-N 119.785 -1.822 . . . . 0.0 106.703 170.016 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -56.5 -20.28 19.57 Favored 'General case' 0 C--N 1.389 2.314 0 CA-C-O 117.409 -1.281 . . . . 0.0 110.333 -168.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.561 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.8 OUTLIER -76.39 -50.35 14.42 Favored 'General case' 0 C--O 1.282 2.816 0 CA-C-N 121.2 1.818 . . . . 0.0 110.313 174.666 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.723 ' HD3' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -67.5 -34.13 76.5 Favored 'General case' 0 C--O 1.267 2.019 0 CA-C-N 122.784 2.538 . . . . 0.0 111.166 -158.431 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -69.02 -40.21 78.79 Favored 'General case' 0 C--N 1.381 1.935 0 O-C-N 119.89 -1.756 . . . . 0.0 109.104 171.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -37.98 89.41 Favored 'General case' 0 C--N 1.382 1.997 0 O-C-N 121.322 -0.862 . . . . 0.0 109.016 -166.051 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.569 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -51.59 -61.74 2.06 Favored 'General case' 0 C--N 1.379 1.86 0 CA-C-O 124.699 2.19 . . . . 0.0 106.729 -175.715 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.504 ' HG2' HG23 ' P' ' 164' ' ' THR . 6.0 mmmt -59.15 -47.62 84.61 Favored 'General case' 0 C--N 1.385 2.143 1 CA-C-N 108.361 -4.018 . . . . 0.0 108.085 -159.322 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -54.67 -42.55 71.51 Favored 'General case' 0 C--N 1.381 1.938 0 CA-C-N 112.475 -2.148 . . . . 0.0 109.336 -178.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.41 -30.66 71.75 Favored 'General case' 0 C--N 1.384 2.068 0 CA-C-O 124.464 2.078 . . . . 0.0 109.322 -175.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.81 -21.91 31.97 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.344 -2.207 . . . . 0.0 110.074 -176.395 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -52.93 -32.53 46.17 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-O 123.944 1.831 . . . . 0.0 109.94 167.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -78.97 -33.68 44.94 Favored 'General case' 0 C--N 1.381 1.939 0 CA-C-N 112.141 -2.3 . . . . 0.0 107.466 -155.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.31 87.37 0.83 Allowed 'General case' 0 C--N 1.382 1.984 0 CA-C-N 113.506 -1.679 . . . . 0.0 108.916 -160.03 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 172' ' ' GLY . . . . . 0.463 ' C ' ' CG ' ' P' ' 173' ' ' TYR . . . 110.14 -93.2 0.73 Allowed Glycine 0 C--N 1.382 3.094 0 N-CA-C 108.607 -1.797 . . . . 0.0 108.607 -154.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 173' ' ' TYR . . . . . 0.463 ' CG ' ' C ' ' P' ' 172' ' ' GLY . 0.0 OUTLIER 176.89 144.1 0.09 Allowed 'General case' 0 C--N 1.382 2.001 0 CA-C-N 113.464 -1.368 . . . . 0.0 109.289 -177.555 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -166.29 157.96 13.57 Favored 'General case' 0 C--N 1.386 2.163 0 CA-C-N 113.282 -1.781 . . . . 0.0 107.299 155.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 122.47 -98.51 0.63 Allowed Glycine 0 C--N 1.381 3.051 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 -154.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.99 160.63 0.47 Allowed Pre-proline 0 CA--C 1.58 2.12 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 178.568 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_exo . . . . . 0 CA--C 1.594 3.516 0 C-N-CA 121.512 1.475 . . . . 0.0 111.59 175.444 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . 0.4 ' H72' ' O6 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.561 3.328 0 O5'-C5'-C4' 115.303 3.645 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.556 " C2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.546 4.426 0 O5'-C5'-C4' 115.434 3.739 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.638 ' O4 ' ' N6 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.04 0 O5'-C5'-C4' 114.508 3.077 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.638 ' N2 ' ' O2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.548 4.644 0 O5'-C5'-C4' 115.157 3.54 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.461 H2'' ' C6 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.543 4.056 0 P-O3'-C3' 123.878 3.482 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.579 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.543 3.994 0 C3'-C2'-C1' 107.278 3.27 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.579 ' C6 ' ' C5 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 2 C5'--C4' 1.547 4.456 0 P-O3'-C3' 123.918 3.515 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.75 " C4'" ' HD2' ' P' ' 111' ' ' LYS . . . . . . . . 1 C5'--C4' 1.55 4.826 1 P-O3'-C3' 124.768 4.223 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.609 " O5'" H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.549 4.743 0 O5'-C5'-C4' 115.734 3.953 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.597 ' C2 ' ' C2 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 2 C5'--C4' 1.544 4.066 0 P-O3'-C3' 123.622 3.268 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.509 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.549 4.794 2 P-O3'-C3' 129.151 7.876 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.547 4.544 0 O5'-C5'-C4' 115.441 3.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.501 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.546 4.39 0 O5'-C5'-C4' 114.5 3.071 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.501 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 2 C5'--C4' 1.545 4.246 0 C4'-C3'-C2' 100.322 -2.878 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.61 ' C5 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.554 5.317 1 O4'-C1'-N19 112.369 5.712 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.61 ' H72' ' C5 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.572 4.355 0 P-O3'-C3' 124.25 3.792 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.807 1 O5'-C5'-C4' 115.875 4.054 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.538 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.547 4.5 0 O4'-C4'-C3' 108.66 3.06 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.538 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.547 4.521 0 O5'-C5'-C4' 114.74 3.243 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.47 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.547 4.512 0 O5'-C5'-C4' 115.379 3.699 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.6 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.57 4.163 0 O5'-C5'-C4' 115.444 3.746 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.6 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.547 4.463 0 O5'-C5'-C4' 114.417 3.012 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.596 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.546 4.392 0 O5'-C5'-C4' 115.289 3.635 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.596 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.548 4.63 0 O5'-C5'-C4' 114.676 3.197 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.532 " C5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.216 0 O5'-C5'-C4' 115.786 3.99 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.513 ' C4 ' ' C6 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.569 4.097 0 O5'-C5'-C4' 114.738 3.242 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.603 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.546 4.355 0 O5'-C5'-C4' 115.429 3.735 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.603 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.547 4.497 0 C4'-C3'-C2' 99.618 -3.582 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.638 ' O2 ' ' N2 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 2 C5'--C4' 1.546 4.431 0 P-O3'-C3' 123.637 3.28 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.638 ' N6 ' ' O4 ' ' A' ' 3' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.547 4.529 0 O5'-C5'-C4' 114.83 3.307 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.502 ' N3 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.547 4.542 0 O4'-C4'-C3' 108.657 3.057 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.371 0 O4'-C1'-N19 110.551 3.439 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.511 -0.555 0 CA-C-O 121.779 0.8 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.92 167.17 13.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.733 0.777 . . . . 0.0 110.957 -173.063 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 9.9 p30 168.36 -22.45 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.11 -171.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 104' ' ' GLY . . . . . 0.489 ' O ' HD13 ' P' ' 105' ' ' LEU . . . -88.9 -59.9 1.55 Allowed Glycine 0 N--CA 1.464 0.536 0 N-CA-C 110.83 -0.908 . . . . 0.0 110.83 171.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.489 HD13 ' O ' ' P' ' 104' ' ' GLY . 1.2 mm? -143.27 148.48 44.63 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-O 122.168 0.985 . . . . 0.0 111.06 -173.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 106' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -86.02 50.92 2.62 Favored 'Trans proline' 0 N--CA 1.526 3.44 1 C-N-CA 127.7 5.6 . . . . 0.0 115.26 178.197 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 107' ' ' ASN . . . . . 0.567 ' O ' ' HG3' ' P' ' 108' ' ' LYS . 0.0 OUTLIER 53.96 -169.38 0.06 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.836 0.827 . . . . 0.0 110.98 -179.558 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 108' ' ' LYS . . . . . 0.794 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -158.31 36.91 0.24 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.676 0.751 . . . . 0.0 111.157 179.419 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.708 ' HG3' ' N ' ' P' ' 110' ' ' ARG . 3.5 tptm -67.72 160.85 27.25 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.667 0.746 . . . . 0.0 111.86 171.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.794 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.3 OUTLIER -129.97 -149.93 0.42 Allowed 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 122.333 1.063 . . . . 0.0 109.088 -171.733 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.75 ' HD2' " C4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -105.21 87.66 2.68 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.557 -177.047 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 112' ' ' ARG . . . . . 0.451 ' NH1' ' CD ' ' P' ' 109' ' ' LYS . 56.4 mtt85 -68.83 -158.33 0.02 OUTLIER 'General case' 0 C--O 1.245 0.852 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.175 169.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.981 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.1 OUTLIER -105.72 116.5 32.05 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.039 0.923 . . . . 0.0 110.396 170.148 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.418 ' CG2' ' OP2' ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -97.85 82.46 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 122.725 1.25 . . . . 0.0 110.105 -175.608 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.981 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -88.74 112.42 23.14 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.663 -169.448 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.677 ' CD1' HD22 ' P' ' 148' ' ' LEU . 0.9 OUTLIER -78.92 150.85 32.0 Favored 'General case' 0 C--O 1.272 2.268 0 CA-C-O 118.215 -0.898 . . . . 0.0 109.71 -171.59 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -69.81 155.48 40.49 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 122.831 2.56 . . . . 0.0 110.006 -172.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.502 ' HB2' ' HE3' ' P' ' 118' ' ' LYS . 0.2 OUTLIER -43.92 -37.12 2.71 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 122.329 1.062 . . . . 0.0 111.223 176.515 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.21 -58.31 9.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 122.953 1.359 . . . . 0.0 110.206 172.224 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.611 ' O ' HD12 ' P' ' 124' ' ' LEU . 78.6 mt-30 -55.51 -47.9 75.5 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.775 177.387 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.503 ' HA ' HD12 ' P' ' 124' ' ' LEU . 3.2 m -53.03 -44.93 67.72 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.348 -0.845 . . . . 0.0 110.242 170.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.508 ' CE2' ' NH1' ' P' ' 126' ' ' ARG . 11.1 t80 -65.43 -40.24 93.07 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 121.714 -0.616 . . . . 0.0 111.088 -171.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.64 ' HB2' HG21 ' P' ' 146' ' ' ILE . 0.0 OUTLIER -71.46 -26.71 62.83 Favored 'General case' 0 C--O 1.265 1.878 0 O-C-N 120.83 -1.169 . . . . 0.0 111.303 169.606 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.611 HD12 ' O ' ' P' ' 120' ' ' GLN . 1.4 mt -73.67 -40.65 63.53 Favored 'General case' 0 C--O 1.247 0.931 0 O-C-N 119.026 -2.296 . . . . 0.0 110.739 172.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 125' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -61.5 -45.68 93.2 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 123.152 1.453 . . . . 0.0 111.442 171.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.508 ' NH1' ' CE2' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -45.92 -65.1 0.59 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.941 172.451 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.798 ' HG3' HD13 ' P' ' 142' ' ' LEU . 0.7 OUTLIER -65.22 -31.32 72.43 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 118.652 -0.69 . . . . 0.0 109.911 -172.463 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.627 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 26.1 t80 -75.78 -44.69 40.17 Favored 'General case' 0 C--O 1.264 1.831 0 CA-C-N 120.685 1.584 . . . . 0.0 112.974 171.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 129' ' ' ARG . . . . . . . . . . . . . 5.8 mtp180 -67.23 -13.58 62.11 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 119.12 -2.237 . . . . 0.0 110.502 -173.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -106.0 -33.62 7.85 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 126.369 1.867 . . . . 0.0 111.559 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.51 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -151.8 108.58 3.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 123.862 1.791 . . . . 0.0 112.665 -167.762 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 132' ' ' ARG . . . . . 0.421 ' HB3' ' CD2' ' P' ' 133' ' ' TYR . 4.2 mtt85 -77.79 -9.14 58.87 Favored 'General case' 0 C--O 1.244 0.779 0 O-C-N 120.444 -1.41 . . . . 0.0 113.649 -171.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.421 ' CD2' ' HB3' ' P' ' 132' ' ' ARG . 98.2 m-85 -152.74 116.78 4.86 Favored 'General case' 0 C--O 1.26 1.647 0 C-N-CA 123.712 0.805 . . . . 0.0 109.765 -168.605 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.598 HD22 ' HB3' ' P' ' 138' ' ' GLU . 23.7 mt -123.11 143.34 50.05 Favored 'General case' 0 C--O 1.276 2.483 0 O-C-N 119.362 -2.086 . . . . 0.0 111.336 -166.113 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.58 162.7 19.71 Favored 'General case' 0 C--O 1.26 1.647 0 CA-C-N 124.492 3.315 . . . . 0.0 110.137 168.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.898 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -50.77 -60.49 5.38 Favored Pre-proline 0 C--O 1.253 1.274 0 O-C-N 119.974 -1.704 . . . . 0.0 111.585 -170.455 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.898 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 85.3 Cg_exo -50.67 -31.23 31.52 Favored 'Trans proline' 1 N--CA 1.538 4.128 1 C-N-CA 125.321 4.014 . . . . 0.0 115.57 -177.392 . . . . . . . . 4 3 . 1 . 017 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.598 ' HB3' HD22 ' P' ' 134' ' ' LEU . 2.3 mm-40 -65.54 -61.15 2.26 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 126.101 2.857 . . . . 0.0 108.638 167.516 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.623 ' NE ' ' HG3' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -74.99 -22.82 58.3 Favored 'General case' 0 C--O 1.276 2.464 0 CA-C-N 112.273 -2.24 . . . . 0.0 113.102 -166.582 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.668 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 3.5 mt-10 -68.78 -39.4 80.2 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 123.844 3.02 . . . . 0.0 111.297 169.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -59.99 -33.72 72.34 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.633 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.798 HD13 ' HG3' ' P' ' 127' ' ' ARG . 0.9 OUTLIER -68.85 -37.14 78.91 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.058 0.932 . . . . 0.0 109.552 169.954 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.68 -36.68 69.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.219 172.012 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 1.6 t -72.09 -42.54 66.04 Favored 'General case' 0 C--O 1.266 1.952 0 N-CA-C 113.971 1.101 . . . . 0.0 113.971 176.118 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 145' ' ' LEU . . . . . 0.579 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 87.1 mt -66.99 -46.0 75.91 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 125.586 2.612 . . . . 0.0 108.674 -168.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 1.012 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -94.13 -15.36 7.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-N 112.311 -2.222 . . . . 0.0 110.381 -175.499 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 147' ' ' ARG . . . . . 0.579 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.1 OUTLIER 76.75 43.65 0.13 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 123.844 1.783 . . . . 0.0 112.122 165.399 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 1.012 HD12 HD11 ' P' ' 146' ' ' ILE . 5.6 mt -103.7 164.91 11.37 Favored 'General case' 0 C--O 1.253 1.273 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.212 168.166 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.512 ' HB ' ' HD2' ' P' ' 150' ' ' PRO . 7.1 p -77.42 153.95 81.71 Favored Pre-proline 0 C--N 1.321 -0.662 0 O-C-N 120.452 -1.405 . . . . 0.0 109.263 169.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.512 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 9.0 Cg_endo -60.0 -45.14 25.48 Favored 'Trans proline' 0 N--CA 1.533 3.825 0 C-N-CA 124.418 3.412 . . . . 0.0 114.184 -171.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 1.1 m -60.48 -20.08 58.87 Favored 'General case' 0 C--O 1.27 2.18 0 CA-C-N 122.274 2.306 . . . . 0.0 112.61 166.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.472 ' HB3' ' CE1' ' P' ' 116' ' ' PHE . 40.2 mt-30 -74.35 -28.4 61.12 Favored 'General case' 0 C--O 1.276 2.452 0 CA-C-N 123.853 3.024 . . . . 0.0 108.442 169.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.564 ' O ' ' HD1' ' P' ' 157' ' ' PHE . 1.2 t -72.41 -63.17 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 CA-C-N 124.585 3.357 . . . . 0.0 111.465 168.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.623 ' HG3' ' NE ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -42.47 -50.04 5.24 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.13 0.972 . . . . 0.0 111.934 -179.51 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.486 HD13 ' HA ' ' P' ' 155' ' ' ILE . 0.8 OUTLIER -56.67 -52.91 48.12 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 O-C-N 121.539 -0.726 . . . . 0.0 110.9 177.373 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.548 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.1 t90 -57.56 -29.98 64.86 Favored 'General case' 0 C--O 1.245 0.865 0 O-C-N 121.265 -0.897 . . . . 0.0 110.0 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.627 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 10.3 m-85 -76.71 -41.38 45.46 Favored 'General case' 0 C--O 1.288 3.113 0 O-C-N 120.227 -1.545 . . . . 0.0 112.999 171.498 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -51.5 -65.97 0.47 Allowed 'General case' 0 C--N 1.314 -0.957 0 O-C-N 116.624 -3.798 . . . . 0.0 110.863 165.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -58.38 -21.24 49.54 Favored 'General case' 0 C--O 1.276 2.463 0 CA-C-O 115.698 -2.096 . . . . 0.0 111.405 -171.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.474 ' NE2' ' CZ2' ' P' ' 156' ' ' TRP . 0.2 OUTLIER -73.25 -56.87 4.51 Favored 'General case' 0 C--O 1.28 2.696 0 CA-C-N 124.924 3.511 . . . . 0.0 112.93 169.929 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.42 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -62.12 -37.03 83.57 Favored 'General case' 0 C--O 1.27 2.182 0 O-C-N 117.962 -2.961 . . . . 0.0 113.651 -170.006 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -67.17 -31.65 72.21 Favored 'General case' 0 C--O 1.258 1.511 0 CA-C-N 123.167 2.712 . . . . 0.0 111.33 171.02 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -68.41 -37.67 80.53 Favored 'General case' 0 C--O 1.256 1.437 0 CA-C-N 121.12 1.782 . . . . 0.0 112.582 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.665 ' O ' ' HB3' ' P' ' 167' ' ' ALA . 0.5 OUTLIER -64.76 -48.97 72.59 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 124.519 2.104 . . . . 0.0 108.823 -172.31 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 165' ' ' LYS . . . . . 0.478 ' HG2' HG23 ' P' ' 164' ' ' THR . 12.2 mmmt -70.79 -42.76 69.93 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 112.967 -1.924 . . . . 0.0 111.227 -169.253 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.88 -16.32 63.06 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 124.271 1.029 . . . . 0.0 110.72 170.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.665 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -76.49 -33.87 58.66 Favored 'General case' 0 C--N 1.323 -0.573 0 O-C-N 121.16 -0.962 . . . . 0.0 111.815 171.513 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 168' ' ' GLN . . . . . 0.405 ' HG3' ' HA ' ' P' ' 165' ' ' LYS . 0.1 OUTLIER -80.65 -12.92 59.42 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.516 -179.096 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.2 -28.01 69.45 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 123.157 1.456 . . . . 0.0 109.604 166.5 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -23.04 50.42 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -170.111 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.89 -121.87 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 -171.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 172' ' ' GLY . . . . . 0.413 ' O ' ' CB ' ' P' ' 173' ' ' TYR . . . -22.54 -40.98 0.01 OUTLIER Glycine 0 C--N 1.314 -0.65 0 CA-C-O 121.913 0.729 . . . . 0.0 112.315 166.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 173' ' ' TYR . . . . . 0.413 ' CB ' ' O ' ' P' ' 172' ' ' GLY . 57.8 m-85 101.62 145.21 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 126.507 1.923 . . . . 0.0 110.615 166.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -163.31 171.89 15.46 Favored 'General case' 0 C--O 1.269 2.125 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.479 172.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 60.79 157.51 0.05 OUTLIER Glycine 0 N--CA 1.483 1.778 0 O-C-N 118.949 -2.345 . . . . 0.0 110.632 -169.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' P' P ' 176' ' ' HIS . . . . . 0.489 ' CG ' ' HD2' ' P' ' 177' ' ' PRO . 6.1 t60 -165.68 147.67 6.3 Favored Pre-proline 0 CA--C 1.51 -0.59 0 O-C-N 121.511 -0.993 . . . . 0.0 110.953 -171.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' P' P ' 177' ' ' PRO . . . . . 0.489 ' HD2' ' CG ' ' P' ' 176' ' ' HIS . 66.6 Cg_endo . . . . . 0 N--CA 1.527 3.497 1 C-N-CA 126.438 4.759 . . . . 0.0 114.315 176.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.565 3.689 0 O5'-C5'-C4' 114.384 2.989 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.695 ' N1 ' ' N3 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.403 0 P-O3'-C3' 124.116 3.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.528 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.948 0 P-O3'-C3' 122.926 2.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.641 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.524 0 P-O3'-C3' 123.668 3.307 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.522 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.738 0 N19-C1'-C2' 118.212 2.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.509 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.841 0 N19-C1'-C2' 120.174 3.734 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 1.041 H2'' " H5'" ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.738 1 P-O3'-C3' 125.263 4.636 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 1.041 " H5'" H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.604 0 P-O3'-C3' 124.395 3.913 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.613 ' C5 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.409 0 O4'-C4'-C3' 108.161 2.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.613 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.862 0 P-O3'-C3' 122.854 2.628 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.504 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.394 0 P-O3'-C3' 122.778 2.565 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . 0.454 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.537 3.293 0 P-O3'-C3' 122.472 2.31 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.504 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.552 0 O4'-C4'-C3' 108.433 2.833 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.735 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.688 0 C2'-C3'-O3' 116.627 2.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.735 H5'' H2'' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.89 1 O4'-C1'-N19 111.39 4.488 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.496 " H5'" H2'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.514 0 P-O3'-C3' 122.147 2.039 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . 0.464 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.751 0 O5'-C5'-C4' 115.008 3.434 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.5 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.006 0 O4'-C4'-C3' 108.128 2.528 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.5 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.418 0 O4'-C4'-C3' 108.211 2.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.37 0 O4'-C4'-C3' 108.266 2.666 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.497 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.57 4.197 0 N19-C1'-C2' 119.312 3.195 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.515 H2'' ' C8 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.562 4.417 1 P-O3'-C3' 127.101 6.168 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.602 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.239 2 P-O3'-C3' 132.32 10.516 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.602 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.717 0 P-O3'-C3' 123.094 2.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.467 H2'' ' C6 ' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.746 0 O4'-C4'-C3' 108.604 3.004 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.516 ' C4 ' ' C6 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C3'--C2' 1.558 4.024 0 N19-C1'-C2' 118.88 2.925 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.54 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.599 0 P-O3'-C3' 123.631 3.276 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.629 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.399 0 C4'-C3'-C2' 100.891 -2.309 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.641 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 O4'-C4'-C3' 108.373 2.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.602 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.424 0 O4'-C4'-C3' 108.18 2.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.695 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.695 1 P-O3'-C3' 124.72 4.184 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . 0.458 " H5'" " H1'" ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.543 3.953 1 P-O3'-C3' 129.421 8.101 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.483 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -163.02 132.62 4.25 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.64 -1.618 . . . . 0.0 108.65 -178.369 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 169.37 23.29 0.0 OUTLIER 'General case' 0 C--N 1.395 2.58 0 CA-C-N 113.376 -1.738 . . . . 0.0 109.469 -174.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 104' ' ' GLY . . . . . 0.677 ' O ' HD23 ' P' ' 105' ' ' LEU . . . -171.05 -104.01 0.17 Allowed Glycine 0 C--N 1.379 2.966 0 N-CA-C 108.831 -1.708 . . . . 0.0 108.831 -161.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.932 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.1 OUTLIER -172.08 155.12 3.56 Favored Pre-proline 0 CA--C 1.581 2.142 0 CA-C-N 113.704 -1.248 . . . . 0.0 108.677 -174.872 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.932 ' HD2' HD13 ' P' ' 105' ' ' LEU . 65.7 Cg_exo -48.92 92.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.116 0 C-N-CA 122.94 2.427 . . . . 0.0 110.346 155.335 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -106.37 169.66 8.38 Favored 'General case' 0 C--N 1.381 1.975 0 CA-C-O 122.478 1.132 . . . . 0.0 109.098 158.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 9.8 tttp -129.04 -54.33 1.2 Allowed 'General case' 0 C--N 1.382 2.01 0 CA-C-N 113.673 -1.603 . . . . 0.0 108.108 -163.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.463 ' HD2' " H5'" ' B' ' 28' ' ' ' DA' . 2.7 tttt -67.7 135.2 52.37 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 113.675 -1.602 . . . . 0.0 109.56 169.228 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.453 ' HD3' ' C ' ' P' ' 109' ' ' LYS . 1.6 mmt85 -135.1 61.4 1.67 Allowed 'General case' 0 C--N 1.385 2.139 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.218 -169.021 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.68 ' HD3' " O4'" ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -178.91 134.65 0.13 Allowed 'General case' 0 C--N 1.381 1.96 0 CA-C-N 114.487 -1.233 . . . . 0.0 108.02 155.121 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 112' ' ' ARG . . . . . 0.585 ' O ' ' HG3' ' P' ' 111' ' ' LYS . 2.4 mtp85 -91.81 170.32 9.98 Favored 'General case' 0 C--N 1.38 1.933 0 CA-C-N 114.803 -1.089 . . . . 0.0 108.488 153.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.94 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.4 OUTLIER -80.2 112.99 18.05 Favored 'General case' 0 C--N 1.387 2.203 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 155.256 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.425 HG21 ' OP1' ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -106.35 63.04 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.186 0 CA-C-O 125.921 2.772 . . . . 0.0 107.675 -156.704 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.94 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -75.59 106.09 6.96 Favored 'General case' 0 C--N 1.394 2.53 0 CA-C-N 110.87 -2.877 . . . . 0.0 109.215 -155.727 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.544 ' CD1' ' CD2' ' P' ' 148' ' ' LEU . 0.7 OUTLIER -76.75 143.54 39.85 Favored 'General case' 0 C--N 1.391 2.405 0 CA-C-N 112.354 -2.203 . . . . 0.0 107.742 -169.323 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 117' ' ' THR . . . . . 0.433 ' O ' ' N ' ' P' ' 121' ' ' THR . 1.3 p -65.25 150.03 48.93 Favored 'General case' 0 C--N 1.382 2.02 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 -168.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' P' ' 122' ' ' TYR . 33.2 ttmt -45.06 -35.92 3.28 Favored 'General case' 0 C--N 1.382 1.98 0 CA-C-N 114.5 -1.227 . . . . 0.0 109.212 -178.071 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.2 -59.7 4.23 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-O 124.361 2.029 . . . . 0.0 109.49 174.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.555 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.6 mt-30 -60.24 -48.09 83.2 Favored 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.332 2.253 . . . . 0.0 109.949 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.635 ' HA ' HD12 ' P' ' 124' ' ' LEU . 4.2 m -47.47 -55.94 8.03 Favored 'General case' 0 C--N 1.385 2.139 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 167.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.587 ' CZ ' ' HG3' ' P' ' 126' ' ' ARG . 0.0 OUTLIER -52.85 -51.37 61.29 Favored 'General case' 0 C--N 1.38 1.912 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.023 -168.498 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.952 ' CD ' HG22 ' P' ' 146' ' ' ILE . 7.8 mt-10 -65.34 -36.37 83.81 Favored 'General case' 0 C--N 1.379 1.869 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.764 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.698 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.3 mt -60.01 -51.87 67.83 Favored 'General case' 0 C--N 1.383 2.062 0 O-C-N 120.885 -1.135 . . . . 0.0 109.735 170.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.469 ' O ' ' N ' ' P' ' 129' ' ' ARG . 19.1 mt-10 -55.89 -49.49 73.25 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-O 122.638 1.208 . . . . 0.0 109.738 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.587 ' HG3' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -42.39 -70.41 0.11 Allowed 'General case' 0 C--N 1.378 1.826 0 CA-C-N 111.896 -2.411 . . . . 0.0 108.717 176.464 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.653 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.3 OUTLIER -58.7 -36.59 74.49 Favored 'General case' 0 C--N 1.393 2.484 0 CA-C-N 112.641 -2.072 . . . . 0.0 108.393 -171.179 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.774 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 25.9 t80 -70.42 -47.23 61.73 Favored 'General case' 0 C--N 1.38 1.924 0 CA-C-O 121.638 0.732 . . . . 0.0 110.346 179.175 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.513 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 0.0 OUTLIER -62.52 -20.62 64.82 Favored 'General case' 0 C--N 1.381 1.949 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -168.585 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -94.06 -44.15 8.17 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-O 123.886 1.803 . . . . 0.0 106.576 -169.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.31 127.34 5.62 Favored 'General case' 0 C--N 1.394 2.51 0 CA-C-N 112.005 -2.361 . . . . 0.0 109.957 -163.235 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.03 -20.14 49.7 Favored 'General case' 0 C--N 1.397 2.673 0 CA-C-N 111.366 -2.652 . . . . 0.0 110.616 -158.313 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.674 ' HD1' ' CZ ' ' P' ' 161' ' ' ARG . 18.0 m-85 -153.0 115.57 4.48 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-O 124.946 2.307 . . . . 0.0 109.094 -154.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.544 HD22 ' HG3' ' P' ' 138' ' ' GLU . 35.8 mt -113.27 139.41 48.84 Favored 'General case' 0 C--N 1.417 3.534 0 O-C-N 119.65 -1.906 . . . . 0.0 108.724 -166.193 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 135' ' ' SER . . . . . 0.409 ' HB2' ' HD2' ' P' ' 137' ' ' PRO . 0.0 OUTLIER -79.25 154.52 29.12 Favored 'General case' 0 C--N 1.384 2.106 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 158.39 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.29 -42.94 97.46 Favored Pre-proline 0 CA--C 1.583 2.224 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.455 -162.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.409 ' HD2' ' HB2' ' P' ' 135' ' ' SER . 0.0 OUTLIER -48.28 -48.48 16.76 Favored 'Trans proline' 0 C--N 1.394 2.942 0 C-N-CA 121.706 1.604 . . . . 0.0 115.903 -178.747 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.544 ' HG3' HD22 ' P' ' 134' ' ' LEU . 5.0 mm-40 -52.85 -60.79 2.83 Favored 'General case' 0 C--N 1.394 2.506 0 CA-C-O 123.89 1.805 . . . . 0.0 106.183 175.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.645 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -70.03 -33.58 72.16 Favored 'General case' 0 C--O 1.27 2.171 0 CA-C-N 109.662 -3.426 . . . . 0.0 109.494 -161.726 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.677 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 6.8 mt-10 -52.76 -47.84 67.18 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-N 121.434 1.925 . . . . 0.0 107.783 169.12 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -68.08 -36.67 80.2 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-N 112.241 -2.254 . . . . 0.0 109.033 -164.011 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.653 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.0 OUTLIER -65.96 -42.07 90.39 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-O 123.177 1.465 . . . . 0.0 109.073 168.768 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -55.71 -36.69 67.46 Favored 'General case' 0 C--N 1.389 2.319 0 CA-C-N 112.646 -2.07 . . . . 0.0 108.413 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.599 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.6 t -72.8 -41.18 65.22 Favored 'General case' 0 C--N 1.388 2.261 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.545 -178.613 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 77.8 mt -66.76 -50.9 61.24 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-O 124.882 2.277 . . . . 0.0 108.048 -165.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.963 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -90.7 -17.94 7.69 Favored 'Isoleucine or valine' 0 C--N 1.387 2.229 0 CA-C-N 110.406 -3.088 . . . . 0.0 107.949 -172.883 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 81.84 38.35 0.06 Allowed 'General case' 0 C--N 1.386 2.161 0 CA-C-N 111.414 -2.63 . . . . 0.0 107.981 153.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.963 HD12 HD11 ' P' ' 146' ' ' ILE . 6.0 mt -94.92 172.84 7.91 Favored 'General case' 0 C--N 1.39 2.356 0 CA-C-N 112.018 -2.356 . . . . 0.0 109.165 166.216 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.528 ' O ' ' N ' ' P' ' 152' ' ' GLN . 16.8 p -87.84 145.29 36.4 Favored Pre-proline 0 CA--C 1.585 2.304 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 168.676 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.543 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 65.9 Cg_exo -49.56 -48.28 19.58 Favored 'Trans proline' 0 C--N 1.408 3.701 0 C-N-CA 124.078 3.185 . . . . 0.0 113.909 -167.126 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.52 -26.27 54.12 Favored 'General case' 0 C--N 1.388 2.255 0 CA-C-N 112.174 -2.285 . . . . 0.0 110.339 173.188 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' P' ' 149' ' ' THR . 47.3 mt-30 -77.58 -28.44 51.67 Favored 'General case' 0 C--N 1.392 2.42 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 174.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.593 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.0 OUTLIER -64.19 -70.5 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.954 0 CA-C-N 122.326 2.33 . . . . 0.0 109.545 163.395 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.645 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.0 -59.21 0.43 Allowed 'General case' 0 C--N 1.385 2.149 0 C-N-CA 124.869 1.267 . . . . 0.0 110.338 -176.818 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.446 HD13 ' HA ' ' P' ' 155' ' ' ILE . 9.4 mm -64.03 -34.5 68.98 Favored 'Isoleucine or valine' 0 C--N 1.385 2.12 0 CA-C-N 112.898 -1.955 . . . . 0.0 110.163 -171.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.698 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.7 t90 -67.45 -31.55 71.79 Favored 'General case' 0 C--N 1.381 1.95 0 O-C-N 121.305 -0.872 . . . . 0.0 109.472 168.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.774 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 65.0 m-85 -74.62 -40.24 61.64 Favored 'General case' 0 C--O 1.273 2.338 0 O-C-N 121.436 -0.79 . . . . 0.0 111.975 172.463 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.519 ' N ' ' O ' ' P' ' 154' ' ' LYS . 39.3 mt-30 -54.25 -59.67 4.36 Favored 'General case' 0 C--N 1.378 1.823 0 O-C-N 119.592 -1.943 . . . . 0.0 106.244 170.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -57.11 -24.74 56.27 Favored 'General case' 0 C--N 1.389 2.32 0 CA-C-O 117.509 -1.234 . . . . 0.0 109.935 -169.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.548 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.5 OUTLIER -79.08 -41.84 27.79 Favored 'General case' 0 C--O 1.284 2.92 0 CA-C-N 121.779 2.082 . . . . 0.0 111.323 177.719 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.682 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -67.66 -38.06 83.26 Favored 'General case' 0 C--O 1.264 1.818 0 CA-C-N 122.946 2.612 . . . . 0.0 109.955 -176.718 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -60.42 -43.87 96.31 Favored 'General case' 0 C--N 1.38 1.908 0 O-C-N 120.659 -1.276 . . . . 0.0 108.101 170.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -23.71 66.44 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.951 -164.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.682 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -73.79 -56.85 4.47 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 125.654 2.645 . . . . 0.0 105.905 -167.289 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' P' P ' 165' ' ' LYS . . . . . . . . . . . . . 9.3 mtpt -58.78 -44.93 90.82 Favored 'General case' 0 C--N 1.392 2.444 1 CA-C-N 107.632 -4.349 . . . . 0.0 108.829 -169.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 11.8 ttt-85 -60.23 -38.92 84.89 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-N 112.662 -2.063 . . . . 0.0 108.763 -177.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.6 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -48.95 -42.34 37.06 Favored 'General case' 0 C--N 1.385 2.109 0 CA-C-N 113.541 -1.663 . . . . 0.0 108.538 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -81.54 -24.14 36.8 Favored 'General case' 0 C--N 1.388 2.269 0 CA-C-N 111.763 -2.471 . . . . 0.0 110.361 -166.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.67 -29.68 53.33 Favored 'General case' 0 C--N 1.387 2.22 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.99 170.417 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -74.61 -40.01 61.82 Favored 'General case' 0 C--N 1.387 2.203 0 CA-C-N 113.059 -1.882 . . . . 0.0 107.993 -165.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -92.63 85.55 5.3 Favored 'General case' 0 C--N 1.382 2.001 0 CA-C-N 113.679 -1.601 . . . . 0.0 109.197 -158.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 125.4 -49.87 0.89 Allowed Glycine 0 C--N 1.382 3.116 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -164.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 102.1 150.37 0.01 OUTLIER 'General case' 0 C--N 1.388 2.279 0 CA-C-N 112.62 -1.79 . . . . 0.0 108.564 172.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -158.57 -179.96 8.56 Favored 'General case' 0 C--N 1.392 2.431 0 CA-C-N 112.969 -1.923 . . . . 0.0 107.942 156.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 144.2 -97.07 0.19 Allowed Glycine 0 C--N 1.382 3.089 0 N-CA-C 109.106 -1.597 . . . . 0.0 109.106 167.243 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -47.1 137.51 8.1 Favored Pre-proline 0 CA--C 1.58 2.131 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 159.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo . . . . . 0 CA--C 1.594 3.523 0 C-N-CA 121.532 1.488 . . . . 0.0 111.59 -179.737 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . 0.637 ' H73' ' O6 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.811 0 O5'-C5'-C4' 114.393 2.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.762 " H2'" ' H71' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.554 1 P-O3'-C3' 125.918 5.182 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.762 ' H71' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.892 1 P-O3'-C3' 131.115 9.512 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.598 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.436 0 P-O3'-C3' 123.717 3.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.523 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.891 0 P-O3'-C3' 123.149 2.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.523 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.567 3.898 0 C3'-C2'-C1' 106.494 2.71 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.696 " O3'" HG23 ' P' ' 114' ' ' VAL . . . . . . . . 0 C4'--C3' 1.565 3.677 0 C2'-C3'-O3' 118.071 2.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.78 " C4'" ' HD2' ' P' ' 111' ' ' LYS . . . . . . . . 1 C5'--C4' 1.548 4.623 0 O4'-C1'-N19 110.817 3.771 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.606 ' C5 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.492 0 O4'-C4'-C3' 108.465 2.865 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.606 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.816 0 N19-C1'-C2' 117.819 2.262 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.429 ' C8 ' H2'' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.415 0 O4'-C4'-C3' 108.186 2.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . 0.494 H2'' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.368 0 P-O3'-C3' 122.482 2.318 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.95 " H2'" ' H71' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.586 0 O4'-C4'-C3' 108.443 2.843 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.95 ' H71' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.705 1 P-O3'-C3' 125.988 5.24 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.612 ' C8 ' ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.9 1 O4'-C1'-N19 111.186 4.233 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.612 ' H71' ' C8 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.584 0 O4'-C1'-N19 109.552 2.19 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . 0.48 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.629 0 O5'-C5'-C4' 115.056 3.468 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.48 " H5'" H2'' ' B' ' 17' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.915 0 O4'-C4'-C3' 108.08 2.48 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.432 ' C8 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.373 0 O4'-C4'-C3' 108.22 2.62 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.562 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.331 0 P-O3'-C3' 123.792 3.41 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.562 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.572 4.382 0 N19-C1'-C2' 119.123 3.077 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.541 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.486 0 P-O3'-C3' 124.294 3.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.612 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.481 0 C3'-C2'-C1' 106.943 3.031 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.612 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.624 0 O4'-C4'-C3' 108.38 2.78 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . 0.618 ' C2 ' ' C4 ' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.749 0 P-O3'-C3' 123.798 3.415 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.618 ' C4 ' ' C2 ' ' B' ' 25' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.56 4.211 0 P-O3'-C3' 123.935 3.529 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.562 ' C8 ' H2'' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.554 3.576 0 P-O3'-C3' 123.343 3.036 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.562 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.443 0 P-O3'-C3' 122.288 2.156 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.598 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.726 0 P-O3'-C3' 123.038 2.781 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.348 0 O4'-C4'-C3' 108.051 2.451 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.592 0 O4'-C4'-C3' 108.424 2.824 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . 0.474 ' C8 ' H2'' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.542 3.906 0 O4'-C1'-N19 109.463 2.078 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.475 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 5.8 t -103.19 -67.2 0.89 Allowed 'General case' 0 C--N 1.382 2.0 0 CA-C-N 113.656 -1.611 . . . . 0.0 108.687 173.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 170.04 37.69 0.0 OUTLIER 'General case' 0 C--N 1.396 2.604 0 CA-C-N 113.357 -1.747 . . . . 0.0 109.484 175.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 104' ' ' GLY . . . . . 0.644 ' O ' HD13 ' P' ' 105' ' ' LEU . . . -172.19 -102.47 0.16 Allowed Glycine 0 C--N 1.381 3.029 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 160.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.644 HD13 ' O ' ' P' ' 104' ' ' GLY . 0.3 OUTLIER -171.35 153.17 3.53 Favored Pre-proline 0 CA--C 1.582 2.198 0 CA-C-N 113.713 -1.243 . . . . 0.0 108.508 176.353 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 106' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -50.75 78.29 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.083 0 C-N-CA 123.046 2.497 . . . . 0.0 110.608 155.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 70.01 -167.8 0.17 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 122.453 1.121 . . . . 0.0 109.176 -173.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 108' ' ' LYS . . . . . 0.581 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -154.55 46.54 0.56 Allowed 'General case' 0 C--N 1.383 2.033 0 CA-C-N 113.681 -1.6 . . . . 0.0 108.048 179.481 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 109' ' ' LYS . . . . . . . . . . . . . 1.7 ttpt -96.8 140.23 31.68 Favored 'General case' 0 C--N 1.379 1.86 0 CA-C-N 113.627 -1.624 . . . . 0.0 109.772 175.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.581 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.0 OUTLIER -127.61 92.46 3.49 Favored 'General case' 0 C--N 1.382 2.015 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.867 -155.564 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.78 ' HD2' " C4'" ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -12.45 88.25 0.0 OUTLIER 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.411 -1.722 . . . . 0.0 110.341 159.518 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -89.68 166.38 13.63 Favored 'General case' 0 C--N 1.39 2.333 0 CA-C-N 112.441 -2.163 . . . . 0.0 108.785 157.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.96 ' CD ' HD21 ' P' ' 115' ' ' LEU . 1.2 ttm180 -83.54 116.99 22.83 Favored 'General case' 0 C--N 1.383 2.059 0 CA-C-N 113.522 -1.672 . . . . 0.0 107.021 -170.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.696 HG23 " O3'" ' A' ' 7' ' ' ' DA' . 0.1 OUTLIER -100.05 70.44 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.388 2.27 0 CA-C-O 124.913 2.292 . . . . 0.0 107.968 -164.497 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.96 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.1 OUTLIER -76.56 108.87 9.86 Favored 'General case' 0 C--N 1.387 2.227 0 CA-C-N 111.842 -2.436 . . . . 0.0 109.456 -161.122 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.514 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.0 m-85 -75.62 141.38 42.85 Favored 'General case' 0 C--N 1.389 2.287 0 CA-C-N 112.872 -1.967 . . . . 0.0 108.152 -170.692 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.82 148.05 52.44 Favored 'General case' 0 C--N 1.382 1.994 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 -170.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 118' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' P' ' 122' ' ' TYR . 31.5 ttmt -43.24 -36.37 1.76 Allowed 'General case' 0 C--N 1.382 1.979 0 CA-C-N 113.425 -1.716 . . . . 0.0 109.218 -177.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 119' ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' P' ' 122' ' ' TYR . . . -53.68 -66.78 0.33 Allowed 'General case' 0 C--N 1.382 1.978 0 CA-C-O 124.178 1.942 . . . . 0.0 109.14 174.075 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.0 mt-30 -48.52 -49.35 36.44 Favored 'General case' 0 C--N 1.382 2.001 0 CA-C-N 112.448 -2.16 . . . . 0.0 109.527 177.298 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.721 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.5 m -51.6 -54.27 29.51 Favored 'General case' 0 C--N 1.384 2.101 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 171.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.664 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.9 OUTLIER -52.96 -46.5 68.23 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 122.428 1.109 . . . . 0.0 110.095 -172.085 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.713 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.89 -38.74 86.83 Favored 'General case' 0 C--N 1.379 1.871 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.87 179.84 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' P' ' 121' ' ' THR . 1.3 mt -60.56 -50.23 74.36 Favored 'General case' 0 C--N 1.385 2.112 0 O-C-N 120.305 -1.497 . . . . 0.0 109.525 172.404 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.457 ' O ' ' N ' ' P' ' 129' ' ' ARG . 23.4 mt-10 -55.81 -50.35 70.77 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-O 122.626 1.203 . . . . 0.0 109.653 177.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.664 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.46 -68.38 0.19 Allowed 'General case' 0 C--N 1.378 1.808 0 CA-C-N 112.09 -2.323 . . . . 0.0 108.844 175.184 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.769 ' CG ' HD13 ' P' ' 142' ' ' LEU . 1.1 mmt85 -60.56 -36.19 77.89 Favored 'General case' 0 C--N 1.386 2.165 0 CA-C-N 113.06 -1.882 . . . . 0.0 108.418 -170.4 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.796 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 13.7 t80 -70.2 -48.09 58.67 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-N 119.066 0.848 . . . . 0.0 110.123 176.172 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' P' ' 125' ' ' GLU . 14.7 mtm180 -62.5 -18.88 62.88 Favored 'General case' 0 C--N 1.381 1.945 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 -168.132 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -95.35 -41.04 9.21 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 123.975 1.845 . . . . 0.0 107.059 -173.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.442 ' OE1' HD21 ' P' ' 134' ' ' LEU . 1.8 tt0 -156.46 123.59 5.3 Favored 'General case' 0 C--N 1.393 2.487 0 CA-C-N 111.888 -2.414 . . . . 0.0 108.982 -156.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 132' ' ' ARG . . . . . 0.445 ' NH1' ' HG3' ' P' ' 132' ' ' ARG . 0.0 OUTLIER -77.73 -16.54 58.37 Favored 'General case' 0 C--N 1.384 2.08 0 CA-C-N 111.805 -2.452 . . . . 0.0 110.249 -172.021 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 133' ' ' TYR . . . . . 0.458 ' HD1' ' HA ' ' P' ' 133' ' ' TYR . 0.2 OUTLIER -155.27 123.84 6.02 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-O 124.886 2.279 . . . . 0.0 109.308 -154.255 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.523 HD11 ' HD3' ' P' ' 127' ' ' ARG . 30.9 mt -136.05 136.93 40.63 Favored 'General case' 0 C--N 1.404 2.954 0 O-C-N 119.884 -1.76 . . . . 0.0 109.359 -164.243 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 135' ' ' SER . . . . . 0.402 ' HB2' ' HD2' ' P' ' 137' ' ' PRO . 0.1 OUTLIER -82.45 151.71 26.44 Favored 'General case' 0 C--N 1.383 2.05 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 172.948 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.68 -39.49 76.98 Favored Pre-proline 0 CA--C 1.588 2.406 0 O-C-N 121.405 -0.81 . . . . 0.0 109.259 -165.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.402 ' HD2' ' HB2' ' P' ' 135' ' ' SER . 0.1 OUTLIER -55.71 -42.56 66.24 Favored 'Trans proline' 0 C--N 1.396 3.033 0 N-CA-C 119.2 2.731 . . . . 0.0 119.2 175.638 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.413 ' HB3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -49.32 -71.28 0.07 Allowed 'General case' 0 C--N 1.379 1.855 0 CA-C-O 124.626 2.155 . . . . 0.0 107.548 162.771 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.824 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.26 -37.07 77.75 Favored 'General case' 0 C--N 1.391 2.376 0 CA-C-N 109.563 -3.471 . . . . 0.0 108.492 -157.37 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.636 ' O ' ' N ' ' P' ' 144' ' ' SER . 2.4 mt-10 -53.29 -40.3 64.63 Favored 'General case' 0 C--N 1.381 1.952 0 CA-C-O 123.103 1.43 . . . . 0.0 108.023 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 141' ' ' HIS . . . . . 0.424 ' O ' ' HB3' ' P' ' 144' ' ' SER . 3.9 t-160 -63.3 -36.0 82.23 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-N 112.937 -1.938 . . . . 0.0 108.445 -171.153 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.769 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.7 tp -66.02 -43.19 88.39 Favored 'General case' 0 C--N 1.383 2.024 0 CA-C-O 123.037 1.399 . . . . 0.0 109.16 168.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.628 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.07 -33.17 64.78 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 112.75 -2.023 . . . . 0.0 108.28 173.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.636 ' N ' ' O ' ' P' ' 140' ' ' GLU . 7.4 t -73.5 -44.26 58.2 Favored 'General case' 0 C--N 1.387 2.228 0 CA-C-N 113.631 -1.622 . . . . 0.0 109.698 -177.347 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 83.0 mt -68.04 -44.22 76.9 Favored 'General case' 0 C--N 1.38 1.933 0 CA-C-O 124.793 2.235 . . . . 0.0 108.255 -163.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 1.009 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -100.2 -13.08 8.31 Favored 'Isoleucine or valine' 0 C--N 1.39 2.34 0 CA-C-N 110.931 -2.85 . . . . 0.0 107.916 -167.696 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 82.37 34.74 0.07 Allowed 'General case' 0 C--N 1.382 1.993 0 CA-C-O 125.508 2.575 . . . . 0.0 107.942 152.519 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 1.009 HD12 HD11 ' P' ' 146' ' ' ILE . 9.3 mt -96.26 169.59 9.83 Favored 'General case' 0 C--N 1.397 2.637 0 CA-C-N 111.573 -2.558 . . . . 0.0 109.516 170.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.648 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.5 p -91.56 139.81 25.17 Favored Pre-proline 0 CA--C 1.593 2.597 0 CA-C-O 122.661 1.22 . . . . 0.0 108.543 170.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.417 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 15.0 Cg_exo -56.07 -35.31 94.67 Favored 'Trans proline' 1 C--N 1.415 4.047 0 C-N-CA 122.688 2.259 . . . . 0.0 112.92 -159.674 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 1.3 m -59.65 -28.5 67.3 Favored 'General case' 0 C--N 1.384 2.071 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.866 167.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.648 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -72.8 -30.83 64.39 Favored 'General case' 0 C--O 1.271 2.197 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.609 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.4 t -64.35 -74.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 122.094 2.224 . . . . 0.0 109.326 164.236 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.824 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -38.22 -45.71 0.99 Allowed 'General case' 0 C--N 1.385 2.128 0 C-N-CA 125.452 1.501 . . . . 0.0 110.873 -173.069 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 155' ' ' ILE . . . . . 0.542 HD13 ' HA ' ' P' ' 155' ' ' ILE . 0.7 OUTLIER -59.28 -64.72 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.382 2.015 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 -179.445 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.721 ' HB3' HD22 ' P' ' 124' ' ' LEU . 2.1 t90 -49.6 -30.9 9.53 Favored 'General case' 0 C--N 1.385 2.126 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -176.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.796 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 45.9 m-85 -74.57 -44.93 48.54 Favored 'General case' 0 C--O 1.278 2.598 0 O-C-N 121.252 -0.905 . . . . 0.0 112.228 171.215 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -46.05 -64.31 0.78 Allowed 'General case' 0 C--N 1.378 1.815 0 O-C-N 119.0 -2.312 . . . . 0.0 107.005 167.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 159' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' P' ' 163' ' ' LYS . 1.4 m120 -55.97 -21.54 21.62 Favored 'General case' 0 C--N 1.386 2.193 0 CA-C-O 117.431 -1.271 . . . . 0.0 110.551 -164.396 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.534 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 1.0 OUTLIER -80.69 -41.58 23.44 Favored 'General case' 0 C--O 1.292 3.31 0 CA-C-N 121.621 2.01 . . . . 0.0 112.436 176.73 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.751 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -66.26 -39.27 89.36 Favored 'General case' 0 C--O 1.267 1.984 0 CA-C-N 123.825 3.011 . . . . 0.0 109.116 -167.505 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -66.16 -31.25 71.99 Favored 'General case' 0 C--N 1.381 1.963 0 O-C-N 120.076 -1.64 . . . . 0.0 109.669 169.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 163' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' P' ' 159' ' ' ASN . 6.1 ttmm -65.05 -32.05 73.57 Favored 'General case' 0 C--N 1.381 1.971 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 -171.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.751 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.3 OUTLIER -69.13 -57.1 5.85 Favored 'General case' 0 CA--C 1.572 1.826 0 CA-C-O 125.732 2.682 . . . . 0.0 105.246 -166.054 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 165' ' ' LYS . . . . . . . . . . . . . 8.2 mtpt -58.11 -50.44 73.47 Favored 'General case' 0 C--N 1.39 2.346 1 CA-C-N 107.929 -4.214 . . . . 0.0 108.787 -168.316 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 8.9 ttt85 -53.97 -39.61 66.14 Favored 'General case' 0 C--N 1.381 1.961 0 CA-C-N 112.561 -2.109 . . . . 0.0 108.991 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -64.75 -31.36 72.55 Favored 'General case' 0 C--N 1.382 2.013 0 CA-C-O 124.387 2.041 . . . . 0.0 109.384 -172.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.95 -22.67 31.39 Favored 'General case' 0 C--N 1.392 2.443 0 CA-C-N 112.39 -2.186 . . . . 0.0 109.982 -176.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -54.04 -32.29 54.04 Favored 'General case' 0 C--N 1.38 1.908 0 CA-C-O 123.874 1.797 . . . . 0.0 110.092 168.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -75.95 -33.2 59.81 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-N 112.284 -2.235 . . . . 0.0 107.762 -154.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -77.82 91.7 4.15 Favored 'General case' 0 C--N 1.382 2.011 0 CA-C-N 113.438 -1.71 . . . . 0.0 109.062 -159.535 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 116.06 -86.77 0.42 Allowed Glycine 0 C--N 1.384 3.197 0 N-CA-C 108.739 -1.744 . . . . 0.0 108.739 -155.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 173' ' ' TYR . . . . . 0.417 ' N ' ' CD1' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 148.83 170.95 0.0 OUTLIER 'General case' 0 C--N 1.382 1.982 0 CA-C-N 113.196 -1.502 . . . . 0.0 109.634 170.997 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.86 54.37 2.69 Favored 'General case' 0 C--N 1.388 2.246 0 CA-C-N 111.868 -2.424 . . . . 0.0 109.686 173.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -65.42 103.52 0.82 Allowed Glycine 0 C--N 1.38 3.0 0 N-CA-C 109.379 -1.489 . . . . 0.0 109.379 -157.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' P' P ' 176' ' ' HIS . . . . . 0.458 ' CG ' ' HD2' ' P' ' 177' ' ' PRO . 0.4 OUTLIER -156.81 165.83 17.92 Favored Pre-proline 0 CA--C 1.579 2.094 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -176.713 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' P' P ' 177' ' ' PRO . . . . . 0.458 ' HD2' ' CG ' ' P' ' 176' ' ' HIS . 68.3 Cg_exo . . . . . 0 CA--C 1.593 3.461 0 C-N-CA 121.516 1.477 . . . . 0.0 111.587 170.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.567 3.856 0 O5'-C5'-C4' 114.351 2.965 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ' DG' . . . . . 0.603 " C2'" ' H71' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.3 0 O4'-C4'-C3' 108.138 2.538 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . 0.603 ' H71' " C2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.856 0 P-O3'-C3' 122.553 2.378 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.661 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.731 0 P-O3'-C3' 123.445 3.121 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ' DT' . . . . . 0.554 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.864 1 P-O3'-C3' 126.54 5.7 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . 0.591 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.956 1 P-O3'-C3' 126.295 5.496 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ' DA' . . . . . 0.803 " C5'" ' HG2' ' P' ' 113' ' ' ARG . . . . . . . . 0 C5'--C4' 1.538 3.383 1 P-O3'-C3' 124.532 4.027 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ' DA' . . . . . 0.912 H2'' H5'' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.445 0 C4'-C3'-C2' 100.818 -2.382 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ' DG' . . . . . 0.912 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.353 0 P-O3'-C3' 123.031 2.776 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ' DT' . . . . . 0.56 ' C7 ' ' C8 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.815 0 P-O3'-C3' 122.726 2.522 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ' DG' . . . . . 0.479 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.475 0 O4'-C4'-C3' 108.002 2.402 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.561 3.347 0 P-O3'-C3' 122.518 2.348 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ' DC' . . . . . 0.71 " H2'" ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.624 0 O4'-C4'-C3' 108.288 2.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ' DT' . . . . . 0.71 ' H72' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.793 0 C2'-C3'-O3' 116.673 2.249 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ' DG' . . . . . 0.679 H5'' H2'' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.543 3.941 1 O4'-C1'-N19 111.241 4.302 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ' DT' . . . . . 0.667 ' H71' ' N9 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.563 0 P-O3'-C3' 123.894 3.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.727 0 O5'-C5'-C4' 115.08 3.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 18' ' ' ' DC' . . . . . 0.472 ' C4 ' ' N6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.538 1 P-O3'-C3' 126.838 5.948 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 19' ' ' ' DA' . . . . . 0.472 ' N6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.508 0 O4'-C4'-C3' 108.253 2.653 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 20' ' ' ' DG' . . . . . 0.47 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.29 0 P-O3'-C3' 124.147 3.706 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 21' ' ' ' DC' . . . . . 0.607 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.571 4.27 0 N19-C1'-C2' 119.009 3.006 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 22' ' ' ' DC' . . . . . 0.607 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.556 3.76 0 N19-C1'-C2' 118.365 2.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 23' ' ' ' DA' . . . . . 0.632 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.564 1 P-O3'-C3' 130.654 9.128 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 24' ' ' ' DC' . . . . . 0.632 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.543 0 O4'-C4'-C3' 108.619 3.019 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.567 3.901 0 C2'-C3'-O3' 116.634 2.235 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 26' ' ' ' DT' . . . . . 0.44 " C2'" ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.558 3.958 0 N19-C1'-C2' 119.252 3.157 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . 0.595 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.671 0 P-O3'-C3' 122.856 2.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 28' ' ' ' DA' . . . . . 0.599 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.349 0 P-O3'-C3' 122.511 2.343 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' ' DC' . . . . . 0.661 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.672 0 O4'-C4'-C3' 108.261 2.661 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . 0.577 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.358 0 O4'-C4'-C3' 107.979 2.379 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 31' ' ' ' DC' . . . . . 0.577 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.617 0 O4'-C4'-C3' 108.302 2.702 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.92 0 P-O3'-C3' 121.98 1.9 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.494 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.8 m -146.51 101.46 3.47 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 113.678 -1.601 . . . . 0.0 108.656 -177.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 169.86 -26.11 0.0 OUTLIER 'General case' 0 C--N 1.389 2.311 0 CA-C-N 113.503 -1.68 . . . . 0.0 108.131 -175.083 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.16 163.06 27.83 Favored Glycine 0 C--N 1.381 3.056 0 N-CA-C 108.892 -1.683 . . . . 0.0 108.892 170.023 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 105' ' ' LEU . . . . . 0.817 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.0 OUTLIER -95.19 170.12 8.35 Favored Pre-proline 0 CA--C 1.581 2.138 0 CA-C-N 113.689 -1.255 . . . . 0.0 108.723 171.264 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.817 ' HD2' HD13 ' P' ' 105' ' ' LEU . 46.6 Cg_exo -46.17 93.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.127 0 C-N-CA 122.983 2.455 . . . . 0.0 110.363 155.322 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -139.18 146.17 40.22 Favored 'General case' 0 C--N 1.382 1.991 0 CA-C-O 122.452 1.12 . . . . 0.0 109.126 161.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.31 112.65 25.43 Favored 'General case' 0 C--N 1.383 2.027 0 CA-C-N 113.725 -1.58 . . . . 0.0 108.151 176.019 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 109' ' ' LYS . . . . . 0.833 ' HE3' ' H ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -64.55 165.26 10.33 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 113.704 -1.589 . . . . 0.0 109.05 -169.636 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 110' ' ' ARG . . . . . 0.833 ' H ' ' HE3' ' P' ' 109' ' ' LYS . 0.8 OUTLIER -123.03 57.08 1.14 Allowed 'General case' 0 C--N 1.382 1.986 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.039 -155.425 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 111' ' ' LYS . . . . . 0.472 ' HD2' " O3'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -82.17 87.46 6.52 Favored 'General case' 0 C--N 1.382 2.012 0 CA-C-O 123.725 1.726 . . . . 0.0 108.363 174.723 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 23.3 mtt-85 -64.28 175.84 1.2 Allowed 'General case' 0 C--N 1.39 2.353 0 CA-C-N 111.801 -2.454 . . . . 0.0 108.848 155.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 113' ' ' ARG . . . . . 0.9 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.8 OUTLIER -91.24 118.44 30.48 Favored 'General case' 0 C--N 1.383 2.029 0 CA-C-N 113.686 -1.597 . . . . 0.0 107.171 160.753 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 114' ' ' VAL . . . . . 0.459 HG23 ' P ' ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -103.42 67.27 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.179 0 CA-C-O 125.349 2.499 . . . . 0.0 108.053 -162.022 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 115' ' ' LEU . . . . . 0.9 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.75 108.99 10.16 Favored 'General case' 0 C--N 1.39 2.341 0 CA-C-N 111.633 -2.53 . . . . 0.0 109.405 -158.962 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 116' ' ' PHE . . . . . 0.4 ' CD1' ' CD2' ' P' ' 148' ' ' LEU . 2.1 m-85 -75.66 142.67 42.5 Favored 'General case' 0 C--N 1.389 2.294 0 CA-C-N 112.667 -2.06 . . . . 0.0 108.208 -170.424 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.1 p -66.01 149.48 50.17 Favored 'General case' 0 C--N 1.383 2.026 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 -171.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -45.06 -36.9 3.81 Favored 'General case' 0 C--N 1.381 1.973 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.067 -177.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.5 -57.91 9.02 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 113.136 -1.847 . . . . 0.0 109.655 175.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 120' ' ' GLN . . . . . 0.572 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.7 mt-30 -60.9 -48.66 80.77 Favored 'General case' 0 C--N 1.382 2.01 0 C-N-CA 126.728 2.011 . . . . 0.0 109.694 179.609 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 121' ' ' THR . . . . . 0.691 ' HA ' HD12 ' P' ' 124' ' ' LEU . 5.7 m -47.6 -54.68 11.15 Favored 'General case' 0 C--N 1.383 2.062 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 169.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 122' ' ' TYR . . . . . 0.57 ' CZ ' ' HG3' ' P' ' 126' ' ' ARG . 0.0 OUTLIER -52.3 -51.17 60.1 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.09 -170.361 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 123' ' ' GLU . . . . . 0.942 ' CD ' HG22 ' P' ' 146' ' ' ILE . 7.8 mt-10 -64.89 -37.38 87.45 Favored 'General case' 0 C--N 1.379 1.89 0 CA-C-N 113.964 -1.471 . . . . 0.0 107.601 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 124' ' ' LEU . . . . . 0.705 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.3 mt -60.82 -49.67 76.56 Favored 'General case' 0 C--N 1.384 2.097 0 O-C-N 120.967 -1.083 . . . . 0.0 110.28 171.174 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 125' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' P' ' 129' ' ' ARG . 27.2 mt-10 -53.97 -55.39 27.53 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-O 122.347 1.07 . . . . 0.0 108.394 176.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 126' ' ' ARG . . . . . 0.603 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -39.08 -68.38 0.17 Allowed 'General case' 0 C--N 1.379 1.861 0 CA-C-N 111.935 -2.393 . . . . 0.0 108.882 179.697 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 127' ' ' ARG . . . . . 0.889 ' HG2' HD13 ' P' ' 142' ' ' LEU . 0.0 OUTLIER -58.54 -34.47 71.05 Favored 'General case' 0 C--N 1.394 2.536 0 CA-C-N 112.673 -2.058 . . . . 0.0 108.469 -174.831 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 128' ' ' PHE . . . . . 0.715 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 9.0 t80 -67.73 -50.94 54.72 Favored 'General case' 0 C--N 1.388 2.264 0 O-C-N 121.213 -0.93 . . . . 0.0 110.382 176.615 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 129' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' P' ' 125' ' ' GLU . 3.2 mmm180 -62.56 -13.15 27.79 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 112.894 -1.957 . . . . 0.0 108.073 -165.353 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -107.88 -39.74 5.46 Favored 'General case' 0 C--N 1.379 1.886 0 C-N-CA 126.319 1.848 . . . . 0.0 107.444 -169.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 131' ' ' GLN . . . . . 0.511 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.4 OUTLIER -153.99 109.08 3.13 Favored 'General case' 0 C--N 1.386 2.164 0 CA-C-N 112.003 -2.362 . . . . 0.0 109.34 -152.914 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -77.04 -18.09 58.33 Favored 'General case' 0 C--N 1.393 2.479 0 CA-C-N 112.45 -2.159 . . . . 0.0 110.556 -167.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 133' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -156.81 112.51 2.92 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-N 114.212 -1.358 . . . . 0.0 108.065 -154.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 134' ' ' LEU . . . . . 0.599 HD11 ' HB3' ' P' ' 127' ' ' ARG . 20.4 mt -127.88 130.63 48.85 Favored 'General case' 0 C--N 1.398 2.701 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 -154.016 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.19 156.79 20.17 Favored 'General case' 0 C--N 1.382 1.987 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 136' ' ' ALA . . . . . 0.463 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.36 -43.3 98.03 Favored Pre-proline 0 CA--C 1.585 2.319 0 O-C-N 121.452 -0.78 . . . . 0.0 109.377 -158.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 137' ' ' PRO . . . . . 0.463 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 0.2 OUTLIER -56.5 -40.17 86.35 Favored 'Trans proline' 0 C--N 1.395 3.001 0 N-CA-C 119.056 2.675 . . . . 0.0 119.056 176.694 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 138' ' ' GLU . . . . . 0.459 ' HB3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -49.79 -73.7 0.04 OUTLIER 'General case' 0 C--N 1.38 1.902 0 CA-C-O 124.049 1.88 . . . . 0.0 107.497 161.721 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 139' ' ' ARG . . . . . 0.921 ' CZ ' ' HG3' ' P' ' 154' ' ' LYS . 2.1 ptt180 -69.79 -33.53 72.51 Favored 'General case' 0 C--N 1.391 2.386 0 CA-C-N 109.722 -3.399 . . . . 0.0 108.774 -156.505 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 140' ' ' GLU . . . . . 0.682 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 1.7 mt-10 -53.1 -45.99 68.49 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-O 123.578 1.656 . . . . 0.0 108.127 174.387 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -66.99 -35.49 80.07 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 112.439 -2.164 . . . . 0.0 109.417 -164.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 142' ' ' LEU . . . . . 0.889 HD13 ' HG2' ' P' ' 127' ' ' ARG . 1.1 tp -65.31 -41.79 93.67 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-O 123.369 1.557 . . . . 0.0 108.981 169.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 143' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -57.04 -36.41 70.46 Favored 'General case' 0 C--N 1.39 2.36 0 CA-C-N 112.224 -2.262 . . . . 0.0 107.971 173.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 144' ' ' SER . . . . . 0.555 ' N ' ' O ' ' P' ' 140' ' ' GLU . 2.1 t -69.76 -43.07 72.98 Favored 'General case' 0 C--N 1.388 2.275 0 CA-C-N 113.22 -1.809 . . . . 0.0 111.083 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 82.5 mt -69.04 -48.14 63.63 Favored 'General case' 0 C--N 1.38 1.891 0 CA-C-O 124.851 2.263 . . . . 0.0 108.205 -163.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 146' ' ' ILE . . . . . 0.966 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -92.02 -13.89 8.69 Favored 'Isoleucine or valine' 0 C--N 1.389 2.325 0 CA-C-N 110.675 -2.966 . . . . 0.0 107.958 -169.407 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 82.27 36.13 0.07 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 125.761 2.696 . . . . 0.0 107.66 152.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 148' ' ' LEU . . . . . 0.966 HD12 HD11 ' P' ' 146' ' ' ILE . 8.3 mt -95.18 173.82 7.37 Favored 'General case' 0 C--N 1.396 2.594 0 CA-C-N 111.353 -2.658 . . . . 0.0 109.083 166.572 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 149' ' ' THR . . . . . 0.426 ' O ' ' N ' ' P' ' 152' ' ' GLN . 16.6 p -89.16 148.22 40.32 Favored Pre-proline 0 CA--C 1.586 2.349 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 164.404 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 150' ' ' PRO . . . . . 0.544 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 86.6 Cg_exo -50.36 -51.99 9.89 Favored 'Trans proline' 0 C--N 1.408 3.69 0 C-N-CA 123.48 2.787 . . . . 0.0 113.543 -169.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -11.59 3.6 Favored 'General case' 0 C--N 1.388 2.252 0 CA-C-N 113.341 -1.754 . . . . 0.0 110.782 175.003 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 152' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' P' ' 149' ' ' THR . 43.6 mt-30 -86.31 -30.55 22.17 Favored 'General case' 0 C--O 1.279 2.656 0 CA-C-N 120.0 1.273 . . . . 0.0 108.443 167.297 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 153' ' ' VAL . . . . . 0.723 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.4 t -63.52 -72.93 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.38 1.919 0 CA-C-N 123.534 2.879 . . . . 0.0 109.779 163.159 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 154' ' ' LYS . . . . . 0.921 ' HG3' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -32.43 -56.11 0.34 Allowed 'General case' 0 C--N 1.385 2.117 0 C-N-CA 124.358 1.063 . . . . 0.0 110.822 -176.68 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.81 -45.13 95.12 Favored 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 113.549 -1.66 . . . . 0.0 108.937 -171.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 156' ' ' TRP . . . . . 0.705 ' HB3' HD22 ' P' ' 124' ' ' LEU . 2.7 t90 -62.97 -31.54 72.67 Favored 'General case' 0 C--N 1.381 1.947 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.06 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 157' ' ' PHE . . . . . 0.723 ' CE2' HG13 ' P' ' 153' ' ' VAL . 66.0 m-85 -74.87 -35.57 62.32 Favored 'General case' 0 C--O 1.279 2.623 0 O-C-N 121.275 -0.89 . . . . 0.0 111.819 170.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 158' ' ' GLN . . . . . 0.549 ' N ' ' O ' ' P' ' 154' ' ' LYS . 33.0 mt-30 -56.96 -62.76 1.52 Allowed 'General case' 0 C--N 1.378 1.817 0 O-C-N 119.047 -2.283 . . . . 0.0 106.802 169.052 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -56.65 -24.91 51.71 Favored 'General case' 0 C--N 1.393 2.46 0 CA-C-O 117.062 -1.447 . . . . 0.0 109.525 -166.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 160' ' ' HIS . . . . . 0.544 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 1.3 t-80 -74.38 -49.19 23.67 Favored 'General case' 0 C--O 1.283 2.835 0 CA-C-N 121.463 1.938 . . . . 0.0 109.914 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 161' ' ' ARG . . . . . 0.724 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -68.18 -41.88 80.81 Favored 'General case' 0 C--O 1.267 2.003 0 CA-C-N 122.19 2.268 . . . . 0.0 109.527 -160.651 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 162' ' ' TYR . . . . . 0.562 ' CZ ' ' HD2' ' P' ' 166' ' ' ARG . 40.5 t80 -66.91 -31.08 71.43 Favored 'General case' 0 C--N 1.381 1.948 0 O-C-N 119.952 -1.717 . . . . 0.0 109.514 171.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -32.25 73.69 Favored 'General case' 0 C--N 1.381 1.936 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -171.532 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 164' ' ' THR . . . . . 0.724 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -68.24 -57.05 6.6 Favored 'General case' 0 CA--C 1.573 1.847 0 CA-C-O 124.831 2.253 . . . . 0.0 105.384 -166.415 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 165' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -58.13 -45.79 86.71 Favored 'General case' 0 C--N 1.386 2.165 0 CA-C-N 108.428 -3.987 . . . . 0.0 109.358 -169.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 166' ' ' ARG . . . . . 0.562 ' HD2' ' CZ ' ' P' ' 162' ' ' TYR . 0.0 OUTLIER -42.04 -54.96 3.36 Favored 'General case' 0 C--N 1.382 1.984 0 CA-C-N 112.992 -1.913 . . . . 0.0 111.468 170.113 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' P' P ' 167' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -45.61 -42.52 11.36 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 111.763 -2.471 . . . . 0.0 108.849 -178.65 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -81.7 -24.5 36.14 Favored 'General case' 0 C--N 1.385 2.128 0 CA-C-N 112.086 -2.324 . . . . 0.0 111.06 -166.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -51.95 -33.44 37.65 Favored 'General case' 0 C--N 1.388 2.245 0 CA-C-N 113.544 -1.662 . . . . 0.0 109.484 167.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -72.82 -27.41 61.94 Favored 'General case' 0 C--N 1.385 2.131 0 CA-C-N 112.62 -2.082 . . . . 0.0 109.156 -165.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 26.9 mttm -88.7 104.42 16.86 Favored 'General case' 0 C--N 1.379 1.866 0 CA-C-N 113.502 -1.681 . . . . 0.0 107.794 -163.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 47.19 75.46 0.18 Allowed Glycine 0 CA--C 1.564 3.149 0 N-CA-C 108.276 -1.93 . . . . 0.0 108.276 -152.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -32.53 146.9 0.01 OUTLIER 'General case' 0 C--N 1.389 2.293 0 CA-C-O 123.724 1.726 . . . . 0.0 109.125 169.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.0 54.12 2.65 Favored 'General case' 0 C--N 1.391 2.376 0 CA-C-N 111.009 -2.814 . . . . 0.0 109.493 175.593 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -59.89 -23.09 58.64 Favored Glycine 0 C--N 1.38 2.976 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -154.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -90.89 131.08 38.38 Favored Pre-proline 0 CA--C 1.581 2.144 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 -164.091 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo . . . . . 0 CA--C 1.594 3.481 0 C-N-CA 121.565 1.51 . . . . 0.0 111.588 -156.93 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.513 ' CE2' ' HB2' ' P' ' 156' ' ' TRP . 1.0 OUTLIER . . . . . 0 C--O 1.254 1.331 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -68.14 147.53 52.17 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -174.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' P' ' 122' ' ' TYR . 34.7 ttmt -43.96 -37.16 2.77 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 112.824 -1.989 . . . . 0.0 109.165 -177.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . 0.411 ' O ' ' HB3' ' P' ' 122' ' ' TYR . . . -53.5 -65.26 0.6 Allowed 'General case' 0 C--N 1.383 2.024 0 CA-C-O 124.071 1.891 . . . . 0.0 109.279 174.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.566 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.6 mt-30 -48.24 -49.58 32.7 Favored 'General case' 0 C--N 1.382 1.991 0 CA-C-N 112.56 -2.109 . . . . 0.0 109.394 175.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.616 ' HA ' HD12 ' P' ' 124' ' ' LEU . 22.6 m -49.07 -55.76 11.14 Favored 'General case' 0 C--N 1.382 1.987 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 170.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.686 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.19 -46.1 68.85 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-O 122.504 1.145 . . . . 0.0 110.224 -169.47 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.664 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.1 OUTLIER -66.16 -40.05 90.23 Favored 'General case' 0 C--N 1.379 1.883 0 CA-C-N 113.983 -1.462 . . . . 0.0 107.927 179.102 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.839 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -61.02 -48.68 80.65 Favored 'General case' 0 C--N 1.385 2.139 0 O-C-N 120.484 -1.385 . . . . 0.0 110.226 172.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.404 ' O ' ' N ' ' P' ' 129' ' ' ARG . 26.0 mt-10 -53.17 -56.12 18.86 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 122.191 0.996 . . . . 0.0 108.598 175.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.686 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.53 -62.0 0.74 Allowed 'General case' 0 C--N 1.379 1.855 0 CA-C-N 112.172 -2.285 . . . . 0.0 108.705 179.113 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.536 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.4 OUTLIER -66.85 -30.51 70.71 Favored 'General case' 0 C--N 1.395 2.571 0 CA-C-N 112.233 -2.258 . . . . 0.0 108.282 -170.63 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.824 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.4 t80 -69.74 -50.82 39.77 Favored 'General case' 0 C--N 1.387 2.232 0 O-C-N 121.067 -1.021 . . . . 0.0 110.96 171.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.448 ' HA ' ' NE ' ' P' ' 129' ' ' ARG . 0.4 OUTLIER -62.26 -12.01 18.13 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-N 113.338 -1.755 . . . . 0.0 108.177 -167.218 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -102.66 -43.33 5.63 Favored 'General case' 0 C--N 1.381 1.945 0 CA-C-O 123.985 1.85 . . . . 0.0 107.258 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.425 ' HG2' ' CD2' ' P' ' 134' ' ' LEU . 2.8 tp-100 -151.69 128.74 11.08 Favored 'General case' 0 C--N 1.387 2.209 0 CA-C-N 111.608 -2.542 . . . . 0.0 110.822 -154.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -79.33 -27.94 42.08 Favored 'General case' 0 C--N 1.389 2.29 0 CA-C-N 112.003 -2.362 . . . . 0.0 111.46 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.495 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 9.2 m-85 -158.66 114.48 2.65 Favored 'General case' 0 C--N 1.377 1.79 0 CA-C-O 122.679 1.228 . . . . 0.0 109.009 -150.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.676 HD22 ' HG3' ' P' ' 138' ' ' GLU . 36.6 mt -122.92 136.08 54.73 Favored 'General case' 0 C--N 1.404 2.957 0 CA-C-N 114.393 -1.276 . . . . 0.0 108.267 -160.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.11 155.79 26.09 Favored 'General case' 0 C--N 1.383 2.025 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 166.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.539 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.34 -49.86 90.43 Favored Pre-proline 0 CA--C 1.584 2.269 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -161.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 84.1 Cg_exo -57.87 -28.89 84.38 Favored 'Trans proline' 0 C--N 1.4 3.277 0 C-N-CA 121.122 1.215 . . . . 0.0 114.932 -174.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.676 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -53.92 -71.36 0.08 Allowed 'General case' 0 C--N 1.38 1.9 0 CA-C-O 124.606 2.146 . . . . 0.0 106.44 160.782 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.904 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.96 -38.69 79.57 Favored 'General case' 0 C--N 1.39 2.334 0 CA-C-N 109.828 -3.351 . . . . 0.0 108.785 -155.33 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.643 ' O ' ' N ' ' P' ' 144' ' ' SER . 5.6 mt-10 -52.84 -39.58 62.63 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 122.849 1.309 . . . . 0.0 108.183 177.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -64.83 -36.47 84.44 Favored 'General case' 0 C--N 1.379 1.879 0 CA-C-N 112.926 -1.943 . . . . 0.0 108.562 -170.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.656 ' O ' HG23 ' P' ' 146' ' ' ILE . 3.2 tp -64.84 -43.2 93.83 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-O 123.104 1.431 . . . . 0.0 109.116 167.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.635 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -57.31 -32.43 66.67 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 112.597 -2.092 . . . . 0.0 108.45 175.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.643 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.4 OUTLIER -73.71 -44.91 55.17 Favored 'General case' 0 C--N 1.386 2.158 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.552 -178.07 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 78.5 mt -67.26 -42.84 83.24 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-O 124.598 2.142 . . . . 0.0 108.349 -163.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.994 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -101.82 -13.01 8.55 Favored 'Isoleucine or valine' 0 C--N 1.389 2.292 0 CA-C-N 111.05 -2.796 . . . . 0.0 107.817 -167.081 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 82.13 34.7 0.08 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-O 125.597 2.618 . . . . 0.0 107.98 152.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.994 HD12 HD11 ' P' ' 146' ' ' ILE . 8.4 mt -96.28 170.04 9.52 Favored 'General case' 0 C--N 1.397 2.633 0 CA-C-N 111.556 -2.565 . . . . 0.0 109.468 170.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.651 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.4 p -91.21 139.71 25.61 Favored Pre-proline 0 CA--C 1.592 2.58 0 CA-C-O 122.729 1.252 . . . . 0.0 108.718 169.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.434 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 16.2 Cg_exo -56.03 -33.9 90.89 Favored 'Trans proline' 1 C--N 1.415 4.075 0 C-N-CA 122.727 2.284 . . . . 0.0 113.114 -159.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -37.57 72.62 Favored 'General case' 0 C--N 1.383 2.045 0 C-N-CA 119.534 -0.866 . . . . 0.0 109.807 166.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.651 ' N ' ' O ' ' P' ' 149' ' ' THR . 49.0 mt-30 -68.51 -28.48 67.04 Favored 'General case' 0 C--N 1.387 2.225 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 -175.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.595 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.1 t -64.53 -70.31 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.193 0 CA-C-N 121.183 1.811 . . . . 0.0 109.517 165.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.904 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.95 -58.59 0.44 Allowed 'General case' 0 C--N 1.384 2.106 0 C-N-CA 125.013 1.325 . . . . 0.0 110.959 -178.143 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.497 HD13 ' OE1' ' P' ' 158' ' ' GLN . 33.4 mm -60.19 -39.33 80.29 Favored 'Isoleucine or valine' 0 C--N 1.382 1.989 0 CA-C-N 113.106 -1.861 . . . . 0.0 109.114 -172.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.839 ' HB3' HD22 ' P' ' 124' ' ' LEU . 3.8 t90 -67.21 -32.08 72.9 Favored 'General case' 0 C--N 1.382 2.003 0 O-C-N 121.373 -0.829 . . . . 0.0 109.088 172.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.824 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 49.2 m-85 -74.66 -40.72 61.28 Favored 'General case' 0 C--O 1.273 2.337 0 O-C-N 120.927 -1.108 . . . . 0.0 111.972 173.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.497 ' OE1' HD13 ' P' ' 155' ' ' ILE . 77.8 mt-30 -52.37 -58.14 7.63 Favored 'General case' 0 C--N 1.377 1.778 0 O-C-N 119.771 -1.831 . . . . 0.0 106.765 170.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -55.84 -25.62 42.85 Favored 'General case' 0 C--N 1.388 2.27 0 CA-C-O 117.709 -1.138 . . . . 0.0 109.659 -168.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.575 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 2.1 t60 -79.75 -42.89 23.61 Favored 'General case' 0 C--O 1.286 2.992 0 CA-C-N 121.526 1.967 . . . . 0.0 111.878 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.495 ' HD2' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.003 0 CA-C-N 123.57 2.896 . . . . 0.0 110.785 -167.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 . . . . . 0 C--O 1.253 1.276 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.03 148.1 51.48 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -174.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' P' ' 122' ' ' TYR . 38.4 ttmt -44.02 -37.19 2.84 Favored 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.084 -1.871 . . . . 0.0 109.187 -178.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.58 -62.15 1.84 Allowed 'General case' 0 C--N 1.382 2.011 0 CA-C-O 124.036 1.874 . . . . 0.0 109.394 175.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.566 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.6 mt-30 -52.96 -48.16 67.58 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-N 112.617 -2.083 . . . . 0.0 109.587 177.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.645 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.0 m -49.33 -55.81 11.61 Favored 'General case' 0 C--N 1.384 2.093 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 169.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.546 ' CE1' ' CZ ' ' P' ' 126' ' ' ARG . 2.9 t80 -53.11 -48.11 68.08 Favored 'General case' 0 C--N 1.382 2.018 0 CA-C-O 122.628 1.204 . . . . 0.0 109.949 -169.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.971 ' CD ' HG22 ' P' ' 146' ' ' ILE . 4.2 mt-10 -66.02 -38.11 87.6 Favored 'General case' 0 C--N 1.378 1.807 0 CA-C-N 113.979 -1.464 . . . . 0.0 107.604 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.717 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.1 mt -60.76 -50.3 74.03 Favored 'General case' 0 C--N 1.385 2.114 0 O-C-N 120.658 -1.276 . . . . 0.0 110.062 171.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.474 ' O ' ' N ' ' P' ' 129' ' ' ARG . 15.5 mt-10 -54.3 -53.65 50.89 Favored 'General case' 0 C--N 1.379 1.887 0 CA-C-O 122.477 1.132 . . . . 0.0 109.014 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.578 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -39.94 -65.04 0.43 Allowed 'General case' 0 C--N 1.379 1.886 0 CA-C-N 111.96 -2.382 . . . . 0.0 108.76 177.46 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.878 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -63.78 -32.7 74.29 Favored 'General case' 0 C--N 1.394 2.519 0 CA-C-N 112.405 -2.18 . . . . 0.0 108.34 -170.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.765 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 7.3 t80 -68.76 -51.01 45.77 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-O 121.973 0.892 . . . . 0.0 110.373 173.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' P' ' 125' ' ' GLU . 8.9 mmm180 -62.36 -12.21 19.94 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.306 -1.77 . . . . 0.0 108.198 -165.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -107.75 -40.97 5.13 Favored 'General case' 0 C--N 1.379 1.878 0 C-N-CA 126.234 1.814 . . . . 0.0 107.626 -172.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.502 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.4 OUTLIER -156.11 97.89 1.83 Allowed 'General case' 0 C--N 1.387 2.22 0 CA-C-N 111.952 -2.385 . . . . 0.0 110.263 -153.164 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . 0.541 ' HG2' ' CD2' ' P' ' 133' ' ' TYR . 0.1 OUTLIER -76.98 -6.91 54.47 Favored 'General case' 0 C--N 1.394 2.501 0 CA-C-N 112.035 -2.348 . . . . 0.0 110.97 -163.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.563 ' CD1' ' CZ ' ' P' ' 161' ' ' ARG . 4.0 m-85 -161.6 112.42 1.68 Allowed 'General case' 0 C--N 1.381 1.946 0 CA-C-N 114.671 -1.15 . . . . 0.0 108.511 -154.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.611 HD22 ' HG3' ' P' ' 138' ' ' GLU . 30.3 mt -130.64 136.02 48.43 Favored 'General case' 0 C--N 1.396 2.599 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -156.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.52 156.11 25.43 Favored 'General case' 0 C--N 1.381 1.959 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 167.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.537 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.36 -50.2 88.65 Favored Pre-proline 0 CA--C 1.582 2.185 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -162.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.537 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 89.3 Cg_exo -57.23 -29.83 85.15 Favored 'Trans proline' 0 C--N 1.401 3.323 0 C-N-CA 120.836 1.024 . . . . 0.0 114.624 -174.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.611 ' HG3' HD22 ' P' ' 134' ' ' LEU . 1.6 mm-40 -54.29 -71.41 0.08 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-O 124.26 1.981 . . . . 0.0 106.48 161.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.933 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.56 -34.52 74.31 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 110.008 -3.269 . . . . 0.0 109.026 -155.35 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.626 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 7.4 mt-10 -52.3 -43.77 64.67 Favored 'General case' 0 C--N 1.38 1.908 0 CA-C-O 123.356 1.551 . . . . 0.0 108.03 174.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -63.27 -36.3 83.2 Favored 'General case' 0 C--N 1.38 1.911 0 CA-C-N 112.406 -2.179 . . . . 0.0 108.738 -168.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.878 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.1 tp -66.24 -42.8 88.09 Favored 'General case' 0 C--N 1.383 2.063 0 CA-C-O 122.987 1.375 . . . . 0.0 109.167 170.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.52 -34.58 67.16 Favored 'General case' 0 C--N 1.387 2.224 0 CA-C-N 112.742 -2.026 . . . . 0.0 108.183 172.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.607 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -71.38 -42.61 68.2 Favored 'General case' 0 C--N 1.388 2.263 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.395 -178.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 80.9 mt -68.63 -46.54 68.94 Favored 'General case' 0 C--N 1.38 1.917 0 CA-C-O 124.682 2.182 . . . . 0.0 108.226 -163.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.99 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.53 -13.01 8.27 Favored 'Isoleucine or valine' 0 C--N 1.389 2.302 0 CA-C-N 110.926 -2.852 . . . . 0.0 107.967 -168.366 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 82.18 35.5 0.07 Allowed 'General case' 0 C--N 1.381 1.956 0 CA-C-O 125.721 2.677 . . . . 0.0 107.652 152.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.99 HD12 HD11 ' P' ' 146' ' ' ILE . 8.6 mt -95.61 172.72 7.88 Favored 'General case' 0 C--N 1.397 2.635 0 CA-C-N 111.45 -2.614 . . . . 0.0 109.133 168.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.588 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.0 p -90.61 141.47 27.15 Favored Pre-proline 0 CA--C 1.589 2.462 0 CA-C-O 122.797 1.284 . . . . 0.0 108.267 166.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.545 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 0.4 OUTLIER -48.29 -47.0 21.13 Favored 'Trans proline' 0 C--N 1.405 3.502 0 C-N-CA 124.954 3.769 . . . . 0.0 115.424 -167.533 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . 0.401 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -52.86 -31.03 37.13 Favored 'General case' 0 C--N 1.384 2.073 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.07 169.327 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.588 ' N ' ' O ' ' P' ' 149' ' ' THR . 46.8 mt-30 -74.66 -27.94 60.64 Favored 'General case' 0 C--N 1.392 2.42 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.709 HG13 ' CD2' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -64.15 -70.94 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.024 0 CA-C-N 122.116 2.235 . . . . 0.0 109.513 162.76 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.933 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.77 -59.57 0.4 Allowed 'General case' 0 C--N 1.387 2.199 0 CA-C-O 122.728 1.251 . . . . 0.0 110.583 -176.497 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 13.4 mm -56.2 -43.03 75.19 Favored 'Isoleucine or valine' 0 C--N 1.383 2.029 0 CA-C-N 112.995 -1.911 . . . . 0.0 109.112 -174.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.717 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.6 t90 -67.23 -31.58 72.04 Favored 'General case' 0 C--N 1.383 2.033 0 O-C-N 120.876 -1.14 . . . . 0.0 109.324 174.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.765 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 44.6 m-85 -75.55 -41.98 53.5 Favored 'General case' 0 C--O 1.275 2.406 0 O-C-N 121.053 -1.029 . . . . 0.0 111.888 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.443 ' N ' ' O ' ' P' ' 154' ' ' LYS . 51.4 mt-30 -49.5 -59.67 3.54 Favored 'General case' 0 C--N 1.378 1.826 0 O-C-N 119.296 -2.127 . . . . 0.0 107.005 169.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -55.83 -25.0 39.74 Favored 'General case' 0 C--N 1.389 2.295 0 CA-C-O 117.713 -1.137 . . . . 0.0 109.386 -166.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.535 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.6 OUTLIER -76.5 -46.84 24.97 Favored 'General case' 0 C--O 1.282 2.801 0 CA-C-N 121.213 1.824 . . . . 0.0 111.286 175.359 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.563 ' CZ ' ' CD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.378 1.841 0 CA-C-N 122.985 2.629 . . . . 0.0 110.543 -161.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.59 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.31 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -65.95 147.53 53.21 Favored 'General case' 0 C--N 1.382 2.011 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 -172.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.457 ' O ' ' N ' ' P' ' 122' ' ' TYR . 33.4 ttmt -42.65 -35.94 1.26 Allowed 'General case' 0 C--N 1.382 1.99 0 CA-C-N 113.547 -1.66 . . . . 0.0 109.594 -176.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.08 -68.12 0.21 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 124.078 1.894 . . . . 0.0 109.146 173.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.55 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.1 mt-30 -46.45 -50.58 16.62 Favored 'General case' 0 C--N 1.382 1.999 0 C-N-CA 127.166 2.186 . . . . 0.0 109.966 175.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.684 ' HA ' HD12 ' P' ' 124' ' ' LEU . 20.2 m -50.78 -57.26 8.82 Favored 'General case' 0 C--N 1.384 2.068 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 170.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.563 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.18 -46.25 68.87 Favored 'General case' 0 C--N 1.383 2.047 0 CA-C-O 122.329 1.061 . . . . 0.0 109.818 -170.217 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.959 ' CD ' HG22 ' P' ' 146' ' ' ILE . 6.5 mt-10 -66.86 -37.11 83.81 Favored 'General case' 0 C--N 1.379 1.872 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.496 178.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.759 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.2 mt -60.4 -51.24 70.34 Favored 'General case' 0 C--N 1.382 2.009 0 O-C-N 119.89 -1.756 . . . . 0.0 110.401 169.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.443 ' O ' ' N ' ' P' ' 129' ' ' ARG . 16.2 mt-10 -54.63 -52.88 60.89 Favored 'General case' 0 C--N 1.379 1.859 0 CA-C-O 122.434 1.111 . . . . 0.0 109.267 177.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.563 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -38.96 -67.62 0.2 Allowed 'General case' 0 C--N 1.379 1.891 0 CA-C-N 111.823 -2.444 . . . . 0.0 108.717 176.04 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.74 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.3 OUTLIER -62.28 -32.64 73.39 Favored 'General case' 0 C--N 1.393 2.462 0 CA-C-N 112.484 -2.144 . . . . 0.0 108.289 -170.117 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.804 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 12.6 t80 -68.8 -50.48 49.82 Favored 'General case' 0 C--N 1.388 2.247 0 CA-C-O 122.073 0.939 . . . . 0.0 110.77 174.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' P' ' 125' ' ' GLU . 8.6 mmm180 -62.33 -11.81 17.48 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.083 -1.871 . . . . 0.0 108.128 -167.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . 0.484 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 33.6 mt-30 -107.99 -40.46 5.23 Favored 'General case' 0 C--N 1.379 1.886 0 C-N-CA 126.378 1.871 . . . . 0.0 107.772 -172.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.5 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -155.19 102.48 2.3 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 111.943 -2.39 . . . . 0.0 109.501 -153.442 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . 0.644 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -77.15 -15.79 59.39 Favored 'General case' 0 C--N 1.387 2.205 0 CA-C-N 112.323 -2.217 . . . . 0.0 110.335 -165.629 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.775 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 2.6 m-30 -154.84 115.69 3.95 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.999 -1.455 . . . . 0.0 108.544 -158.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.504 HD22 ' HB3' ' P' ' 138' ' ' GLU . 21.1 mt -130.08 134.18 47.19 Favored 'General case' 0 C--N 1.398 2.717 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -157.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.2 154.11 25.62 Favored 'General case' 0 C--N 1.381 1.959 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 171.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.492 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.86 -45.89 99.58 Favored Pre-proline 0 CA--C 1.584 2.251 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -158.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 0.1 OUTLIER -52.55 -41.1 70.34 Favored 'Trans proline' 0 C--N 1.396 3.05 0 C-N-CA 122.631 2.22 . . . . 0.0 117.647 179.337 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.504 ' HB3' HD22 ' P' ' 134' ' ' LEU . 1.6 mm-40 -50.2 -69.45 0.11 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-O 123.509 1.623 . . . . 0.0 107.135 166.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.577 ' HB2' HG11 ' P' ' 153' ' ' VAL . 1.0 OUTLIER -69.12 -35.56 76.55 Favored 'General case' 0 C--N 1.389 2.291 0 CA-C-N 110.072 -3.24 . . . . 0.0 108.494 -158.339 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.63 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.2 mt-10 -53.29 -41.05 65.21 Favored 'General case' 0 C--N 1.38 1.926 0 CA-C-O 123.112 1.434 . . . . 0.0 108.539 176.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -64.67 -35.8 82.2 Favored 'General case' 0 C--N 1.38 1.921 0 CA-C-N 112.81 -1.996 . . . . 0.0 108.804 -169.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.74 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.3 tp -65.64 -42.99 90.84 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-O 123.211 1.482 . . . . 0.0 109.198 168.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.9 -33.89 67.38 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.429 -2.169 . . . . 0.0 108.227 174.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.629 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.7 m -73.28 -42.72 62.12 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 113.699 -1.591 . . . . 0.0 109.752 -178.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 78.7 mt -66.62 -48.02 70.79 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 124.659 2.171 . . . . 0.0 108.318 -165.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.986 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.56 -12.84 8.31 Favored 'Isoleucine or valine' 0 C--N 1.389 2.322 0 CA-C-N 110.821 -2.9 . . . . 0.0 107.933 -167.11 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 82.44 35.03 0.07 Allowed 'General case' 0 C--N 1.381 1.939 0 CA-C-O 125.755 2.693 . . . . 0.0 107.865 152.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.986 HD12 HD11 ' P' ' 146' ' ' ILE . 8.8 mt -96.17 170.81 9.0 Favored 'General case' 0 C--N 1.397 2.659 0 CA-C-N 111.571 -2.559 . . . . 0.0 109.382 169.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.643 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.2 p -92.46 140.15 24.04 Favored Pre-proline 0 CA--C 1.592 2.566 0 CA-C-O 122.738 1.256 . . . . 0.0 108.752 170.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.448 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 21.4 Cg_exo -55.08 -33.48 83.79 Favored 'Trans proline' 1 C--N 1.415 4.036 0 C-N-CA 122.902 2.401 . . . . 0.0 113.815 -160.234 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.21 -38.26 73.46 Favored 'General case' 0 C--N 1.382 2.003 0 C-N-CA 119.084 -1.046 . . . . 0.0 109.442 166.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.643 ' N ' ' O ' ' P' ' 149' ' ' THR . 49.1 mt-30 -69.36 -28.4 66.17 Favored 'General case' 0 C--N 1.387 2.214 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 -174.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.627 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.1 t -64.2 -71.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.186 0 CA-C-N 121.394 1.906 . . . . 0.0 109.259 164.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.627 ' N ' HG12 ' P' ' 153' ' ' VAL . 0.0 OUTLIER -34.69 -58.46 0.5 Allowed 'General case' 0 C--N 1.384 2.093 0 C-N-CA 125.012 1.325 . . . . 0.0 110.54 -176.175 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 28.8 mm -60.65 -38.85 79.69 Favored 'Isoleucine or valine' 0 C--N 1.381 1.969 0 CA-C-N 113.328 -1.76 . . . . 0.0 108.859 -172.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.759 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.1 t90 -67.66 -31.88 72.17 Favored 'General case' 0 C--N 1.384 2.07 0 O-C-N 121.168 -0.957 . . . . 0.0 109.451 172.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.804 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 62.9 m-85 -75.18 -40.14 59.63 Favored 'General case' 0 C--O 1.274 2.358 0 O-C-N 121.231 -0.918 . . . . 0.0 112.115 173.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.431 ' N ' ' O ' ' P' ' 154' ' ' LYS . 77.1 mt-30 -51.72 -61.76 2.05 Favored 'General case' 0 C--N 1.376 1.754 0 O-C-N 119.709 -1.869 . . . . 0.0 106.479 168.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -56.43 -24.19 43.62 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-O 117.446 -1.264 . . . . 0.0 109.448 -167.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.507 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 3.1 t60 -78.33 -39.66 38.91 Favored 'General case' 0 C--O 1.282 2.785 0 CA-C-N 121.606 2.003 . . . . 0.0 111.489 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.775 ' HD3' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.265 1.903 0 CA-C-N 122.668 2.485 . . . . 0.0 111.137 -177.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.547 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.8 m-85 . . . . . 0 C--O 1.258 1.515 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . 0.409 ' O ' ' N ' ' P' ' 121' ' ' THR . 1.2 p -65.88 147.64 53.05 Favored 'General case' 0 C--N 1.382 2.006 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -169.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -42.85 -36.56 1.53 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-N 113.843 -1.526 . . . . 0.0 109.286 -176.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.89 -65.54 0.55 Allowed 'General case' 0 C--N 1.382 2.014 0 CA-C-O 124.172 1.939 . . . . 0.0 109.261 174.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.566 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.0 mt-30 -50.96 -47.39 61.29 Favored 'General case' 0 C--N 1.381 1.967 0 CA-C-N 112.426 -2.17 . . . . 0.0 110.073 177.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.635 ' HA ' HD12 ' P' ' 124' ' ' LEU . 11.3 m -50.02 -57.83 6.76 Favored 'General case' 0 C--N 1.383 2.03 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 168.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.583 ' CE1' ' HG2' ' P' ' 126' ' ' ARG . 0.9 OUTLIER -52.86 -47.79 67.55 Favored 'General case' 0 C--N 1.383 2.038 0 CA-C-O 122.377 1.084 . . . . 0.0 110.017 -169.097 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.95 ' CD ' HG22 ' P' ' 146' ' ' ILE . 7.1 mt-10 -66.94 -35.86 80.93 Favored 'General case' 0 C--N 1.379 1.862 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.875 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.8 mt -60.43 -52.4 65.37 Favored 'General case' 0 C--N 1.383 2.043 0 O-C-N 120.044 -1.66 . . . . 0.0 110.592 168.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' P' ' 129' ' ' ARG . 15.8 mt-10 -53.77 -53.65 49.35 Favored 'General case' 0 C--N 1.379 1.854 0 CA-C-O 122.248 1.023 . . . . 0.0 108.874 177.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.583 ' HG2' ' CE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -38.05 -67.25 0.21 Allowed 'General case' 0 C--N 1.38 1.926 0 CA-C-N 111.683 -2.508 . . . . 0.0 108.679 176.403 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.725 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -64.14 -29.94 71.04 Favored 'General case' 0 C--N 1.394 2.501 0 CA-C-N 112.287 -2.233 . . . . 0.0 108.23 -169.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.8 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 12.3 t80 -69.44 -50.73 42.91 Favored 'General case' 0 C--N 1.389 2.29 0 O-C-N 121.134 -0.979 . . . . 0.0 110.956 172.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.45 ' N ' ' O ' ' P' ' 125' ' ' GLU . 10.1 mmm180 -62.28 -11.87 17.5 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.083 -1.872 . . . . 0.0 108.093 -166.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . 0.506 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 34.2 mt-30 -109.19 -39.74 5.16 Favored 'General case' 0 C--N 1.38 1.892 0 C-N-CA 126.355 1.862 . . . . 0.0 108.044 -171.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.505 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -153.15 109.36 3.35 Favored 'General case' 0 C--N 1.389 2.295 0 CA-C-N 112.24 -2.255 . . . . 0.0 109.217 -153.579 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -77.05 -19.77 56.73 Favored 'General case' 0 C--N 1.394 2.519 0 CA-C-N 112.171 -2.286 . . . . 0.0 110.806 -168.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.54 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 15.4 m-85 -159.82 114.34 2.31 Favored 'General case' 0 C--N 1.38 1.9 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.373 -153.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.614 HD22 ' HG3' ' P' ' 138' ' ' GLU . 27.1 mt -126.66 136.97 53.19 Favored 'General case' 0 C--N 1.399 2.754 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -158.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 155.16 25.93 Favored 'General case' 0 C--N 1.382 1.998 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 166.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.507 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.57 -49.62 91.2 Favored Pre-proline 0 CA--C 1.582 2.209 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.355 -161.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.507 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 81.3 Cg_exo -58.2 -28.69 84.99 Favored 'Trans proline' 0 C--N 1.401 3.297 0 C-N-CA 121.048 1.165 . . . . 0.0 114.894 -174.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.614 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.1 OUTLIER -54.03 -71.06 0.08 Allowed 'General case' 0 C--N 1.38 1.9 0 CA-C-O 124.704 2.192 . . . . 0.0 106.334 160.393 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.832 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.1 -40.14 82.66 Favored 'General case' 0 C--N 1.389 2.303 0 CA-C-N 109.965 -3.289 . . . . 0.0 108.885 -154.927 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.647 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 3.9 mt-10 -53.35 -39.17 63.93 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 123.163 1.459 . . . . 0.0 108.304 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -64.28 -35.46 80.91 Favored 'General case' 0 C--N 1.38 1.918 0 CA-C-N 112.945 -1.934 . . . . 0.0 108.732 -171.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.725 HD13 ' CG ' ' P' ' 127' ' ' ARG . 2.3 tp -65.47 -42.77 91.9 Favored 'General case' 0 C--N 1.383 2.023 0 CA-C-O 123.223 1.487 . . . . 0.0 109.038 168.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -57.04 -34.71 68.5 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-N 112.38 -2.191 . . . . 0.0 108.592 174.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.617 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 0.9 OUTLIER -73.51 -43.22 60.56 Favored 'General case' 0 C--N 1.387 2.225 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.19 -179.443 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . 0.725 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 75.0 mt -66.19 -48.06 71.9 Favored 'General case' 0 C--N 1.379 1.888 0 CA-C-O 124.743 2.211 . . . . 0.0 107.954 -164.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.987 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -94.68 -17.03 7.26 Favored 'Isoleucine or valine' 0 C--N 1.385 2.145 0 CA-C-N 110.544 -3.025 . . . . 0.0 107.84 -172.104 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . 0.725 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.0 OUTLIER 81.19 37.21 0.08 Allowed 'General case' 0 C--N 1.385 2.126 0 CA-C-N 111.494 -2.594 . . . . 0.0 108.112 152.777 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.987 HD12 HD11 ' P' ' 146' ' ' ILE . 6.1 mt -95.24 168.08 10.96 Favored 'General case' 0 C--N 1.39 2.35 0 CA-C-N 112.13 -2.305 . . . . 0.0 109.416 168.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.643 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.0 p -88.12 143.97 33.73 Favored Pre-proline 0 CA--C 1.587 2.392 0 CA-C-O 122.986 1.374 . . . . 0.0 108.273 172.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.402 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 1.3 Cg_endo -59.73 -38.44 80.85 Favored 'Trans proline' 1 C--N 1.415 4.031 0 C-N-CA 122.715 2.277 . . . . 0.0 112.073 -155.568 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . 0.518 HG22 HG12 ' P' ' 155' ' ' ILE . 0.4 OUTLIER -57.81 -29.47 64.93 Favored 'General case' 0 C--N 1.385 2.129 0 CA-C-O 118.081 -0.961 . . . . 0.0 110.343 167.754 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.643 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -73.64 -28.04 61.58 Favored 'General case' 0 C--N 1.388 2.258 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.618 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.3 t -64.38 -72.53 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 122.019 2.19 . . . . 0.0 109.439 164.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.832 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.27 -57.44 0.49 Allowed 'General case' 0 C--N 1.385 2.148 0 C-N-CA 125.188 1.395 . . . . 0.0 111.017 -177.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.518 HG12 HG22 ' P' ' 151' ' ' THR . 0.7 OUTLIER -53.04 -47.81 53.71 Favored 'Isoleucine or valine' 0 C--N 1.386 2.17 0 CA-C-N 112.86 -1.973 . . . . 0.0 108.967 -176.45 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.875 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.4 t90 -66.19 -31.06 71.67 Favored 'General case' 0 C--N 1.382 1.98 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.8 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 69.0 m-85 -74.82 -39.87 61.4 Favored 'General case' 0 C--O 1.274 2.373 0 O-C-N 121.257 -0.902 . . . . 0.0 112.057 174.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' P' ' 154' ' ' LYS . 24.7 mt-30 -49.71 -63.87 0.98 Allowed 'General case' 0 C--N 1.377 1.762 0 O-C-N 119.558 -1.964 . . . . 0.0 106.953 167.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -57.48 -13.55 3.79 Favored 'General case' 0 C--N 1.388 2.253 0 CA-C-O 118.129 -0.938 . . . . 0.0 111.024 -165.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.559 ' ND1' ' CE2' ' P' ' 128' ' ' PHE . 31.5 t-80 -78.44 -56.45 4.43 Favored 'General case' 0 C--O 1.279 2.655 0 CA-C-N 120.46 1.482 . . . . 0.0 110.92 167.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.54 ' HD2' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.016 0 O-C-N 118.639 -2.538 . . . . 0.0 110.587 -155.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.495 ' CE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 . . . . . 0 C--O 1.257 1.487 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . 0.402 ' O ' ' N ' ' P' ' 121' ' ' THR . 1.3 p -65.62 147.56 53.2 Favored 'General case' 0 C--N 1.382 1.98 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -166.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' P' ' 122' ' ' TYR . 36.6 ttmt -42.62 -36.0 1.26 Allowed 'General case' 0 C--N 1.381 1.963 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.489 -176.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.04 -67.78 0.23 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 123.995 1.855 . . . . 0.0 109.207 173.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.569 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.6 mt-30 -47.68 -50.56 24.49 Favored 'General case' 0 C--N 1.382 2.014 0 CA-C-N 112.47 -2.15 . . . . 0.0 110.217 176.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.592 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.1 m -49.44 -58.73 4.61 Favored 'General case' 0 C--N 1.383 2.026 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 169.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.575 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 1.2 t80 -52.97 -47.2 68.33 Favored 'General case' 0 C--N 1.384 2.071 0 CA-C-O 122.435 1.112 . . . . 0.0 109.825 -169.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.977 ' CD ' HG22 ' P' ' 146' ' ' ILE . 3.2 mt-10 -66.81 -36.7 82.99 Favored 'General case' 0 C--O 1.265 1.91 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.063 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.794 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.7 mt -60.56 -52.19 66.21 Favored 'General case' 0 C--N 1.382 1.984 0 O-C-N 119.521 -1.987 . . . . 0.0 109.88 169.033 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.47 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.2 mt-10 -53.77 -51.35 63.71 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-O 122.245 1.021 . . . . 0.0 109.213 178.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.575 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.6 -69.68 0.12 Allowed 'General case' 0 C--N 1.379 1.874 0 CA-C-N 111.767 -2.47 . . . . 0.0 108.69 175.045 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.657 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.4 OUTLIER -58.2 -38.09 76.07 Favored 'General case' 0 C--N 1.391 2.398 0 CA-C-N 112.999 -1.91 . . . . 0.0 108.288 -171.768 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.83 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 20.8 t80 -69.71 -45.5 68.1 Favored 'General case' 0 C--N 1.381 1.958 0 O-C-N 121.559 -0.713 . . . . 0.0 110.817 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' P' ' 125' ' ' GLU . 13.8 mmm180 -62.33 -15.98 51.41 Favored 'General case' 0 C--N 1.38 1.915 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 -170.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . 0.425 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 37.0 mt-30 -104.41 -37.9 7.02 Favored 'General case' 0 C--N 1.38 1.908 0 C-N-CA 126.776 2.031 . . . . 0.0 107.503 -168.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.527 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -155.34 107.75 2.69 Favored 'General case' 0 C--N 1.387 2.232 0 CA-C-N 111.914 -2.403 . . . . 0.0 108.84 -153.86 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.86 -21.12 60.22 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 112.218 -2.265 . . . . 0.0 110.873 -167.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.536 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 33.8 m-85 -159.33 112.84 2.28 Favored 'General case' 0 C--N 1.38 1.901 0 CA-C-N 113.305 -1.77 . . . . 0.0 108.14 -153.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.657 HD11 ' CD ' ' P' ' 127' ' ' ARG . 18.6 mt -124.63 135.83 53.42 Favored 'General case' 0 C--N 1.396 2.611 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 -158.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.12 155.05 26.44 Favored 'General case' 0 C--N 1.381 1.973 0 O-C-N 120.612 -1.305 . . . . 0.0 107.498 167.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.513 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.42 -49.62 91.51 Favored Pre-proline 0 CA--C 1.583 2.22 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 -160.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.513 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 79.7 Cg_exo -58.15 -30.03 89.21 Favored 'Trans proline' 0 C--N 1.402 3.342 0 N-CA-C 114.87 1.065 . . . . 0.0 114.87 -175.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.586 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.3 OUTLIER -54.37 -69.46 0.13 Allowed 'General case' 0 C--N 1.38 1.912 0 CA-C-O 124.54 2.114 . . . . 0.0 106.378 161.164 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.93 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.08 -39.5 82.91 Favored 'General case' 0 C--N 1.392 2.428 0 CA-C-N 109.942 -3.299 . . . . 0.0 108.657 -154.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.633 ' O ' ' N ' ' P' ' 144' ' ' SER . 4.0 mt-10 -53.13 -38.03 62.31 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-O 122.498 1.142 . . . . 0.0 108.568 178.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -64.22 -37.03 86.03 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-N 113.142 -1.845 . . . . 0.0 109.347 -174.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.63 ' O ' HG23 ' P' ' 146' ' ' ILE . 0.4 OUTLIER -57.86 -47.33 83.02 Favored 'General case' 0 C--N 1.385 2.151 0 CA-C-O 123.125 1.44 . . . . 0.0 108.719 164.804 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -62.73 -31.71 72.69 Favored 'General case' 0 C--N 1.387 2.208 0 CA-C-N 112.104 -2.316 . . . . 0.0 109.087 -179.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.633 ' N ' ' O ' ' P' ' 140' ' ' GLU . 5.9 t -74.45 -41.95 59.94 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-N 114.243 -1.344 . . . . 0.0 109.037 -178.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . 0.462 HD13 ' OE1' ' P' ' 123' ' ' GLU . 39.5 mt -63.86 -46.62 84.18 Favored 'General case' 0 C--N 1.381 1.962 0 CA-C-O 124.52 2.105 . . . . 0.0 108.269 -167.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 1.022 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -101.41 -12.67 8.55 Favored 'Isoleucine or valine' 0 C--N 1.388 2.25 0 CA-C-N 110.739 -2.937 . . . . 0.0 108.155 -165.437 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 82.08 34.42 0.08 Allowed 'General case' 0 C--N 1.383 2.047 0 CA-C-O 125.547 2.594 . . . . 0.0 108.147 153.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 1.022 HD12 HD11 ' P' ' 146' ' ' ILE . 7.6 mt -96.49 169.47 9.88 Favored 'General case' 0 C--N 1.397 2.637 0 CA-C-N 111.652 -2.522 . . . . 0.0 109.475 169.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.613 ' O ' ' N ' ' P' ' 152' ' ' GLN . 21.5 p -91.31 145.29 31.17 Favored Pre-proline 0 CA--C 1.588 2.435 0 CA-C-O 122.91 1.338 . . . . 0.0 108.735 171.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.426 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 2.2 Cg_endo -62.07 -37.43 64.1 Favored 'Trans proline' 1 C--N 1.414 4.021 0 C-N-CA 122.682 2.255 . . . . 0.0 113.128 -155.864 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.92 -35.62 61.86 Favored 'General case' 0 C--N 1.384 2.066 0 C-N-CA 119.676 -0.81 . . . . 0.0 109.671 165.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.613 ' N ' ' O ' ' P' ' 149' ' ' THR . 44.3 mt-30 -70.48 -27.42 64.2 Favored 'General case' 0 C--N 1.389 2.296 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 -177.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.612 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.3 t -64.68 -71.84 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.105 0 CA-C-N 121.487 1.949 . . . . 0.0 109.666 163.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.93 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.8 -59.61 0.4 Allowed 'General case' 0 C--N 1.386 2.188 0 CA-C-O 122.668 1.223 . . . . 0.0 110.656 -178.163 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 10.2 mm -56.25 -41.89 71.85 Favored 'Isoleucine or valine' 0 C--N 1.381 1.948 0 CA-C-N 113.114 -1.857 . . . . 0.0 108.984 -174.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.794 ' HB3' HD22 ' P' ' 124' ' ' LEU . 7.4 t90 -68.24 -32.24 72.3 Favored 'General case' 0 C--N 1.382 1.98 0 O-C-N 120.962 -1.086 . . . . 0.0 109.637 173.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.83 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 59.6 m-85 -74.81 -40.48 61.07 Favored 'General case' 0 C--O 1.276 2.484 0 O-C-N 120.932 -1.105 . . . . 0.0 112.074 174.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' P' ' 154' ' ' LYS . 25.3 mt-30 -48.94 -64.19 0.88 Allowed 'General case' 0 C--N 1.377 1.795 0 O-C-N 119.543 -1.973 . . . . 0.0 106.674 167.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -55.94 -23.34 31.37 Favored 'General case' 0 C--N 1.389 2.285 0 CA-C-O 117.579 -1.2 . . . . 0.0 109.706 -163.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.527 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.7 OUTLIER -76.34 -47.64 22.78 Favored 'General case' 0 C--O 1.281 2.758 0 CA-C-N 121.239 1.836 . . . . 0.0 110.949 177.108 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.536 ' CD ' ' CE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.933 0 CA-C-N 122.815 2.552 . . . . 0.0 110.619 -161.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.668 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 1.1 m-85 . . . . . 0 C--O 1.255 1.388 0 N-CA-C 107.832 -1.174 . . . . 0.0 107.832 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.41 148.03 52.42 Favored 'General case' 0 C--N 1.382 1.99 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -168.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' P' ' 122' ' ' TYR . 37.2 ttmt -42.15 -36.02 1.08 Allowed 'General case' 0 C--N 1.381 1.966 0 CA-C-N 114.037 -1.438 . . . . 0.0 109.29 -177.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.93 -67.72 0.24 Allowed 'General case' 0 C--N 1.382 1.982 0 CA-C-O 124.217 1.961 . . . . 0.0 109.104 173.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.541 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.7 mt-30 -48.56 -48.05 39.02 Favored 'General case' 0 C--N 1.382 2.008 0 CA-C-N 112.419 -2.173 . . . . 0.0 110.052 177.188 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.666 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.9 m -52.05 -56.37 14.78 Favored 'General case' 0 C--N 1.383 2.027 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 169.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.663 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.2 t80 -53.16 -46.68 68.99 Favored 'General case' 0 C--N 1.383 2.023 0 CA-C-O 122.325 1.059 . . . . 0.0 110.15 -170.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.648 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.1 OUTLIER -66.29 -39.17 89.19 Favored 'General case' 0 C--N 1.38 1.894 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.219 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.805 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -60.16 -49.74 76.42 Favored 'General case' 0 C--N 1.385 2.142 0 O-C-N 120.691 -1.255 . . . . 0.0 109.727 172.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.54 ' O ' ' N ' ' P' ' 129' ' ' ARG . 13.3 mt-10 -55.17 -53.3 57.78 Favored 'General case' 0 C--N 1.38 1.909 0 CA-C-O 122.509 1.147 . . . . 0.0 109.461 176.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.663 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.9 -69.23 0.14 Allowed 'General case' 0 C--N 1.378 1.825 0 CA-C-N 111.897 -2.41 . . . . 0.0 108.665 177.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.848 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -57.49 -37.25 72.62 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 112.686 -2.052 . . . . 0.0 108.342 -173.334 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.827 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 24.7 t80 -70.0 -45.98 66.13 Favored 'General case' 0 C--N 1.38 1.927 0 CA-C-O 121.58 0.705 . . . . 0.0 110.752 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.54 ' N ' ' O ' ' P' ' 125' ' ' GLU . 7.6 mmm180 -62.54 -14.45 42.16 Favored 'General case' 0 C--N 1.381 1.941 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -169.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' P' ' 126' ' ' ARG . 39.4 mt-30 -107.67 -37.84 6.04 Favored 'General case' 0 C--N 1.38 1.91 0 C-N-CA 126.607 1.963 . . . . 0.0 107.687 -167.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.493 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -154.2 105.78 2.73 Favored 'General case' 0 C--N 1.388 2.273 0 CA-C-N 112.018 -2.355 . . . . 0.0 108.83 -153.552 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . 0.745 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 3.2 mtt85 -77.36 -18.31 57.48 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 111.841 -2.436 . . . . 0.0 110.474 -169.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.745 ' HD1' ' O ' ' P' ' 132' ' ' ARG . 4.1 m-30 -154.66 111.25 3.28 Favored 'General case' 0 C--N 1.38 1.921 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.3 -154.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.614 HD22 ' HG3' ' P' ' 138' ' ' GLU . 31.5 mt -126.13 136.66 53.15 Favored 'General case' 0 C--N 1.397 2.65 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -161.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.54 155.31 25.8 Favored 'General case' 0 C--N 1.382 1.989 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 166.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.509 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.59 -49.43 92.09 Favored Pre-proline 0 CA--C 1.583 2.228 0 C-N-CA 120.049 -0.661 . . . . 0.0 109.347 -161.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 82.9 Cg_exo -58.15 -28.64 84.62 Favored 'Trans proline' 0 C--N 1.401 3.31 0 C-N-CA 121.001 1.134 . . . . 0.0 114.969 -175.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.614 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -53.85 -71.06 0.08 Allowed 'General case' 0 C--N 1.38 1.933 0 CA-C-O 124.524 2.107 . . . . 0.0 106.44 160.201 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.91 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.33 -39.66 81.87 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 109.969 -3.287 . . . . 0.0 108.79 -154.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.653 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.5 mt-10 -53.28 -39.3 63.82 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-O 123.177 1.465 . . . . 0.0 108.42 177.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -63.67 -35.29 80.04 Favored 'General case' 0 C--N 1.379 1.885 0 CA-C-N 112.846 -1.979 . . . . 0.0 108.633 -171.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.848 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.4 tp -65.95 -42.7 89.65 Favored 'General case' 0 C--N 1.383 2.056 0 CA-C-O 123.333 1.54 . . . . 0.0 109.186 169.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.76 -34.33 67.47 Favored 'General case' 0 C--N 1.39 2.334 0 CA-C-N 112.287 -2.233 . . . . 0.0 108.378 174.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.578 ' N ' ' O ' ' P' ' 140' ' ' GLU . 2.6 t -73.35 -43.6 60.4 Favored 'General case' 0 C--N 1.387 2.237 0 CA-C-N 114.242 -1.344 . . . . 0.0 110.296 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.99 -47.72 73.59 Favored 'General case' 0 C--N 1.378 1.847 0 CA-C-O 124.895 2.283 . . . . 0.0 107.922 -163.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.985 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.66 -16.83 7.17 Favored 'Isoleucine or valine' 0 C--N 1.385 2.125 0 CA-C-N 110.482 -3.054 . . . . 0.0 107.761 -171.767 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 6.4 mmt180 81.31 37.36 0.08 Allowed 'General case' 0 C--N 1.384 2.095 0 CA-C-N 111.566 -2.561 . . . . 0.0 108.111 152.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.985 HD12 HD11 ' P' ' 146' ' ' ILE . 6.4 mt -95.27 167.99 11.01 Favored 'General case' 0 C--N 1.391 2.391 0 CA-C-N 112.179 -2.282 . . . . 0.0 109.46 168.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.647 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -88.51 144.07 33.15 Favored Pre-proline 0 CA--C 1.588 2.404 0 CA-C-O 122.95 1.357 . . . . 0.0 108.299 173.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.409 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 1.8 Cg_endo -60.28 -38.38 75.93 Favored 'Trans proline' 1 C--N 1.414 4.02 0 C-N-CA 122.736 2.291 . . . . 0.0 112.416 -155.436 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . 0.504 HG22 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -57.05 -29.37 63.35 Favored 'General case' 0 C--N 1.384 2.103 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.203 167.255 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.647 ' N ' ' O ' ' P' ' 149' ' ' THR . 43.9 mt-30 -74.08 -28.36 61.35 Favored 'General case' 0 C--N 1.388 2.28 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.628 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.1 t -64.29 -71.44 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.077 0 CA-C-N 122.074 2.215 . . . . 0.0 109.399 164.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.91 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.36 -59.35 0.45 Allowed 'General case' 0 C--N 1.386 2.154 0 CA-C-O 122.969 1.366 . . . . 0.0 110.853 -177.518 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.504 HG12 HG22 ' P' ' 151' ' ' THR . 0.5 OUTLIER -52.43 -47.19 47.49 Favored 'Isoleucine or valine' 0 C--N 1.389 2.309 0 CA-C-N 112.653 -2.067 . . . . 0.0 108.7 -176.121 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.805 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.2 t90 -66.58 -32.13 73.28 Favored 'General case' 0 C--N 1.382 2.013 0 O-C-N 121.432 -0.792 . . . . 0.0 109.144 177.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.827 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 63.7 m-85 -75.57 -40.04 57.26 Favored 'General case' 0 C--O 1.275 2.419 0 O-C-N 120.962 -1.086 . . . . 0.0 112.275 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -46.91 -66.62 0.38 Allowed 'General case' 0 C--N 1.376 1.737 0 O-C-N 119.44 -2.038 . . . . 0.0 107.171 165.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -56.01 -23.81 35.26 Favored 'General case' 0 C--N 1.391 2.403 0 CA-C-N 113.994 -1.457 . . . . 0.0 109.324 -161.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.557 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.8 OUTLIER -78.87 -40.11 33.38 Favored 'General case' 0 C--O 1.288 3.116 0 CA-C-N 121.249 1.84 . . . . 0.0 111.78 174.377 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.686 ' CD ' ' HE1' ' P' ' 133' ' ' TYR 0.278 40.0 mtm180 . . . . . 0 C--O 1.271 2.213 0 CA-C-N 123.588 2.904 . . . . 0.0 110.531 -176.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.518 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.5 OUTLIER . . . . . 0 C--O 1.253 1.24 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.16 149.07 51.0 Favored 'General case' 0 C--N 1.383 2.06 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 -175.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.43 ' O ' ' N ' ' P' ' 122' ' ' TYR . 35.4 ttmt -44.85 -36.35 3.23 Favored 'General case' 0 C--N 1.382 1.981 0 CA-C-N 113.165 -1.834 . . . . 0.0 109.219 -178.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.0 -63.78 1.03 Allowed 'General case' 0 C--N 1.382 2.008 0 CA-C-O 124.266 1.984 . . . . 0.0 109.22 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.56 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.0 mt-30 -52.33 -43.17 64.42 Favored 'General case' 0 C--N 1.382 1.989 0 CA-C-N 112.407 -2.179 . . . . 0.0 109.734 177.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.592 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.9 m -54.39 -55.49 28.09 Favored 'General case' 0 C--N 1.381 1.965 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 169.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.672 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.6 OUTLIER -53.04 -47.57 68.28 Favored 'General case' 0 C--N 1.383 2.045 0 CA-C-O 122.622 1.201 . . . . 0.0 110.003 -169.805 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.715 ' HB2' HD11 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -66.52 -38.38 87.08 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 113.864 -1.516 . . . . 0.0 108.004 179.936 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.795 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.1 mt -61.05 -50.56 72.82 Favored 'General case' 0 C--N 1.385 2.12 0 O-C-N 120.169 -1.582 . . . . 0.0 109.544 171.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.546 ' O ' ' N ' ' P' ' 129' ' ' ARG . 13.4 mt-10 -55.14 -44.65 75.29 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 122.756 1.265 . . . . 0.0 109.4 178.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.672 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -49.23 -66.77 0.34 Allowed 'General case' 0 C--N 1.377 1.795 0 CA-C-N 112.08 -2.327 . . . . 0.0 108.405 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.673 ' HB3' HD11 ' P' ' 134' ' ' LEU . 4.0 mmt85 -58.47 -36.01 73.07 Favored 'General case' 0 C--N 1.381 1.97 0 CA-C-N 113.29 -1.777 . . . . 0.0 109.61 -177.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.688 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 11.5 t80 -67.44 -51.81 47.12 Favored 'General case' 0 C--N 1.385 2.141 0 CA-C-N 119.627 1.103 . . . . 0.0 110.266 174.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' P' ' 125' ' ' GLU . 0.2 OUTLIER -62.79 -14.82 49.71 Favored 'General case' 0 C--N 1.379 1.889 0 CA-C-N 112.815 -1.993 . . . . 0.0 108.203 -164.466 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -104.61 -40.09 6.14 Favored 'General case' 0 C--N 1.378 1.846 0 C-N-CA 126.327 1.851 . . . . 0.0 106.966 -171.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.519 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.5 OUTLIER -155.74 98.73 1.95 Allowed 'General case' 0 C--N 1.385 2.145 0 CA-C-N 111.952 -2.385 . . . . 0.0 110.003 -153.2 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . 0.5 ' HG2' ' CD2' ' P' ' 133' ' ' TYR . 0.1 OUTLIER -76.53 -6.72 53.06 Favored 'General case' 0 C--N 1.394 2.523 0 CA-C-N 112.133 -2.303 . . . . 0.0 110.985 -162.164 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.515 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 6.0 m-85 -162.68 108.51 1.19 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.0 -156.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.673 HD11 ' HB3' ' P' ' 127' ' ' ARG . 15.0 mt -122.44 135.65 54.72 Favored 'General case' 0 C--N 1.4 2.764 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -154.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.23 154.52 25.37 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 169.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.511 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.92 -49.23 94.5 Favored Pre-proline 0 CA--C 1.583 2.249 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.438 -161.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.511 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 81.9 Cg_exo -58.7 -29.61 90.0 Favored 'Trans proline' 0 C--N 1.401 3.341 0 N-CA-C 115.016 1.122 . . . . 0.0 115.016 -173.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.591 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -54.89 -70.48 0.1 Allowed 'General case' 0 C--N 1.382 2.006 0 CA-C-O 124.754 2.216 . . . . 0.0 106.31 161.905 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 1.004 ' NH2' ' HG3' ' P' ' 154' ' ' LYS . 2.0 ptt85 -66.85 -40.63 87.98 Favored 'General case' 0 C--N 1.393 2.476 0 CA-C-N 109.97 -3.287 . . . . 0.0 108.684 -155.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.627 ' O ' ' N ' ' P' ' 144' ' ' SER . 3.5 mt-10 -53.57 -41.01 66.09 Favored 'General case' 0 C--N 1.38 1.931 0 O-C-N 120.68 -1.262 . . . . 0.0 108.486 176.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -63.71 -37.89 89.05 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 112.933 -1.939 . . . . 0.0 109.15 -172.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.715 HD11 ' HB2' ' P' ' 123' ' ' GLU . 0.8 OUTLIER -58.1 -45.78 86.65 Favored 'General case' 0 C--N 1.386 2.172 0 CA-C-O 123.136 1.446 . . . . 0.0 109.056 167.278 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.597 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -62.87 -33.18 74.74 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 112.175 -2.284 . . . . 0.0 109.093 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.627 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.6 OUTLIER -73.66 -39.76 64.2 Favored 'General case' 0 C--N 1.384 2.101 0 CA-C-N 114.071 -1.422 . . . . 0.0 109.471 -177.52 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 40.1 mt -66.87 -47.41 71.97 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-O 124.57 2.128 . . . . 0.0 108.491 -166.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.999 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -98.41 -12.74 8.29 Favored 'Isoleucine or valine' 0 C--N 1.389 2.312 0 CA-C-N 110.87 -2.877 . . . . 0.0 107.954 -166.932 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 82.34 35.43 0.07 Allowed 'General case' 0 C--N 1.381 1.959 0 CA-C-O 125.774 2.702 . . . . 0.0 107.788 153.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.999 HD12 HD11 ' P' ' 146' ' ' ILE . 7.7 mt -96.17 170.28 9.37 Favored 'General case' 0 C--N 1.397 2.642 0 CA-C-N 111.54 -2.573 . . . . 0.0 109.42 168.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.618 ' O ' ' N ' ' P' ' 152' ' ' GLN . 19.2 p -92.93 144.65 28.79 Favored Pre-proline 0 CA--C 1.59 2.484 0 CA-C-O 123.168 1.461 . . . . 0.0 108.977 171.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.483 ' HB2' ' NH1' ' P' ' 139' ' ' ARG . 1.2 Cg_endo -58.76 -38.98 86.13 Favored 'Trans proline' 1 C--N 1.416 4.096 0 C-N-CA 122.616 2.211 . . . . 0.0 113.064 -156.093 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -34.89 62.75 Favored 'General case' 0 C--N 1.383 2.048 0 C-N-CA 119.945 -0.702 . . . . 0.0 109.755 167.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.618 ' N ' ' O ' ' P' ' 149' ' ' THR . 46.1 mt-30 -69.89 -27.92 65.2 Favored 'General case' 0 C--N 1.389 2.295 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 -176.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.602 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.4 t -64.39 -72.37 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.122 0 CA-C-N 121.273 1.852 . . . . 0.0 109.629 164.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 1.004 ' HG3' ' NH2' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.26 -55.3 0.51 Allowed 'General case' 0 C--N 1.383 2.065 0 C-N-CA 124.975 1.31 . . . . 0.0 110.536 -176.402 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 11.3 mm -61.49 -40.57 86.87 Favored 'Isoleucine or valine' 0 C--N 1.383 2.041 0 CA-C-N 113.999 -1.455 . . . . 0.0 109.481 -173.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.795 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.3 t90 -67.37 -31.53 71.83 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 121.168 -0.957 . . . . 0.0 109.195 172.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.688 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 30.1 m-85 -75.42 -42.85 52.59 Favored 'General case' 0 C--O 1.274 2.383 0 O-C-N 121.132 -0.98 . . . . 0.0 111.871 175.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -49.27 -60.37 2.87 Favored 'General case' 0 C--N 1.378 1.807 0 O-C-N 119.51 -1.994 . . . . 0.0 107.117 169.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -56.01 -24.99 42.44 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-O 117.677 -1.154 . . . . 0.0 109.494 -166.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.552 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.5 OUTLIER -77.15 -45.45 26.74 Favored 'General case' 0 C--O 1.284 2.88 0 CA-C-N 121.374 1.897 . . . . 0.0 111.479 178.344 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.515 ' CD ' ' CE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 1.988 0 CA-C-N 122.586 2.448 . . . . 0.0 109.513 -164.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.585 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.251 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.84 148.58 50.99 Favored 'General case' 0 C--N 1.384 2.105 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 -174.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.405 ' O ' ' N ' ' P' ' 122' ' ' TYR . 22.9 ttmt -44.9 -36.72 3.47 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-N 113.134 -1.848 . . . . 0.0 109.17 -177.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' P' ' 122' ' ' TYR . . . -53.35 -62.06 1.89 Allowed 'General case' 0 C--N 1.383 2.046 0 CA-C-O 124.242 1.973 . . . . 0.0 109.242 174.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 82.0 mt-30 -54.48 -45.55 73.24 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 112.538 -2.119 . . . . 0.0 109.872 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.58 ' HA ' HD12 ' P' ' 124' ' ' LEU . 10.7 m -49.74 -56.68 9.35 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 168.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.722 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.4 OUTLIER -52.94 -48.27 67.47 Favored 'General case' 0 C--N 1.382 2.01 0 CA-C-O 122.609 1.195 . . . . 0.0 110.052 -168.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.705 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.75 -37.1 83.96 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.113 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.755 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.9 mt -60.52 -51.86 67.66 Favored 'General case' 0 C--N 1.384 2.086 0 O-C-N 120.281 -1.512 . . . . 0.0 109.493 170.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' P' ' 129' ' ' ARG . 10.2 mt-10 -55.35 -48.97 73.44 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-O 122.686 1.231 . . . . 0.0 109.598 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.722 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.92 -67.52 0.25 Allowed 'General case' 0 C--N 1.378 1.814 0 CA-C-N 112.191 -2.277 . . . . 0.0 109.14 174.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.575 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.5 OUTLIER -60.33 -37.87 81.98 Favored 'General case' 0 C--N 1.39 2.37 0 CA-C-N 112.388 -2.187 . . . . 0.0 108.191 -171.345 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.807 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 15.7 t80 -69.94 -47.59 61.74 Favored 'General case' 0 C--N 1.381 1.976 0 O-C-N 121.409 -0.807 . . . . 0.0 110.183 177.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.552 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 4.6 mmm180 -62.35 -20.04 63.98 Favored 'General case' 0 C--N 1.38 1.927 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -168.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -91.58 -42.55 10.16 Favored 'General case' 0 C--N 1.379 1.85 0 CA-C-O 124.126 1.917 . . . . 0.0 106.935 -174.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.438 ' HG2' ' CD2' ' P' ' 134' ' ' LEU . 2.6 tp-100 -152.81 123.87 7.5 Favored 'General case' 0 C--N 1.386 2.169 0 CA-C-N 111.422 -2.626 . . . . 0.0 110.313 -155.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . 0.526 ' HG2' ' CG ' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -79.29 -23.83 43.31 Favored 'General case' 0 C--N 1.386 2.166 0 CA-C-N 112.784 -2.007 . . . . 0.0 110.8 -173.172 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.657 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 1.0 OUTLIER -155.22 112.21 3.28 Favored 'General case' 0 C--N 1.377 1.798 0 CA-C-O 123.472 1.606 . . . . 0.0 108.986 -152.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.613 HD22 ' HG3' ' P' ' 138' ' ' GLU . 27.3 mt -123.22 134.79 54.1 Favored 'General case' 0 C--N 1.405 3.011 0 CA-C-N 112.598 -2.092 . . . . 0.0 108.042 -160.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.08 155.24 26.39 Favored 'General case' 0 C--N 1.382 1.988 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 167.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.537 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.46 -49.42 92.44 Favored Pre-proline 0 CA--C 1.583 2.244 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.233 -160.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.537 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 76.7 Cg_exo -58.63 -29.23 88.6 Favored 'Trans proline' 0 C--N 1.401 3.332 0 C-N-CA 121.057 1.171 . . . . 0.0 115.041 -175.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.613 ' HG3' HD22 ' P' ' 134' ' ' LEU . 2.4 mm-40 -54.02 -70.43 0.1 Allowed 'General case' 0 C--N 1.38 1.896 0 CA-C-O 124.624 2.154 . . . . 0.0 106.456 160.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.875 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.18 -39.15 82.6 Favored 'General case' 0 C--N 1.39 2.368 0 CA-C-N 109.907 -3.315 . . . . 0.0 108.75 -154.592 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.62 ' O ' ' N ' ' P' ' 144' ' ' SER . 5.1 mt-10 -53.36 -39.02 63.83 Favored 'General case' 0 C--N 1.38 1.91 0 CA-C-O 122.61 1.195 . . . . 0.0 108.505 177.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -63.54 -37.13 86.13 Favored 'General case' 0 C--N 1.379 1.879 0 CA-C-N 113.016 -1.902 . . . . 0.0 109.322 -173.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.635 ' CD1' HD13 ' P' ' 146' ' ' ILE . 0.7 OUTLIER -58.7 -46.12 87.98 Favored 'General case' 0 C--N 1.387 2.201 0 CA-C-O 122.974 1.368 . . . . 0.0 108.87 166.287 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.38 -31.71 72.93 Favored 'General case' 0 C--N 1.385 2.139 0 CA-C-N 112.339 -2.21 . . . . 0.0 109.217 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.62 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.9 OUTLIER -74.25 -41.56 61.08 Favored 'General case' 0 C--N 1.384 2.08 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.666 179.552 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . 0.561 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 43.5 mt -65.13 -48.44 73.57 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-O 124.906 2.289 . . . . 0.0 108.039 -165.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.991 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.51 -16.94 7.02 Favored 'Isoleucine or valine' 0 C--N 1.386 2.153 0 CA-C-N 110.316 -3.129 . . . . 0.0 107.739 -170.828 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . 0.599 ' HG3' ' O ' ' P' ' 144' ' ' SER . 0.1 OUTLIER 81.21 37.71 0.08 Allowed 'General case' 0 C--N 1.386 2.188 0 CA-C-N 111.375 -2.648 . . . . 0.0 108.055 153.008 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.991 HD12 HD11 ' P' ' 146' ' ' ILE . 5.7 mt -95.03 168.5 10.74 Favored 'General case' 0 C--N 1.39 2.354 0 CA-C-N 112.224 -2.262 . . . . 0.0 109.294 168.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.65 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.9 p -88.6 143.03 31.44 Favored Pre-proline 0 CA--C 1.588 2.415 0 CA-C-O 122.854 1.311 . . . . 0.0 108.01 173.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -60.19 -37.41 83.47 Favored 'Trans proline' 0 C--N 1.413 3.953 0 C-N-CA 122.652 2.235 . . . . 0.0 112.054 -155.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.35 -29.06 65.67 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.67 167.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.65 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.9 mt-30 -73.52 -28.33 61.83 Favored 'General case' 0 C--N 1.39 2.333 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.613 HG13 ' CD2' ' P' ' 157' ' ' PHE . 1.2 t -64.48 -71.14 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.077 0 CA-C-N 121.901 2.137 . . . . 0.0 109.597 165.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.875 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.95 -57.98 0.45 Allowed 'General case' 0 C--N 1.385 2.139 0 C-N-CA 124.762 1.225 . . . . 0.0 110.531 -176.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.58 HD12 ' OE1' ' P' ' 158' ' ' GLN . 0.2 OUTLIER -58.59 -42.39 84.63 Favored 'Isoleucine or valine' 0 C--N 1.383 2.057 0 CA-C-N 113.389 -1.732 . . . . 0.0 108.994 -172.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.755 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.4 t90 -66.68 -32.23 73.42 Favored 'General case' 0 C--N 1.385 2.11 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.807 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 49.0 m-85 -74.35 -40.56 62.06 Favored 'General case' 0 C--O 1.272 2.261 0 O-C-N 121.072 -1.018 . . . . 0.0 111.998 173.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.58 ' OE1' HD12 ' P' ' 155' ' ' ILE . 73.2 mt-30 -50.97 -59.32 4.27 Favored 'General case' 0 C--N 1.378 1.813 0 O-C-N 119.664 -1.898 . . . . 0.0 106.77 169.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -56.04 -25.01 43.02 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.923 -166.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.559 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.4 OUTLIER -77.39 -47.58 19.47 Favored 'General case' 0 C--O 1.281 2.736 0 CA-C-N 121.714 2.052 . . . . 0.0 111.327 175.354 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.657 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.957 0 CA-C-N 122.985 2.63 . . . . 0.0 110.762 -160.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.618 ' CD1' HD22 ' P' ' 148' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.258 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.45 149.48 50.17 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -175.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.417 ' O ' ' N ' ' P' ' 122' ' ' TYR . 31.8 ttmt -44.94 -36.06 3.18 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.538 -1.665 . . . . 0.0 109.252 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -52.88 -62.73 1.46 Allowed 'General case' 0 C--N 1.383 2.033 0 CA-C-O 124.305 2.003 . . . . 0.0 109.128 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.554 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.4 mt-30 -54.85 -43.99 73.57 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-N 112.42 -2.173 . . . . 0.0 109.709 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.554 ' HA ' HD12 ' P' ' 124' ' ' LEU . 9.8 m -51.18 -57.68 8.12 Favored 'General case' 0 C--N 1.385 2.129 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 166.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.717 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.7 OUTLIER -53.04 -48.15 67.86 Favored 'General case' 0 C--N 1.382 2.021 0 CA-C-O 122.487 1.136 . . . . 0.0 110.051 -168.5 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.749 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.5 OUTLIER -66.33 -37.85 86.31 Favored 'General case' 0 C--N 1.378 1.834 0 CA-C-N 114.562 -1.199 . . . . 0.0 107.878 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.792 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.6 mt -60.46 -50.82 72.07 Favored 'General case' 0 C--N 1.384 2.084 0 O-C-N 120.536 -1.352 . . . . 0.0 109.615 171.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' P' ' 129' ' ' ARG . 20.0 mt-10 -54.39 -52.76 60.66 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-O 122.384 1.088 . . . . 0.0 109.21 177.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.717 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.98 -67.78 0.22 Allowed 'General case' 0 C--N 1.378 1.818 0 CA-C-N 111.872 -2.422 . . . . 0.0 108.754 177.378 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.413 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.3 OUTLIER -59.21 -36.81 76.05 Favored 'General case' 0 C--N 1.397 2.634 0 CA-C-N 112.032 -2.349 . . . . 0.0 108.373 -172.478 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.85 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 12.6 t80 -69.21 -48.85 60.91 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-N 119.1 0.864 . . . . 0.0 109.679 178.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' P' ' 125' ' ' GLU . 27.3 mtm180 -62.96 -15.96 57.71 Favored 'General case' 0 C--N 1.38 1.931 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -166.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -101.66 -39.86 7.26 Favored 'General case' 0 C--N 1.379 1.862 0 C-N-CA 126.669 1.988 . . . . 0.0 107.374 -170.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.492 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.1 OUTLIER -153.2 104.49 2.8 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 111.723 -2.489 . . . . 0.0 108.64 -153.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . 0.492 ' HB3' ' CD2' ' P' ' 133' ' ' TYR . 3.2 mtt85 -74.48 -15.79 60.87 Favored 'General case' 0 C--N 1.391 2.41 0 CA-C-N 112.197 -2.274 . . . . 0.0 110.721 -166.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.492 ' CD2' ' HB3' ' P' ' 132' ' ' ARG . 66.8 m-85 -160.16 112.14 2.0 Favored 'General case' 0 C--N 1.378 1.835 0 CA-C-N 113.842 -1.526 . . . . 0.0 108.289 -153.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.559 HD22 ' HB3' ' P' ' 138' ' ' GLU . 19.1 mt -129.45 133.33 47.25 Favored 'General case' 0 C--N 1.396 2.595 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.028 -155.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . 0.338 1.3 t -92.6 166.57 12.43 Favored 'General case' 0 C--N 1.394 2.533 0 CA-C-N 122.103 2.229 . . . . 0.0 107.372 174.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.536 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.75 -46.47 98.45 Favored Pre-proline 0 CA--C 1.582 2.188 0 CA-C-N 113.573 -1.648 . . . . 0.0 108.684 -155.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 0.1 OUTLIER -53.64 -46.49 33.34 Favored 'Trans proline' 0 C--N 1.395 2.982 0 N-CA-C 116.73 1.781 . . . . 0.0 116.73 177.413 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.559 ' HB3' HD22 ' P' ' 134' ' ' LEU . 1.6 mm-40 -51.86 -65.68 0.52 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 123.726 1.727 . . . . 0.0 106.813 170.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.946 ' NH2' ' HG3' ' P' ' 154' ' ' LYS . 1.7 ptt180 -69.62 -32.18 70.74 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 109.942 -3.299 . . . . 0.0 108.718 -160.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.628 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 2.4 mt-10 -52.81 -47.02 67.93 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 122.987 1.375 . . . . 0.0 108.131 170.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -64.78 -37.85 89.01 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-N 112.416 -2.175 . . . . 0.0 109.608 -166.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.493 HD13 HD13 ' P' ' 146' ' ' ILE . 1.3 tm? -59.29 -44.5 92.51 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-O 123.169 1.461 . . . . 0.0 108.913 169.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.628 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.89 -34.27 77.58 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-N 112.037 -2.347 . . . . 0.0 109.095 177.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.581 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -72.5 -37.69 68.33 Favored 'General case' 0 C--N 1.388 2.243 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.451 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 45.7 mt -67.25 -52.48 40.35 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 124.777 2.227 . . . . 0.0 108.337 -167.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.973 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -91.61 -16.6 7.94 Favored 'Isoleucine or valine' 0 C--N 1.386 2.194 0 CA-C-N 110.498 -3.046 . . . . 0.0 107.959 -172.831 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . 0.516 ' HD3' ' O ' ' P' ' 144' ' ' SER . 3.2 mmt-85 81.3 38.54 0.07 Allowed 'General case' 0 C--N 1.385 2.144 0 CA-C-N 111.464 -2.607 . . . . 0.0 107.822 153.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.973 HD12 HD11 ' P' ' 146' ' ' ILE . 5.8 mt -94.19 171.79 8.62 Favored 'General case' 0 C--N 1.39 2.335 0 CA-C-N 112.023 -2.353 . . . . 0.0 109.055 166.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.64 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.4 p -89.99 139.86 27.49 Favored Pre-proline 0 CA--C 1.588 2.432 0 CA-C-O 123.148 1.451 . . . . 0.0 108.061 171.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.43 ' HB3' HH11 ' P' ' 139' ' ' ARG . 0.6 OUTLIER -46.34 -48.6 13.05 Favored 'Trans proline' 0 C--N 1.406 3.566 0 C-N-CA 124.935 3.757 . . . . 0.0 115.286 -165.436 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.41 -29.61 35.88 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 118.347 -0.835 . . . . 0.0 110.06 169.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.64 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -74.85 -27.67 60.36 Favored 'General case' 0 C--N 1.39 2.347 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.802 HG13 ' CD2' ' P' ' 157' ' ' PHE . 1.5 t -64.69 -72.86 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.382 2.007 0 CA-C-N 122.069 2.213 . . . . 0.0 109.883 162.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.946 ' HG3' ' NH2' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.47 -54.93 0.54 Allowed 'General case' 0 C--N 1.386 2.154 0 C-N-CA 124.896 1.278 . . . . 0.0 110.409 -175.504 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 16.5 mm -60.98 -41.7 90.12 Favored 'Isoleucine or valine' 0 C--N 1.387 2.199 0 CA-C-N 114.072 -1.422 . . . . 0.0 109.498 -174.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.792 ' HB3' HD22 ' P' ' 124' ' ' LEU . 7.7 t90 -66.81 -32.08 73.12 Favored 'General case' 0 C--N 1.382 2.0 0 O-C-N 121.228 -0.92 . . . . 0.0 109.076 172.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.85 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 52.2 m-85 -74.9 -42.2 58.24 Favored 'General case' 0 C--O 1.276 2.463 0 O-C-N 121.376 -0.827 . . . . 0.0 111.815 176.073 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.436 ' N ' ' O ' ' P' ' 154' ' ' LYS . 60.5 mt-30 -50.57 -60.25 3.22 Favored 'General case' 0 C--N 1.377 1.778 0 O-C-N 119.571 -1.956 . . . . 0.0 107.28 169.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -56.25 -23.42 36.0 Favored 'General case' 0 C--N 1.391 2.374 0 CA-C-O 117.358 -1.306 . . . . 0.0 109.629 -166.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.564 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 2.2 t60 -75.28 -50.64 15.43 Favored 'General case' 0 C--O 1.281 2.744 0 CA-C-N 121.307 1.867 . . . . 0.0 110.128 175.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.47 ' NH1' ' CD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.018 0 CA-C-N 122.538 2.427 . . . . 0.0 110.732 -158.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.546 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.6 m-85 . . . . . 0 C--O 1.257 1.459 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.19 147.82 52.75 Favored 'General case' 0 C--N 1.381 1.976 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -168.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.424 ' O ' ' N ' ' P' ' 122' ' ' TYR . 37.5 ttmt -42.82 -36.22 1.41 Allowed 'General case' 0 C--N 1.381 1.963 0 CA-C-N 113.716 -1.584 . . . . 0.0 109.381 -177.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.77 -67.39 0.26 Allowed 'General case' 0 C--N 1.383 2.025 0 CA-C-O 123.981 1.848 . . . . 0.0 109.088 173.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.1 mt-30 -48.32 -48.8 35.84 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 112.435 -2.166 . . . . 0.0 110.038 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.649 ' HA ' HD12 ' P' ' 124' ' ' LEU . 9.1 m -50.39 -58.38 5.84 Favored 'General case' 0 C--N 1.384 2.071 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.538 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 0.6 OUTLIER -52.94 -46.99 68.39 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.985 -170.246 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.688 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -67.06 -35.94 80.94 Favored 'General case' 0 C--O 1.265 1.898 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.137 177.416 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.75 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.7 mt -59.98 -53.97 51.51 Favored 'General case' 0 C--N 1.381 1.956 0 O-C-N 119.593 -1.942 . . . . 0.0 109.619 168.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.576 ' O ' ' N ' ' P' ' 129' ' ' ARG . 11.6 mt-10 -55.36 -42.37 73.81 Favored 'General case' 0 C--N 1.381 1.962 0 CA-C-O 122.564 1.173 . . . . 0.0 109.679 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.538 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -47.41 -71.6 0.07 Allowed 'General case' 0 C--N 1.38 1.912 0 CA-C-N 111.235 -2.712 . . . . 0.0 108.132 177.085 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.681 ' HD2' HD21 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -60.82 -33.3 72.81 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 113.933 -1.485 . . . . 0.0 108.405 -172.397 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.842 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 30.6 t80 -69.89 -48.9 56.9 Favored 'General case' 0 C--N 1.38 1.929 0 CA-C-N 119.623 1.102 . . . . 0.0 109.998 176.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.576 ' N ' ' O ' ' P' ' 125' ' ' GLU . 71.3 mtt180 -62.19 -19.08 62.75 Favored 'General case' 0 C--N 1.38 1.93 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -167.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -99.92 -40.02 7.88 Favored 'General case' 0 C--N 1.379 1.85 0 C-N-CA 126.279 1.832 . . . . 0.0 107.097 -169.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.482 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.8 OUTLIER -154.58 102.86 2.43 Favored 'General case' 0 C--N 1.384 2.102 0 CA-C-N 111.953 -2.385 . . . . 0.0 109.329 -152.61 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -13.89 60.76 Favored 'General case' 0 C--N 1.394 2.533 0 CA-C-N 112.244 -2.253 . . . . 0.0 111.212 -161.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.453 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 12.8 m-85 -159.23 111.09 2.12 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-N 113.36 -1.745 . . . . 0.0 108.089 -154.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.681 HD21 ' HD2' ' P' ' 127' ' ' ARG . 29.2 mt -123.4 132.36 53.93 Favored 'General case' 0 C--N 1.398 2.703 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -155.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.0 155.46 23.94 Favored 'General case' 0 C--N 1.38 1.934 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 171.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.533 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.17 -49.32 93.6 Favored Pre-proline 0 CA--C 1.584 2.276 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -160.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.533 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 75.5 Cg_exo -59.84 -28.8 88.02 Favored 'Trans proline' 0 C--N 1.401 3.312 0 N-CA-C 115.402 1.27 . . . . 0.0 115.402 -176.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.45 ' HB3' HD22 ' P' ' 134' ' ' LEU . 2.9 mm-40 -53.33 -72.4 0.06 Allowed 'General case' 0 C--N 1.379 1.872 0 CA-C-O 124.822 2.249 . . . . 0.0 106.795 158.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.906 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -66.45 -39.44 88.88 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 110.267 -3.152 . . . . 0.0 108.407 -154.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.635 ' O ' ' N ' ' P' ' 144' ' ' SER . 1.7 mt-10 -53.81 -43.2 69.15 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.576 1.179 . . . . 0.0 108.319 177.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -63.55 -36.81 85.03 Favored 'General case' 0 C--N 1.381 1.936 0 CA-C-N 112.693 -2.048 . . . . 0.0 109.277 -174.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.613 ' O ' HG23 ' P' ' 146' ' ' ILE . 0.8 OUTLIER -60.02 -45.65 92.07 Favored 'General case' 0 C--N 1.386 2.172 0 CA-C-O 122.79 1.281 . . . . 0.0 108.857 165.675 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.75 -30.53 71.62 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 112.606 -2.088 . . . . 0.0 109.368 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.635 ' N ' ' O ' ' P' ' 140' ' ' GLU . 8.0 t -74.81 -43.46 54.56 Favored 'General case' 0 C--N 1.383 2.04 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.327 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . 0.533 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 39.4 mt -62.51 -44.06 97.28 Favored 'General case' 0 C--N 1.38 1.914 0 CA-C-O 124.727 2.203 . . . . 0.0 107.794 -164.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.976 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -102.87 -17.24 7.13 Favored 'Isoleucine or valine' 0 C--N 1.385 2.135 0 CA-C-N 110.283 -3.144 . . . . 0.0 107.792 -168.766 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.0 OUTLIER 81.22 37.55 0.08 Allowed 'General case' 0 C--N 1.388 2.249 0 CA-C-N 111.249 -2.705 . . . . 0.0 108.292 153.496 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.976 HD12 HD11 ' P' ' 146' ' ' ILE . 5.7 mt -95.25 168.04 10.98 Favored 'General case' 0 C--N 1.39 2.332 0 CA-C-N 112.353 -2.203 . . . . 0.0 109.416 167.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.638 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -88.77 143.38 31.64 Favored Pre-proline 0 CA--C 1.587 2.378 0 CA-C-O 122.948 1.356 . . . . 0.0 108.25 173.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -60.74 -37.32 79.56 Favored 'Trans proline' 1 C--N 1.415 4.062 0 C-N-CA 122.621 2.214 . . . . 0.0 112.885 -155.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.79 -34.9 63.26 Favored 'General case' 0 C--N 1.384 2.092 0 C-N-CA 119.593 -0.843 . . . . 0.0 109.774 165.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.638 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.7 mt-30 -70.91 -27.67 63.96 Favored 'General case' 0 C--N 1.388 2.272 0 N-CA-C 105.639 -1.986 . . . . 0.0 105.639 -177.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.79 HG11 ' HB2' ' P' ' 139' ' ' ARG . 1.3 t -64.55 -71.99 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.096 0 CA-C-N 121.537 1.971 . . . . 0.0 109.567 164.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.906 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.75 -58.93 0.42 Allowed 'General case' 0 C--N 1.385 2.144 0 C-N-CA 124.807 1.243 . . . . 0.0 110.784 -177.8 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.444 HD13 ' OE1' ' P' ' 158' ' ' GLN . 22.7 mm -58.81 -40.86 81.03 Favored 'Isoleucine or valine' 0 C--N 1.381 1.969 0 CA-C-N 113.089 -1.869 . . . . 0.0 108.847 -172.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.75 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.9 t90 -67.71 -31.89 72.14 Favored 'General case' 0 C--N 1.382 2.011 0 O-C-N 121.419 -0.801 . . . . 0.0 109.311 173.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.842 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 72.5 m-85 -75.18 -38.76 60.69 Favored 'General case' 0 C--O 1.274 2.345 0 O-C-N 121.274 -0.891 . . . . 0.0 112.302 173.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.482 ' N ' ' O ' ' P' ' 154' ' ' LYS . 81.1 mt-30 -53.22 -62.93 1.33 Allowed 'General case' 0 C--N 1.376 1.754 0 O-C-N 119.879 -1.763 . . . . 0.0 106.465 167.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -56.53 -24.49 47.11 Favored 'General case' 0 C--N 1.39 2.331 0 CA-C-O 117.672 -1.156 . . . . 0.0 109.648 -166.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.543 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 5.4 t60 -79.26 -38.03 36.48 Favored 'General case' 0 C--O 1.282 2.787 0 CA-C-N 121.491 1.95 . . . . 0.0 111.895 178.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.502 ' NH2' ' HB3' ' P' ' 157' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.96 0 CA-C-N 122.997 2.635 . . . . 0.0 111.225 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.499 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 . . . . . 0 C--O 1.258 1.531 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.29 148.13 52.3 Favored 'General case' 0 C--N 1.381 1.965 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -169.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.433 ' O ' ' N ' ' P' ' 122' ' ' TYR . 31.8 ttmt -43.43 -36.15 1.86 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-N 113.384 -1.734 . . . . 0.0 109.226 -177.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.67 -66.86 0.32 Allowed 'General case' 0 C--N 1.382 2.019 0 CA-C-O 124.109 1.909 . . . . 0.0 109.138 173.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.546 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.7 mt-30 -48.71 -45.92 39.95 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-N 112.476 -2.147 . . . . 0.0 109.663 177.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.71 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.0 m -54.73 -54.75 37.83 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.614 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.6 t80 -53.18 -46.13 68.81 Favored 'General case' 0 C--N 1.382 2.014 0 CA-C-O 122.381 1.086 . . . . 0.0 110.161 -171.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.696 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.3 OUTLIER -66.35 -40.15 89.64 Favored 'General case' 0 C--N 1.38 1.893 0 CA-C-N 114.245 -1.343 . . . . 0.0 107.803 179.417 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.736 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.7 mt -60.98 -48.94 79.5 Favored 'General case' 0 C--N 1.386 2.174 0 O-C-N 120.528 -1.357 . . . . 0.0 109.607 173.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.6 mt-10 -55.18 -52.63 62.72 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.755 1.264 . . . . 0.0 109.398 176.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.614 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -42.28 -58.67 2.09 Favored 'General case' 0 C--N 1.379 1.848 0 CA-C-N 112.209 -2.269 . . . . 0.0 109.075 177.073 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.679 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -69.83 -32.72 71.3 Favored 'General case' 0 C--N 1.396 2.596 0 CA-C-N 112.481 -2.145 . . . . 0.0 108.467 -168.083 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.715 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.0 t80 -68.95 -52.09 32.87 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-O 121.81 0.814 . . . . 0.0 109.638 171.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.668 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 3.2 mmm180 -62.58 -14.07 38.4 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-N 113.545 -1.661 . . . . 0.0 108.302 -164.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . 0.436 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 41.4 mt-30 -95.91 -47.33 6.17 Favored 'General case' 0 C--N 1.379 1.87 0 CA-C-O 123.93 1.824 . . . . 0.0 106.539 -176.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.614 ' OE1' HD23 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -159.36 123.1 3.78 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 111.919 -2.401 . . . . 0.0 110.256 -166.043 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . 0.5 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 1.1 ptt-85 -80.45 -7.65 59.23 Favored 'General case' 0 C--N 1.387 2.223 0 CA-C-N 112.36 -2.2 . . . . 0.0 111.243 -162.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.578 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 0.4 OUTLIER -152.84 90.6 1.48 Allowed 'General case' 0 C--N 1.378 1.837 0 CA-C-O 126.846 3.212 . . . . 0.0 109.183 -154.268 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.614 HD23 ' OE1' ' P' ' 131' ' ' GLN . 65.0 mt -97.3 137.88 35.62 Favored 'General case' 0 C--N 1.415 3.413 0 CA-C-N 111.863 -2.426 . . . . 0.0 108.528 -166.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.31 156.68 25.4 Favored 'General case' 0 C--N 1.381 1.971 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 161.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.521 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.11 -50.01 90.05 Favored Pre-proline 0 CA--C 1.583 2.221 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.458 -163.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.521 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 69.9 Cg_exo -57.05 -28.86 80.72 Favored 'Trans proline' 0 C--N 1.4 3.269 0 N-CA-C 115.011 1.12 . . . . 0.0 115.011 -172.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.564 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.1 OUTLIER -55.53 -70.88 0.1 Allowed 'General case' 0 C--N 1.384 2.093 0 CA-C-O 125.039 2.352 . . . . 0.0 105.734 164.421 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 1.015 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.59 -40.51 80.46 Favored 'General case' 0 C--N 1.391 2.388 0 CA-C-N 109.514 -3.494 . . . . 0.0 108.739 -156.047 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.647 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.8 mt-10 -53.17 -41.28 65.04 Favored 'General case' 0 C--N 1.38 1.901 0 CA-C-O 123.482 1.611 . . . . 0.0 108.368 178.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -64.03 -35.13 79.7 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.99 -172.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.679 HD13 ' CG ' ' P' ' 127' ' ' ARG . 2.5 tp -65.33 -43.04 92.21 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-O 123.282 1.515 . . . . 0.0 108.957 168.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.2 -34.98 66.77 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-N 112.32 -2.218 . . . . 0.0 108.37 174.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.572 ' N ' ' O ' ' P' ' 140' ' ' GLU . 3.1 t -73.49 -44.27 58.28 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.248 -179.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 81.2 mt -66.19 -47.01 75.31 Favored 'General case' 0 C--N 1.379 1.88 0 CA-C-O 124.897 2.284 . . . . 0.0 107.933 -163.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 1.045 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.66 -17.07 7.1 Favored 'Isoleucine or valine' 0 C--N 1.385 2.124 0 CA-C-N 110.539 -3.028 . . . . 0.0 107.688 -171.565 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 81.26 37.11 0.08 Allowed 'General case' 0 C--N 1.385 2.148 0 CA-C-N 111.44 -2.618 . . . . 0.0 108.181 152.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 1.045 HD12 HD11 ' P' ' 146' ' ' ILE . 6.0 mt -95.32 168.25 10.84 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 112.084 -2.325 . . . . 0.0 109.395 168.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.65 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.9 p -89.28 143.8 31.45 Favored Pre-proline 0 CA--C 1.588 2.407 0 CA-C-O 122.794 1.283 . . . . 0.0 108.26 172.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -60.66 -37.82 76.52 Favored 'Trans proline' 0 C--N 1.414 3.993 0 C-N-CA 122.531 2.154 . . . . 0.0 112.409 -155.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.27 -32.65 62.55 Favored 'General case' 0 C--N 1.385 2.121 0 C-N-CA 119.512 -0.875 . . . . 0.0 109.806 166.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.65 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.8 mt-30 -72.4 -29.44 63.74 Favored 'General case' 0 C--N 1.389 2.283 0 N-CA-C 105.848 -1.908 . . . . 0.0 105.848 -178.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.83 HG11 ' HB2' ' P' ' 139' ' ' ARG . 1.2 t -64.71 -69.75 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.098 0 CA-C-N 121.9 2.137 . . . . 0.0 109.562 166.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 1.015 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.68 -59.18 0.41 Allowed 'General case' 0 C--N 1.387 2.234 0 C-N-CA 124.986 1.315 . . . . 0.0 110.801 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.462 HD13 ' HA ' ' P' ' 155' ' ' ILE . 3.4 mm -55.22 -43.15 69.49 Favored 'Isoleucine or valine' 0 C--N 1.384 2.082 0 CA-C-N 112.825 -1.989 . . . . 0.0 110.089 -176.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.736 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.0 t90 -66.83 -30.56 70.77 Favored 'General case' 0 C--N 1.382 1.981 0 O-C-N 120.912 -1.118 . . . . 0.0 108.998 174.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.715 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 45.2 m-85 -76.11 -44.39 38.8 Favored 'General case' 0 C--O 1.276 2.493 0 O-C-N 121.235 -0.916 . . . . 0.0 111.939 174.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' P' ' 154' ' ' LYS . 23.5 mt-30 -42.71 -66.3 0.38 Allowed 'General case' 0 C--N 1.378 1.807 0 O-C-N 119.078 -2.264 . . . . 0.0 107.713 167.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -56.66 -21.93 30.97 Favored 'General case' 0 C--N 1.396 2.628 0 CA-C-N 112.759 -2.019 . . . . 0.0 109.695 -165.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.509 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.8 OUTLIER -76.12 -49.84 16.29 Favored 'General case' 0 C--O 1.284 2.876 0 CA-C-N 120.9 1.682 . . . . 0.0 110.809 172.253 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.578 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.269 2.083 0 CA-C-N 122.505 2.411 . . . . 0.0 109.578 -160.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.581 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.299 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.68 148.17 52.28 Favored 'General case' 0 C--N 1.382 1.984 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 -171.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -43.78 -36.51 2.32 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-N 113.279 -1.782 . . . . 0.0 109.157 -177.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.51 -65.16 0.61 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 124.203 1.954 . . . . 0.0 109.237 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.561 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.2 mt-30 -49.32 -47.61 46.99 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 127.081 2.152 . . . . 0.0 109.722 176.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.649 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.5 m -51.16 -56.18 14.08 Favored 'General case' 0 C--N 1.384 2.072 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 169.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.546 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 2.6 t80 -52.96 -48.62 67.24 Favored 'General case' 0 C--N 1.381 1.975 0 CA-C-O 122.593 1.187 . . . . 0.0 110.048 -169.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.934 ' CD ' HG22 ' P' ' 146' ' ' ILE . 6.9 mt-10 -66.23 -36.97 84.42 Favored 'General case' 0 C--N 1.377 1.798 0 CA-C-N 114.253 -1.34 . . . . 0.0 107.826 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.827 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -59.98 -51.85 67.92 Favored 'General case' 0 C--N 1.384 2.079 0 O-C-N 120.76 -1.212 . . . . 0.0 109.871 170.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' P' ' 129' ' ' ARG . 24.2 mt-10 -54.59 -51.47 65.22 Favored 'General case' 0 C--N 1.379 1.872 0 CA-C-O 122.629 1.205 . . . . 0.0 109.294 178.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.608 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -41.46 -70.06 0.12 Allowed 'General case' 0 C--N 1.379 1.873 0 CA-C-N 111.683 -2.508 . . . . 0.0 108.681 177.076 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.62 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.7 OUTLIER -56.67 -38.73 72.63 Favored 'General case' 0 C--N 1.387 2.238 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.259 -173.181 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.862 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 27.5 t80 -69.47 -46.44 66.66 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-O 121.541 0.686 . . . . 0.0 110.144 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' P' ' 125' ' ' GLU . 13.2 mtp85 -62.63 -13.96 37.74 Favored 'General case' 0 C--N 1.381 1.936 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 -168.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -107.44 -37.19 6.28 Favored 'General case' 0 C--N 1.379 1.887 0 C-N-CA 126.938 2.095 . . . . 0.0 107.96 -168.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.496 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -153.43 108.37 3.17 Favored 'General case' 0 C--N 1.39 2.328 0 CA-C-N 111.971 -2.377 . . . . 0.0 108.615 -153.45 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -76.15 -19.37 58.53 Favored 'General case' 0 C--N 1.39 2.36 0 CA-C-N 112.021 -2.354 . . . . 0.0 110.508 -168.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.435 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 36.5 m-85 -162.27 112.54 1.53 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 113.875 -1.511 . . . . 0.0 108.313 -153.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.603 HD22 ' HG3' ' P' ' 138' ' ' GLU . 29.6 mt -120.84 142.69 49.4 Favored 'General case' 0 C--N 1.398 2.706 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -163.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.83 152.24 29.82 Favored 'General case' 0 C--N 1.382 2.02 0 O-C-N 121.14 -0.975 . . . . 0.0 108.408 158.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.44 ' HA ' ' CG ' ' P' ' 139' ' ' ARG . . . -58.58 -43.78 98.34 Favored Pre-proline 0 CA--C 1.583 2.216 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -161.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -49.82 -43.35 41.11 Favored 'Trans proline' 0 C--N 1.393 2.914 0 N-CA-C 116.954 1.867 . . . . 0.0 116.954 -179.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.603 ' HG3' HD22 ' P' ' 134' ' ' LEU . 7.6 mm-40 -52.79 -62.61 1.54 Allowed 'General case' 0 C--N 1.39 2.353 0 CA-C-O 124.13 1.919 . . . . 0.0 105.984 169.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 1.042 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -68.01 -46.79 70.28 Favored 'General case' 0 C--N 1.388 2.273 0 CA-C-N 109.492 -3.504 . . . . 0.0 108.331 -158.506 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.66 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 3.3 mt-10 -53.87 -35.71 61.85 Favored 'General case' 0 C--N 1.38 1.893 0 CA-C-O 122.744 1.259 . . . . 0.0 108.003 -177.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -65.96 -36.4 83.24 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.563 -1.653 . . . . 0.0 108.859 -173.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.635 HD21 ' C ' ' P' ' 123' ' ' GLU . 1.0 OUTLIER -65.72 -42.28 91.24 Favored 'General case' 0 C--N 1.382 1.992 0 CA-C-O 123.172 1.463 . . . . 0.0 109.072 168.163 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.66 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.18 -32.66 64.54 Favored 'General case' 0 C--N 1.389 2.308 0 CA-C-N 112.62 -2.082 . . . . 0.0 108.346 172.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.627 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -73.15 -43.63 61.26 Favored 'General case' 0 C--N 1.389 2.302 0 CA-C-N 113.468 -1.696 . . . . 0.0 109.571 -177.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 86.4 mt -69.2 -45.68 69.32 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-O 124.812 2.244 . . . . 0.0 108.262 -164.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.969 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -97.14 -13.28 8.14 Favored 'Isoleucine or valine' 0 C--N 1.39 2.36 0 CA-C-N 110.934 -2.848 . . . . 0.0 108.11 -169.245 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 83.05 34.87 0.06 Allowed 'General case' 0 C--N 1.382 1.995 0 CA-C-O 125.67 2.652 . . . . 0.0 108.249 152.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.969 HD12 HD11 ' P' ' 146' ' ' ILE . 9.2 mt -96.89 171.41 8.52 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 111.65 -2.523 . . . . 0.0 109.736 169.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.569 ' O ' ' N ' ' P' ' 152' ' ' GLN . 20.7 p -95.2 143.19 25.68 Favored Pre-proline 0 CA--C 1.588 2.442 0 CA-C-O 122.361 1.077 . . . . 0.0 108.773 168.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.475 ' HG3' ' HA ' ' P' ' 140' ' ' GLU . 77.5 Cg_exo -55.37 -36.45 93.85 Favored 'Trans proline' 0 C--N 1.41 3.787 0 C-N-CA 122.059 1.84 . . . . 0.0 114.475 -165.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.73 -9.26 13.35 Favored 'General case' 0 C--N 1.38 1.93 0 CA-C-N 119.992 1.269 . . . . 0.0 111.687 167.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.569 ' N ' ' O ' ' P' ' 149' ' ' THR . 42.5 mt-30 -88.56 -34.22 17.43 Favored 'General case' 0 C--O 1.285 2.952 0 CA-C-O 117.169 -1.396 . . . . 0.0 108.471 168.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.971 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -65.0 -70.5 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.941 0 CA-C-N 124.65 3.386 . . . . 0.0 109.731 165.806 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 1.042 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.4 -54.2 0.52 Allowed 'General case' 0 C--N 1.386 2.17 0 C-N-CA 125.796 1.638 . . . . 0.0 108.865 -178.315 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.579 HD13 ' OE1' ' P' ' 158' ' ' GLN . 7.4 mm -56.89 -61.74 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.956 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.827 ' HB3' HD22 ' P' ' 124' ' ' LEU . 3.4 t90 -49.82 -30.19 9.33 Favored 'General case' 0 C--N 1.382 2.019 0 O-C-N 120.2 -1.562 . . . . 0.0 109.187 -178.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.971 ' CE2' HG13 ' P' ' 153' ' ' VAL . 74.1 m-85 -75.51 -43.88 46.65 Favored 'General case' 0 C--O 1.282 2.779 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 170.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.579 ' OE1' HD13 ' P' ' 155' ' ' ILE . 13.6 mt-30 -41.95 -70.94 0.09 Allowed 'General case' 0 C--N 1.378 1.808 0 O-C-N 118.517 -2.614 . . . . 0.0 106.533 161.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -18.92 22.82 Favored 'General case' 0 C--N 1.385 2.15 0 CA-C-O 117.684 -1.151 . . . . 0.0 111.187 -165.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.558 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.1 t60 -74.95 -48.87 22.21 Favored 'General case' 0 C--O 1.281 2.72 0 CA-C-N 120.964 1.711 . . . . 0.0 110.186 177.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.435 ' CD ' ' CE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.269 2.079 0 CA-C-N 122.443 2.383 . . . . 0.0 110.59 -159.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.413 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.5 m-85 . . . . . 0 C--O 1.256 1.416 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.1 p -67.37 148.08 52.09 Favored 'General case' 0 C--N 1.381 1.967 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -171.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.43 ' O ' ' N ' ' P' ' 122' ' ' TYR . 35.0 ttmt -43.17 -36.17 1.63 Allowed 'General case' 0 C--N 1.382 2.012 0 CA-C-N 113.271 -1.786 . . . . 0.0 109.258 -178.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.56 -66.67 0.35 Allowed 'General case' 0 C--N 1.383 2.032 0 CA-C-O 124.172 1.939 . . . . 0.0 109.078 173.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.9 mt-30 -49.12 -48.24 44.71 Favored 'General case' 0 C--N 1.382 2.005 0 CA-C-N 112.421 -2.172 . . . . 0.0 109.491 177.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.707 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.9 m -52.38 -55.07 24.15 Favored 'General case' 0 C--N 1.385 2.143 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 170.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.509 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 2.3 t80 -53.05 -45.69 68.19 Favored 'General case' 0 C--N 1.383 2.057 0 CA-C-O 122.237 1.018 . . . . 0.0 109.985 -171.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.715 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.8 -39.64 87.84 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-N 114.321 -1.309 . . . . 0.0 107.834 179.664 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.745 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.3 mt -60.55 -49.49 77.33 Favored 'General case' 0 C--N 1.385 2.111 0 O-C-N 120.532 -1.355 . . . . 0.0 109.599 172.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.5 mt-10 -55.68 -51.79 66.06 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-O 122.575 1.179 . . . . 0.0 109.639 177.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.594 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -40.65 -70.24 0.11 Allowed 'General case' 0 C--N 1.378 1.822 0 CA-C-N 111.851 -2.431 . . . . 0.0 109.022 177.245 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.735 ' HD2' HD21 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -62.82 -31.44 72.43 Favored 'General case' 0 C--N 1.379 1.866 0 CA-C-N 113.702 -1.59 . . . . 0.0 108.244 -171.185 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.813 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 19.9 t80 -70.13 -49.02 54.93 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-N 119.786 1.176 . . . . 0.0 109.971 175.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.5 mmm180 -62.65 -16.12 55.41 Favored 'General case' 0 C--N 1.38 1.909 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -166.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -105.29 -41.29 5.57 Favored 'General case' 0 C--N 1.378 1.84 0 CA-C-O 124.07 1.891 . . . . 0.0 107.217 -168.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.459 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.7 OUTLIER -152.94 96.67 2.12 Favored 'General case' 0 C--N 1.386 2.175 0 CA-C-N 111.752 -2.477 . . . . 0.0 109.54 -152.012 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . 0.487 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -77.48 -5.85 51.44 Favored 'General case' 0 C--N 1.394 2.52 0 CA-C-N 111.59 -2.55 . . . . 0.0 110.779 -158.406 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.726 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 2.5 m-30 -163.85 113.04 1.23 Allowed 'General case' 0 C--N 1.38 1.923 0 CA-C-N 114.516 -1.22 . . . . 0.0 108.356 -154.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.735 HD21 ' HD2' ' P' ' 127' ' ' ARG . 43.3 mt -120.67 139.6 52.79 Favored 'General case' 0 C--N 1.397 2.664 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -161.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.85 157.63 25.63 Favored 'General case' 0 C--N 1.382 2.022 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 160.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.522 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.22 -49.81 90.9 Favored Pre-proline 0 CA--C 1.583 2.222 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.465 -164.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 50.9 Cg_exo -55.99 -29.73 75.03 Favored 'Trans proline' 0 C--N 1.399 3.187 0 C-N-CA 121.002 1.135 . . . . 0.0 114.649 -173.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.445 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -55.87 -69.45 0.14 Allowed 'General case' 0 C--N 1.385 2.121 0 CA-C-O 124.176 1.941 . . . . 0.0 106.09 165.535 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.632 ' CZ ' ' HG3' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.67 -35.79 75.44 Favored 'General case' 0 C--N 1.391 2.408 0 CA-C-N 109.858 -3.337 . . . . 0.0 108.85 -156.275 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.668 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.0 mt-10 -52.25 -44.8 65.08 Favored 'General case' 0 C--N 1.381 1.944 0 CA-C-O 123.628 1.68 . . . . 0.0 107.786 174.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -67.12 -36.3 81.6 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 112.396 -2.184 . . . . 0.0 109.121 -166.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.573 ' O ' HG23 ' P' ' 146' ' ' ILE . 1.0 OUTLIER -65.95 -42.1 90.42 Favored 'General case' 0 C--N 1.382 1.995 0 CA-C-O 123.158 1.456 . . . . 0.0 109.049 169.401 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.3 -35.69 67.81 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.54 -2.118 . . . . 0.0 108.094 172.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.596 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.5 t -70.9 -43.14 68.92 Favored 'General case' 0 C--N 1.389 2.305 0 CA-C-N 113.231 -1.804 . . . . 0.0 110.592 -178.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.73 -46.96 67.55 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-O 124.863 2.268 . . . . 0.0 108.09 -164.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.992 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.37 -13.16 8.23 Favored 'Isoleucine or valine' 0 C--N 1.39 2.351 0 CA-C-N 110.815 -2.902 . . . . 0.0 108.042 -168.291 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . 0.568 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 7.4 tpt180 82.32 35.28 0.07 Allowed 'General case' 0 C--N 1.382 1.998 0 CA-C-O 125.635 2.636 . . . . 0.0 107.837 153.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.992 HD12 HD11 ' P' ' 146' ' ' ILE . 9.8 mt -95.89 172.32 8.09 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 111.473 -2.603 . . . . 0.0 109.145 168.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.477 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.3 p -88.98 146.43 36.54 Favored Pre-proline 0 CA--C 1.587 2.371 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 165.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.554 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 85.0 Cg_exo -50.45 -49.39 16.68 Favored 'Trans proline' 0 C--N 1.408 3.71 0 C-N-CA 123.78 2.986 . . . . 0.0 114.127 -167.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . 0.427 HG22 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -58.26 -20.66 44.04 Favored 'General case' 0 C--N 1.386 2.194 0 CA-C-N 112.759 -2.019 . . . . 0.0 110.79 173.847 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.4 mt-30 -78.07 -32.48 50.8 Favored 'General case' 0 C--O 1.277 2.522 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 171.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.762 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.7 t -64.27 -75.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.381 1.972 0 CA-C-N 122.967 2.621 . . . . 0.0 109.718 162.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.632 ' HG3' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -40.65 -42.84 1.8 Allowed 'General case' 0 C--N 1.387 2.212 0 C-N-CA 124.881 1.273 . . . . 0.0 109.971 -171.108 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.427 HG12 HG22 ' P' ' 151' ' ' THR . 0.7 OUTLIER -60.3 -63.05 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.956 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 -179.381 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.745 ' HB3' HD22 ' P' ' 124' ' ' LEU . 2.7 t90 -49.5 -29.03 6.08 Favored 'General case' 0 C--N 1.384 2.078 0 O-C-N 121.415 -0.803 . . . . 0.0 109.311 -177.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.813 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 52.1 m-85 -75.19 -43.06 54.17 Favored 'General case' 0 C--O 1.275 2.437 0 O-C-N 121.629 -0.669 . . . . 0.0 112.37 173.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -46.58 -65.32 0.58 Allowed 'General case' 0 C--N 1.376 1.759 0 O-C-N 119.131 -2.231 . . . . 0.0 107.028 165.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -56.0 -19.77 13.93 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-O 117.868 -1.063 . . . . 0.0 111.073 -164.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.559 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.6 OUTLIER -79.19 -46.59 17.59 Favored 'General case' 0 C--O 1.286 3.019 0 CA-C-N 121.055 1.752 . . . . 0.0 111.752 173.499 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.726 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.939 0 CA-C-N 123.603 2.91 . . . . 0.0 110.192 -163.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.55 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.2 m-85 . . . . . 0 C--O 1.258 1.515 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.55 147.41 53.46 Favored 'General case' 0 C--N 1.381 1.964 0 N-CA-C 107.543 -1.281 . . . . 0.0 107.543 -166.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' P' ' 122' ' ' TYR . 33.7 ttmt -41.72 -36.24 0.95 Allowed 'General case' 0 C--N 1.381 1.957 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.283 -176.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.1 -68.75 0.16 Allowed 'General case' 0 C--N 1.382 2.013 0 CA-C-O 124.329 2.014 . . . . 0.0 109.14 173.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.552 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.8 mt-30 -46.79 -50.11 18.81 Favored 'General case' 0 C--N 1.383 2.056 0 CA-C-N 112.356 -2.202 . . . . 0.0 109.855 176.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.628 ' HA ' HD12 ' P' ' 124' ' ' LEU . 18.7 m -51.18 -55.92 15.44 Favored 'General case' 0 C--N 1.383 2.05 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 170.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.616 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.8 t80 -52.99 -46.38 68.29 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-O 122.34 1.067 . . . . 0.0 110.194 -171.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.691 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.3 OUTLIER -66.42 -39.5 88.99 Favored 'General case' 0 C--N 1.379 1.88 0 CA-C-N 114.455 -1.248 . . . . 0.0 107.759 179.494 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.856 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.7 mt -60.84 -49.11 78.8 Favored 'General case' 0 C--N 1.385 2.136 0 O-C-N 120.592 -1.317 . . . . 0.0 109.953 173.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' P' ' 129' ' ' ARG . 17.8 mt-10 -53.74 -55.37 26.87 Favored 'General case' 0 C--N 1.38 1.895 0 CA-C-O 122.354 1.073 . . . . 0.0 108.841 175.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.616 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.82 -66.56 0.29 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 111.918 -2.401 . . . . 0.0 108.677 178.785 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.555 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.7 OUTLIER -61.09 -33.31 73.14 Favored 'General case' 0 C--N 1.394 2.503 0 CA-C-N 112.427 -2.17 . . . . 0.0 108.384 -173.416 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.727 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 13.8 t80 -67.5 -50.99 56.34 Favored 'General case' 0 C--N 1.387 2.23 0 O-C-N 121.195 -0.941 . . . . 0.0 110.29 174.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.493 ' HA ' ' NE ' ' P' ' 129' ' ' ARG . 0.1 OUTLIER -62.58 -12.56 23.59 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-N 112.916 -1.947 . . . . 0.0 108.158 -165.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . 0.423 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 38.7 mt-30 -108.62 -39.67 5.32 Favored 'General case' 0 C--N 1.38 1.909 0 C-N-CA 126.383 1.873 . . . . 0.0 108.251 -170.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.481 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -151.79 110.24 3.77 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 112.051 -2.34 . . . . 0.0 108.861 -153.237 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -76.78 -20.28 56.63 Favored 'General case' 0 C--N 1.392 2.441 0 CA-C-N 112.23 -2.259 . . . . 0.0 110.738 -168.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.411 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 33.0 m-85 -161.02 114.18 1.97 Allowed 'General case' 0 C--N 1.379 1.887 0 CA-C-N 113.812 -1.54 . . . . 0.0 108.298 -153.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.627 HD22 ' HG3' ' P' ' 138' ' ' GLU . 26.4 mt -124.91 137.04 54.29 Favored 'General case' 0 C--N 1.399 2.753 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -159.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.35 154.84 26.27 Favored 'General case' 0 C--N 1.381 1.95 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 166.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.513 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.68 -49.36 92.28 Favored Pre-proline 0 CA--C 1.583 2.242 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.248 -161.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.513 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 82.7 Cg_exo -58.05 -28.89 85.09 Favored 'Trans proline' 0 C--N 1.4 3.286 0 C-N-CA 121.183 1.255 . . . . 0.0 114.956 -174.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.627 ' HG3' HD22 ' P' ' 134' ' ' LEU . 1.4 mm-40 -54.04 -70.78 0.09 Allowed 'General case' 0 C--N 1.379 1.883 0 CA-C-O 124.786 2.231 . . . . 0.0 106.308 160.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.903 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.25 -40.47 81.93 Favored 'General case' 0 C--N 1.39 2.328 0 CA-C-N 109.88 -3.327 . . . . 0.0 108.794 -155.14 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.649 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 5.0 mt-10 -53.24 -38.24 62.8 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-O 123.125 1.441 . . . . 0.0 108.294 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -65.18 -35.6 81.6 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 112.955 -1.93 . . . . 0.0 108.728 -172.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.583 ' O ' HG23 ' P' ' 146' ' ' ILE . 2.9 tp -64.37 -43.14 95.44 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-O 123.277 1.513 . . . . 0.0 108.976 167.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.649 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.86 -34.61 67.99 Favored 'General case' 0 C--N 1.39 2.351 0 CA-C-N 112.29 -2.232 . . . . 0.0 108.613 176.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.59 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.9 OUTLIER -73.83 -44.04 56.89 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.142 -179.587 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 74.7 mt -65.54 -46.75 78.33 Favored 'General case' 0 C--N 1.379 1.859 0 CA-C-O 124.866 2.27 . . . . 0.0 107.88 -163.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 1.029 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.99 -17.65 6.85 Favored 'Isoleucine or valine' 0 C--N 1.384 2.108 0 CA-C-N 110.435 -3.075 . . . . 0.0 107.664 -171.101 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 80.93 37.44 0.09 Allowed 'General case' 0 C--N 1.385 2.141 0 CA-C-N 111.397 -2.638 . . . . 0.0 108.158 152.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 1.029 HD12 HD11 ' P' ' 146' ' ' ILE . 6.0 mt -95.05 168.71 10.6 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-N 112.121 -2.308 . . . . 0.0 109.308 168.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.648 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.4 p -88.29 143.48 32.69 Favored Pre-proline 0 CA--C 1.587 2.375 0 CA-C-O 122.862 1.315 . . . . 0.0 108.137 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -37.35 86.91 Favored 'Trans proline' 1 C--N 1.414 4.001 0 C-N-CA 122.634 2.223 . . . . 0.0 111.926 -155.743 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . 0.422 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.2 OUTLIER -56.69 -33.1 66.09 Favored 'General case' 0 C--N 1.386 2.174 0 C-N-CA 119.657 -0.817 . . . . 0.0 110.059 167.644 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.648 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.8 mt-30 -72.8 -26.97 61.7 Favored 'General case' 0 C--N 1.388 2.269 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.619 HG12 ' N ' ' P' ' 154' ' ' LYS . 0.9 OUTLIER -64.29 -69.78 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.084 0 CA-C-N 121.789 2.086 . . . . 0.0 109.229 164.39 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.903 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -35.55 -60.13 0.52 Allowed 'General case' 0 C--N 1.386 2.153 0 C-N-CA 125.194 1.398 . . . . 0.0 110.462 -176.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.453 HD13 ' HA ' ' P' ' 155' ' ' ILE . 4.3 mm -58.95 -37.38 66.99 Favored 'Isoleucine or valine' 0 C--N 1.384 2.106 0 CA-C-N 112.889 -1.96 . . . . 0.0 110.841 -174.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.856 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.5 t90 -67.38 -32.17 72.91 Favored 'General case' 0 C--N 1.381 1.959 0 O-C-N 120.369 -1.457 . . . . 0.0 109.21 169.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.727 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 44.0 m-85 -75.51 -43.79 47.18 Favored 'General case' 0 C--O 1.276 2.497 0 O-C-N 120.713 -1.242 . . . . 0.0 111.823 175.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' P' ' 154' ' ' LYS . 46.3 mt-30 -50.68 -58.25 6.33 Favored 'General case' 0 C--N 1.377 1.784 0 O-C-N 118.994 -2.316 . . . . 0.0 107.292 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -54.93 -29.92 57.38 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-O 117.957 -1.02 . . . . 0.0 108.917 -169.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.552 ' HB3' ' CE1' ' P' ' 128' ' ' PHE . 3.4 t60 -77.58 -41.12 39.91 Favored 'General case' 0 C--O 1.285 2.972 0 CA-C-N 121.562 1.983 . . . . 0.0 111.667 -174.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.411 ' CD ' ' CE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.963 0 CA-C-N 122.995 2.634 . . . . 0.0 108.482 -170.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.664 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.255 1.393 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.93 148.97 50.53 Favored 'General case' 0 C--N 1.383 2.024 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 -171.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' P' ' 122' ' ' TYR . 19.8 ttmt -33.21 -50.07 0.28 Allowed 'General case' 0 C--N 1.383 2.063 0 O-C-N 126.883 2.614 . . . . 0.0 108.268 174.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.66 -58.11 5.92 Favored 'General case' 0 C--N 1.385 2.109 0 CA-C-N 111.424 -2.625 . . . . 0.0 109.165 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.542 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.7 mt-30 -59.83 -46.57 88.83 Favored 'General case' 0 C--N 1.381 1.969 0 CA-C-N 112.434 -2.166 . . . . 0.0 109.464 -178.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.575 ' HA ' HD12 ' P' ' 124' ' ' LEU . 3.3 m -47.64 -57.6 5.29 Favored 'General case' 0 C--N 1.386 2.155 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 166.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.667 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.34 -48.52 68.44 Favored 'General case' 0 C--N 1.382 1.997 0 CA-C-O 122.587 1.184 . . . . 0.0 109.904 -167.573 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.703 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.6 OUTLIER -66.2 -37.95 86.79 Favored 'General case' 0 C--N 1.378 1.83 0 CA-C-N 114.032 -1.44 . . . . 0.0 107.856 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.81 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.0 mt -60.7 -50.88 71.69 Favored 'General case' 0 C--N 1.384 2.105 0 O-C-N 120.52 -1.362 . . . . 0.0 109.604 171.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' P' ' 129' ' ' ARG . 9.3 mt-10 -55.47 -50.18 70.57 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-O 122.418 1.104 . . . . 0.0 109.48 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.667 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.65 -69.79 0.12 Allowed 'General case' 0 C--N 1.378 1.845 0 CA-C-N 111.872 -2.422 . . . . 0.0 108.719 176.211 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.724 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.5 OUTLIER -59.31 -36.0 74.83 Favored 'General case' 0 C--N 1.391 2.373 0 CA-C-N 112.778 -2.01 . . . . 0.0 108.343 -171.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.813 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 25.7 t80 -70.31 -46.92 63.27 Favored 'General case' 0 C--N 1.381 1.966 0 CA-C-N 119.148 0.886 . . . . 0.0 110.338 178.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.5 mmp_? -62.51 -15.95 53.15 Favored 'General case' 0 C--N 1.381 1.937 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -168.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -104.51 -39.44 6.41 Favored 'General case' 0 C--N 1.379 1.878 0 C-N-CA 126.592 1.957 . . . . 0.0 107.383 -169.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.503 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -156.21 98.71 1.88 Allowed 'General case' 0 C--N 1.388 2.24 0 CA-C-N 111.759 -2.473 . . . . 0.0 109.223 -153.5 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . 0.519 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 0.4 OUTLIER -77.32 -11.79 59.88 Favored 'General case' 0 C--N 1.388 2.257 0 CA-C-N 111.784 -2.462 . . . . 0.0 110.466 -164.845 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.677 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 3.4 m-30 -154.12 110.81 3.34 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.362 -162.161 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.724 HD11 ' CD ' ' P' ' 127' ' ' ARG . 19.5 mt -121.33 140.01 52.66 Favored 'General case' 0 C--N 1.396 2.63 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -162.413 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.46 160.56 23.95 Favored 'General case' 0 C--N 1.382 1.983 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 164.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.558 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.35 -51.63 80.42 Favored Pre-proline 0 CA--C 1.585 2.312 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -166.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 71.4 Cg_exo -58.16 -29.99 89.1 Favored 'Trans proline' 0 C--N 1.399 3.229 0 N-CA-C 115.387 1.264 . . . . 0.0 115.387 -172.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.629 ' CB ' HD22 ' P' ' 134' ' ' LEU . 15.7 mp0 -58.72 -66.18 0.54 Allowed 'General case' 0 C--N 1.381 1.942 0 CA-C-O 124.866 2.27 . . . . 0.0 105.468 163.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.765 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -67.64 -41.66 83.53 Favored 'General case' 0 C--N 1.391 2.382 0 CA-C-N 109.659 -3.428 . . . . 0.0 108.71 -153.797 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.611 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 0.7 OUTLIER -53.19 -38.05 62.49 Favored 'General case' 0 C--N 1.381 1.94 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.915 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -65.39 -39.08 91.78 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.226 -1.807 . . . . 0.0 109.051 -172.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.63 ' O ' HG23 ' P' ' 146' ' ' ILE . 0.5 OUTLIER -55.57 -46.21 77.23 Favored 'General case' 0 C--N 1.387 2.212 0 CA-C-O 123.256 1.503 . . . . 0.0 108.515 167.447 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.611 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.44 -35.69 81.27 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 111.738 -2.483 . . . . 0.0 108.967 -178.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.579 ' N ' ' O ' ' P' ' 140' ' ' GLU . 4.0 m -73.37 -37.6 65.98 Favored 'General case' 0 C--N 1.387 2.217 0 CA-C-N 114.087 -1.415 . . . . 0.0 109.651 -176.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 37.7 mt -67.3 -49.05 65.77 Favored 'General case' 0 C--N 1.382 1.995 0 CA-C-O 124.492 2.092 . . . . 0.0 108.694 -167.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.974 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.43 -13.54 8.21 Favored 'Isoleucine or valine' 0 C--N 1.389 2.308 0 CA-C-N 110.943 -2.844 . . . . 0.0 108.031 -167.649 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' P' ' 147' ' ' ARG . 0.0 OUTLIER 82.41 35.62 0.07 Allowed 'General case' 0 C--N 1.382 2.019 0 CA-C-O 125.853 2.74 . . . . 0.0 107.668 153.549 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.974 HD12 HD11 ' P' ' 146' ' ' ILE . 7.6 mt -95.95 172.44 8.01 Favored 'General case' 0 C--N 1.396 2.63 0 CA-C-N 111.472 -2.604 . . . . 0.0 109.352 166.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.565 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -89.09 143.59 31.4 Favored Pre-proline 0 CA--C 1.586 2.333 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 167.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.594 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 72.4 Cg_exo -51.4 -46.05 33.76 Favored 'Trans proline' 0 C--N 1.408 3.689 0 C-N-CA 124.252 3.301 . . . . 0.0 114.673 -165.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.71 -33.69 48.92 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-N 112.163 -2.29 . . . . 0.0 109.507 170.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.565 ' N ' ' O ' ' P' ' 149' ' ' THR . 48.1 mt-30 -72.5 -28.27 62.77 Favored 'General case' 0 C--N 1.392 2.43 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.73 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.2 t -64.61 -71.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.026 0 CA-C-N 121.798 2.09 . . . . 0.0 109.814 163.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.765 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.23 -57.78 0.4 Allowed 'General case' 0 C--N 1.388 2.254 0 C-N-CA 124.466 1.106 . . . . 0.0 110.364 -177.581 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.404 HD13 ' OE1' ' P' ' 158' ' ' GLN . 9.9 mm -59.89 -40.22 82.21 Favored 'Isoleucine or valine' 0 C--N 1.382 1.995 0 CA-C-N 113.311 -1.768 . . . . 0.0 109.47 -173.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.81 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.3 t90 -67.45 -31.33 71.43 Favored 'General case' 0 C--N 1.381 1.965 0 O-C-N 121.182 -0.949 . . . . 0.0 109.231 172.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.813 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 66.3 m-85 -74.65 -40.19 61.61 Favored 'General case' 0 C--O 1.273 2.34 0 O-C-N 121.526 -0.734 . . . . 0.0 111.956 173.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.451 ' N ' ' O ' ' P' ' 154' ' ' LYS . 23.8 mt-30 -49.86 -63.62 1.06 Allowed 'General case' 0 C--N 1.378 1.823 0 O-C-N 119.47 -2.018 . . . . 0.0 106.821 167.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -56.7 -19.29 15.84 Favored 'General case' 0 C--N 1.388 2.28 0 CA-C-O 117.907 -1.044 . . . . 0.0 110.446 -164.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.528 ' ND1' ' CZ ' ' P' ' 128' ' ' PHE . 14.7 t-80 -76.48 -52.51 9.67 Favored 'General case' 0 C--O 1.279 2.639 0 CA-C-N 120.743 1.61 . . . . 0.0 111.084 171.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.677 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.921 0 CA-C-N 122.535 2.425 . . . . 0.0 111.06 -158.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.496 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 3.2 m-85 . . . . . 0 C--O 1.257 1.455 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.24 148.11 52.32 Favored 'General case' 0 C--N 1.383 2.035 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 -171.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' P' ' 122' ' ' TYR . 34.4 ttmt -42.71 -36.09 1.33 Allowed 'General case' 0 C--N 1.382 2.003 0 CA-C-N 113.923 -1.489 . . . . 0.0 109.446 -177.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.87 -67.8 0.23 Allowed 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.148 -1.842 . . . . 0.0 109.161 173.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.561 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.2 mt-30 -49.9 -50.77 44.83 Favored 'General case' 0 C--N 1.382 1.986 0 CA-C-N 112.437 -2.165 . . . . 0.0 109.399 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.761 ' HA ' HD12 ' P' ' 124' ' ' LEU . 21.5 m -49.75 -56.86 8.68 Favored 'General case' 0 C--N 1.382 1.994 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 170.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.544 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 1.0 OUTLIER -53.23 -45.51 68.74 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 122.29 1.043 . . . . 0.0 109.74 -170.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.968 ' CD ' HG22 ' P' ' 146' ' ' ILE . 6.9 mt-10 -66.9 -38.56 86.48 Favored 'General case' 0 C--N 1.379 1.853 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.607 178.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.829 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.4 mt -60.71 -50.01 75.22 Favored 'General case' 0 C--N 1.382 2.005 0 O-C-N 119.62 -1.925 . . . . 0.0 109.9 171.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' P' ' 129' ' ' ARG . 20.1 mt-10 -55.75 -52.18 64.8 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-O 122.613 1.197 . . . . 0.0 109.55 177.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.544 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.38 -60.18 1.15 Allowed 'General case' 0 C--N 1.38 1.898 0 CA-C-N 112.128 -2.305 . . . . 0.0 109.362 176.032 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.817 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -70.5 -32.04 69.38 Favored 'General case' 0 C--N 1.397 2.638 0 CA-C-N 112.274 -2.239 . . . . 0.0 108.343 -167.097 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.765 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.3 t80 -67.94 -53.04 29.36 Favored 'General case' 0 C--N 1.384 2.072 0 CA-C-O 121.832 0.825 . . . . 0.0 109.397 170.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.411 ' N ' ' O ' ' P' ' 125' ' ' GLU . 19.6 mmm180 -62.72 -17.77 61.35 Favored 'General case' 0 C--N 1.379 1.888 0 CA-C-N 113.213 -1.812 . . . . 0.0 108.239 -163.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . 0.42 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 35.9 mt-30 -88.22 -51.68 5.63 Favored 'General case' 0 C--N 1.379 1.882 0 CA-C-O 123.811 1.767 . . . . 0.0 106.482 -179.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.31 125.5 4.43 Favored 'General case' 0 C--N 1.394 2.522 0 CA-C-N 112.19 -2.277 . . . . 0.0 110.843 -168.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . 0.657 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 3.7 ptt-85 -80.02 -6.52 57.74 Favored 'General case' 0 C--N 1.393 2.47 0 CA-C-N 111.774 -2.467 . . . . 0.0 111.318 -160.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.723 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 3.0 m-30 -148.27 115.01 6.03 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 125.297 2.475 . . . . 0.0 109.768 -161.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.553 HD22 ' HG3' ' P' ' 138' ' ' GLU . 67.2 mt -125.3 133.91 52.45 Favored 'General case' 0 C--N 1.415 3.425 0 O-C-N 119.851 -1.781 . . . . 0.0 108.826 -162.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.33 158.2 21.24 Favored 'General case' 0 C--N 1.381 1.978 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 168.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.575 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.15 -50.36 88.17 Favored Pre-proline 0 CA--C 1.584 2.285 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -161.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 77.7 Cg_exo -58.66 -28.86 87.61 Favored 'Trans proline' 0 C--N 1.401 3.338 0 N-CA-C 115.185 1.186 . . . . 0.0 115.185 -175.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.553 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -53.45 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.379 1.864 0 CA-C-O 124.295 1.997 . . . . 0.0 106.483 159.895 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 1.028 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.51 -34.87 74.93 Favored 'General case' 0 C--N 1.387 2.226 0 CA-C-N 109.919 -3.31 . . . . 0.0 109.159 -155.124 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.651 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 2.7 mt-10 -52.42 -42.94 64.52 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-O 123.493 1.616 . . . . 0.0 108.137 175.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -64.76 -35.67 81.82 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 112.501 -2.136 . . . . 0.0 108.97 -169.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.817 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.1 tp -65.91 -43.03 89.36 Favored 'General case' 0 C--N 1.382 1.998 0 CA-C-O 123.201 1.477 . . . . 0.0 109.163 168.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -55.34 -35.82 65.62 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.036 174.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.581 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.7 OUTLIER -72.43 -43.17 64.2 Favored 'General case' 0 C--N 1.389 2.29 0 CA-C-N 113.762 -1.563 . . . . 0.0 110.407 -178.113 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 81.3 mt -66.11 -44.87 83.05 Favored 'General case' 0 C--N 1.379 1.89 0 CA-C-O 124.838 2.256 . . . . 0.0 108.301 -164.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 1.01 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -98.83 -13.42 8.09 Favored 'Isoleucine or valine' 0 C--N 1.39 2.344 0 CA-C-N 110.905 -2.861 . . . . 0.0 108.064 -166.249 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 81.8 34.98 0.08 Allowed 'General case' 0 C--N 1.381 1.975 0 CA-C-O 125.586 2.612 . . . . 0.0 107.946 153.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 1.01 HD12 HD11 ' P' ' 146' ' ' ILE . 8.6 mt -95.63 172.36 8.1 Favored 'General case' 0 C--N 1.396 2.593 0 CA-C-N 111.47 -2.605 . . . . 0.0 109.078 167.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.586 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.1 p -91.27 141.53 26.29 Favored Pre-proline 0 CA--C 1.589 2.454 0 CA-C-O 122.795 1.283 . . . . 0.0 108.264 166.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.538 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 0.3 OUTLIER -48.21 -46.99 20.94 Favored 'Trans proline' 0 C--N 1.403 3.429 0 C-N-CA 124.934 3.756 . . . . 0.0 115.404 -167.289 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . 0.465 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -52.85 -30.55 34.39 Favored 'General case' 0 C--N 1.383 2.065 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.112 169.278 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.586 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.3 mt-30 -73.87 -30.58 62.72 Favored 'General case' 0 C--N 1.391 2.401 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 179.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.696 HG13 ' CD2' ' P' ' 157' ' ' PHE . 0.9 OUTLIER -64.07 -67.05 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.382 2.018 0 CA-C-N 122.011 2.187 . . . . 0.0 109.743 165.803 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 1.028 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -32.93 -60.08 0.33 Allowed 'General case' 0 C--N 1.387 2.201 0 C-N-CA 124.615 1.166 . . . . 0.0 110.845 -177.254 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.418 HD13 ' OE1' ' P' ' 158' ' ' GLN . 37.5 mm -64.78 -34.94 73.5 Favored 'Isoleucine or valine' 0 C--N 1.382 2.01 0 CA-C-N 112.794 -2.003 . . . . 0.0 108.756 -169.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.829 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.1 t90 -67.47 -33.07 74.37 Favored 'General case' 0 C--N 1.384 2.109 0 O-C-N 121.691 -0.631 . . . . 0.0 109.353 168.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.765 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 39.2 m-85 -74.89 -41.71 59.24 Favored 'General case' 0 C--O 1.272 2.272 0 O-C-N 120.966 -1.084 . . . . 0.0 111.94 174.599 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' P' ' 154' ' ' LYS . 77.3 mt-30 -50.98 -59.8 3.77 Favored 'General case' 0 C--N 1.377 1.77 0 O-C-N 119.785 -1.822 . . . . 0.0 106.703 170.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -56.5 -20.28 19.57 Favored 'General case' 0 C--N 1.389 2.314 0 CA-C-O 117.409 -1.281 . . . . 0.0 110.333 -168.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.561 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.5 OUTLIER -76.39 -50.35 14.42 Favored 'General case' 0 C--O 1.282 2.816 0 CA-C-N 121.2 1.818 . . . . 0.0 110.313 174.666 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.723 ' HD3' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.019 0 CA-C-N 122.784 2.538 . . . . 0.0 111.166 -158.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.677 ' CD1' HD22 ' P' ' 148' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.272 2.268 0 CA-C-O 118.215 -0.898 . . . . 0.0 109.71 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -69.81 155.48 40.49 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 122.831 2.56 . . . . 0.0 110.006 -172.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.502 ' HB2' ' HE3' ' P' ' 118' ' ' LYS . 0.2 OUTLIER -43.92 -37.12 2.71 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 122.329 1.062 . . . . 0.0 111.223 176.515 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.21 -58.31 9.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 122.953 1.359 . . . . 0.0 110.206 172.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.611 ' O ' HD12 ' P' ' 124' ' ' LEU . 78.6 mt-30 -55.51 -47.9 75.5 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.775 177.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.503 ' HA ' HD12 ' P' ' 124' ' ' LEU . 3.2 m -53.03 -44.93 67.72 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.348 -0.845 . . . . 0.0 110.242 170.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.508 ' CE2' ' NH1' ' P' ' 126' ' ' ARG . 11.1 t80 -65.43 -40.24 93.07 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 121.714 -0.616 . . . . 0.0 111.088 -171.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.64 ' HB2' HG21 ' P' ' 146' ' ' ILE . 0.0 OUTLIER -71.46 -26.71 62.83 Favored 'General case' 0 C--O 1.265 1.878 0 O-C-N 120.83 -1.169 . . . . 0.0 111.303 169.606 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.611 HD12 ' O ' ' P' ' 120' ' ' GLN . 1.4 mt -73.67 -40.65 63.53 Favored 'General case' 0 C--O 1.247 0.931 0 O-C-N 119.026 -2.296 . . . . 0.0 110.739 172.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -61.5 -45.68 93.2 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 123.152 1.453 . . . . 0.0 111.442 171.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.508 ' NH1' ' CE2' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -45.92 -65.1 0.59 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.941 172.451 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.798 ' HG3' HD13 ' P' ' 142' ' ' LEU . 0.7 OUTLIER -65.22 -31.32 72.43 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 118.652 -0.69 . . . . 0.0 109.911 -172.463 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.627 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 26.1 t80 -75.78 -44.69 40.17 Favored 'General case' 0 C--O 1.264 1.831 0 CA-C-N 120.685 1.584 . . . . 0.0 112.974 171.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . . . . . . . . . 5.8 mtp180 -67.23 -13.58 62.11 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 119.12 -2.237 . . . . 0.0 110.502 -173.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . 0.413 HE21 ' CA ' ' P' ' 126' ' ' ARG . 54.1 mt-30 -106.0 -33.62 7.85 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 126.369 1.867 . . . . 0.0 111.559 179.233 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.51 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -151.8 108.58 3.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 123.862 1.791 . . . . 0.0 112.665 -167.762 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . 0.421 ' HB3' ' CD2' ' P' ' 133' ' ' TYR . 4.2 mtt85 -77.79 -9.14 58.87 Favored 'General case' 0 C--O 1.244 0.779 0 O-C-N 120.444 -1.41 . . . . 0.0 113.649 -171.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.421 ' CD2' ' HB3' ' P' ' 132' ' ' ARG . 98.2 m-85 -152.74 116.78 4.86 Favored 'General case' 0 C--O 1.26 1.647 0 C-N-CA 123.712 0.805 . . . . 0.0 109.765 -168.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.598 HD22 ' HB3' ' P' ' 138' ' ' GLU . 23.7 mt -123.11 143.34 50.05 Favored 'General case' 0 C--O 1.276 2.483 0 O-C-N 119.362 -2.086 . . . . 0.0 111.336 -166.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.58 162.7 19.71 Favored 'General case' 0 C--O 1.26 1.647 0 CA-C-N 124.492 3.315 . . . . 0.0 110.137 168.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.898 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -50.77 -60.49 5.38 Favored Pre-proline 0 C--O 1.253 1.274 0 O-C-N 119.974 -1.704 . . . . 0.0 111.585 -170.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.898 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 85.3 Cg_exo -50.67 -31.23 31.52 Favored 'Trans proline' 1 N--CA 1.538 4.128 1 C-N-CA 125.321 4.014 . . . . 0.0 115.57 -177.392 . . . . . . . . 4 3 . 1 . 017 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.598 ' HB3' HD22 ' P' ' 134' ' ' LEU . 2.3 mm-40 -65.54 -61.15 2.26 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 126.101 2.857 . . . . 0.0 108.638 167.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.623 ' NE ' ' HG3' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -74.99 -22.82 58.3 Favored 'General case' 0 C--O 1.276 2.464 0 CA-C-N 112.273 -2.24 . . . . 0.0 113.102 -166.582 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.668 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 3.5 mt-10 -68.78 -39.4 80.2 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 123.844 3.02 . . . . 0.0 111.297 169.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -59.99 -33.72 72.34 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.633 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.798 HD13 ' HG3' ' P' ' 127' ' ' ARG . 0.9 OUTLIER -68.85 -37.14 78.91 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.058 0.932 . . . . 0.0 109.552 169.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.68 -36.68 69.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.219 172.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 1.6 t -72.09 -42.54 66.04 Favored 'General case' 0 C--O 1.266 1.952 0 N-CA-C 113.971 1.101 . . . . 0.0 113.971 176.118 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . 0.579 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 87.1 mt -66.99 -46.0 75.91 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 125.586 2.612 . . . . 0.0 108.674 -168.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 1.012 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -94.13 -15.36 7.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-N 112.311 -2.222 . . . . 0.0 110.381 -175.499 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . 0.579 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.1 OUTLIER 76.75 43.65 0.13 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 123.844 1.783 . . . . 0.0 112.122 165.399 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 1.012 HD12 HD11 ' P' ' 146' ' ' ILE . 5.6 mt -103.7 164.91 11.37 Favored 'General case' 0 C--O 1.253 1.273 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.212 168.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.512 ' HB ' ' HD2' ' P' ' 150' ' ' PRO . 7.1 p -77.42 153.95 81.71 Favored Pre-proline 0 C--N 1.321 -0.662 0 O-C-N 120.452 -1.405 . . . . 0.0 109.263 169.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.512 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 9.0 Cg_endo -60.0 -45.14 25.48 Favored 'Trans proline' 0 N--CA 1.533 3.825 0 C-N-CA 124.418 3.412 . . . . 0.0 114.184 -171.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 1.1 m -60.48 -20.08 58.87 Favored 'General case' 0 C--O 1.27 2.18 0 CA-C-N 122.274 2.306 . . . . 0.0 112.61 166.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.472 ' HB3' ' CE1' ' P' ' 116' ' ' PHE . 40.2 mt-30 -74.35 -28.4 61.12 Favored 'General case' 0 C--O 1.276 2.452 0 CA-C-N 123.853 3.024 . . . . 0.0 108.442 169.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.564 ' O ' ' HD1' ' P' ' 157' ' ' PHE . 1.2 t -72.41 -63.17 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 CA-C-N 124.585 3.357 . . . . 0.0 111.465 168.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.623 ' HG3' ' NE ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -42.47 -50.04 5.24 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.13 0.972 . . . . 0.0 111.934 -179.51 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.486 HD13 ' HA ' ' P' ' 155' ' ' ILE . 0.8 OUTLIER -56.67 -52.91 48.12 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 O-C-N 121.539 -0.726 . . . . 0.0 110.9 177.373 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.676 ' CZ2' ' CE1' ' P' ' 160' ' ' HIS . 4.1 t90 -57.56 -29.98 64.86 Favored 'General case' 0 C--O 1.245 0.865 0 O-C-N 121.265 -0.897 . . . . 0.0 110.0 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.627 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 10.3 m-85 -76.71 -41.38 45.46 Favored 'General case' 0 C--O 1.288 3.113 0 O-C-N 120.227 -1.545 . . . . 0.0 112.999 171.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -51.5 -65.97 0.47 Allowed 'General case' 0 C--N 1.314 -0.957 0 O-C-N 116.624 -3.798 . . . . 0.0 110.863 165.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -58.38 -21.24 49.54 Favored 'General case' 0 C--O 1.276 2.463 0 CA-C-O 115.698 -2.096 . . . . 0.0 111.405 -171.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.676 ' CE1' ' CZ2' ' P' ' 156' ' ' TRP . 0.2 OUTLIER -73.25 -56.87 4.51 Favored 'General case' 0 C--O 1.28 2.696 0 CA-C-N 124.924 3.511 . . . . 0.0 112.93 169.929 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.27 2.182 0 O-C-N 117.962 -2.961 . . . . 0.0 113.651 -170.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.544 ' CD1' ' CD2' ' P' ' 148' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.256 1.416 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . 0.433 ' O ' ' N ' ' P' ' 121' ' ' THR . 1.3 p -65.25 150.03 48.93 Favored 'General case' 0 C--N 1.382 2.02 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 -168.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' P' ' 122' ' ' TYR . 33.2 ttmt -45.06 -35.92 3.28 Favored 'General case' 0 C--N 1.382 1.98 0 CA-C-N 114.5 -1.227 . . . . 0.0 109.212 -178.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.2 -59.7 4.23 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-O 124.361 2.029 . . . . 0.0 109.49 174.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.555 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.6 mt-30 -60.24 -48.09 83.2 Favored 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.332 2.253 . . . . 0.0 109.949 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.635 ' HA ' HD12 ' P' ' 124' ' ' LEU . 4.2 m -47.47 -55.94 8.03 Favored 'General case' 0 C--N 1.385 2.139 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 167.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.587 ' CZ ' ' HG3' ' P' ' 126' ' ' ARG . 0.0 OUTLIER -52.85 -51.37 61.29 Favored 'General case' 0 C--N 1.38 1.912 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.023 -168.498 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.952 ' CD ' HG22 ' P' ' 146' ' ' ILE . 7.8 mt-10 -65.34 -36.37 83.81 Favored 'General case' 0 C--N 1.379 1.869 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.764 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.698 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.3 mt -60.01 -51.87 67.83 Favored 'General case' 0 C--N 1.383 2.062 0 O-C-N 120.885 -1.135 . . . . 0.0 109.735 170.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.469 ' O ' ' N ' ' P' ' 129' ' ' ARG . 19.1 mt-10 -55.89 -49.49 73.25 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-O 122.638 1.208 . . . . 0.0 109.738 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.587 ' HG3' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -42.39 -70.41 0.11 Allowed 'General case' 0 C--N 1.378 1.826 0 CA-C-N 111.896 -2.411 . . . . 0.0 108.717 176.464 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.653 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.3 OUTLIER -58.7 -36.59 74.49 Favored 'General case' 0 C--N 1.393 2.484 0 CA-C-N 112.641 -2.072 . . . . 0.0 108.393 -171.179 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.774 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 25.9 t80 -70.42 -47.23 61.73 Favored 'General case' 0 C--N 1.38 1.924 0 CA-C-O 121.638 0.732 . . . . 0.0 110.346 179.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.513 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 0.0 OUTLIER -62.52 -20.62 64.82 Favored 'General case' 0 C--N 1.381 1.949 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -168.585 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -94.06 -44.15 8.17 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-O 123.886 1.803 . . . . 0.0 106.576 -169.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.31 127.34 5.62 Favored 'General case' 0 C--N 1.394 2.51 0 CA-C-N 112.005 -2.361 . . . . 0.0 109.957 -163.235 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.03 -20.14 49.7 Favored 'General case' 0 C--N 1.397 2.673 0 CA-C-N 111.366 -2.652 . . . . 0.0 110.616 -158.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.674 ' HD1' ' CZ ' ' P' ' 161' ' ' ARG . 18.0 m-85 -153.0 115.57 4.48 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-O 124.946 2.307 . . . . 0.0 109.094 -154.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.544 HD22 ' HG3' ' P' ' 138' ' ' GLU . 35.8 mt -113.27 139.41 48.84 Favored 'General case' 0 C--N 1.417 3.534 0 O-C-N 119.65 -1.906 . . . . 0.0 108.724 -166.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . 0.409 ' HB2' ' HD2' ' P' ' 137' ' ' PRO . 0.0 OUTLIER -79.25 154.52 29.12 Favored 'General case' 0 C--N 1.384 2.106 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 158.39 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.29 -42.94 97.46 Favored Pre-proline 0 CA--C 1.583 2.224 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.455 -162.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.409 ' HD2' ' HB2' ' P' ' 135' ' ' SER . 0.0 OUTLIER -48.28 -48.48 16.76 Favored 'Trans proline' 0 C--N 1.394 2.942 0 C-N-CA 121.706 1.604 . . . . 0.0 115.903 -178.747 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.544 ' HG3' HD22 ' P' ' 134' ' ' LEU . 5.0 mm-40 -52.85 -60.79 2.83 Favored 'General case' 0 C--N 1.394 2.506 0 CA-C-O 123.89 1.805 . . . . 0.0 106.183 175.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.645 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -70.03 -33.58 72.16 Favored 'General case' 0 C--O 1.27 2.171 0 CA-C-N 109.662 -3.426 . . . . 0.0 109.494 -161.726 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.677 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 6.8 mt-10 -52.76 -47.84 67.18 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-N 121.434 1.925 . . . . 0.0 107.783 169.12 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -68.08 -36.67 80.2 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-N 112.241 -2.254 . . . . 0.0 109.033 -164.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.653 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.0 OUTLIER -65.96 -42.07 90.39 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-O 123.177 1.465 . . . . 0.0 109.073 168.768 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -55.71 -36.69 67.46 Favored 'General case' 0 C--N 1.389 2.319 0 CA-C-N 112.646 -2.07 . . . . 0.0 108.413 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.599 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.6 t -72.8 -41.18 65.22 Favored 'General case' 0 C--N 1.388 2.261 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.545 -178.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 77.8 mt -66.76 -50.9 61.24 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-O 124.882 2.277 . . . . 0.0 108.048 -165.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.963 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -90.7 -17.94 7.69 Favored 'Isoleucine or valine' 0 C--N 1.387 2.229 0 CA-C-N 110.406 -3.088 . . . . 0.0 107.949 -172.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 81.84 38.35 0.06 Allowed 'General case' 0 C--N 1.386 2.161 0 CA-C-N 111.414 -2.63 . . . . 0.0 107.981 153.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.963 HD12 HD11 ' P' ' 146' ' ' ILE . 6.0 mt -94.92 172.84 7.91 Favored 'General case' 0 C--N 1.39 2.356 0 CA-C-N 112.018 -2.356 . . . . 0.0 109.165 166.216 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.528 ' O ' ' N ' ' P' ' 152' ' ' GLN . 16.8 p -87.84 145.29 36.4 Favored Pre-proline 0 CA--C 1.585 2.304 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 168.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.543 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 65.9 Cg_exo -49.56 -48.28 19.58 Favored 'Trans proline' 0 C--N 1.408 3.701 0 C-N-CA 124.078 3.185 . . . . 0.0 113.909 -167.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.52 -26.27 54.12 Favored 'General case' 0 C--N 1.388 2.255 0 CA-C-N 112.174 -2.285 . . . . 0.0 110.339 173.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' P' ' 149' ' ' THR . 47.3 mt-30 -77.58 -28.44 51.67 Favored 'General case' 0 C--N 1.392 2.42 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 174.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.593 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.0 OUTLIER -64.19 -70.5 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.954 0 CA-C-N 122.326 2.33 . . . . 0.0 109.545 163.395 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.645 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.0 -59.21 0.43 Allowed 'General case' 0 C--N 1.385 2.149 0 C-N-CA 124.869 1.267 . . . . 0.0 110.338 -176.818 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.446 HD13 ' HA ' ' P' ' 155' ' ' ILE . 9.4 mm -64.03 -34.5 68.98 Favored 'Isoleucine or valine' 0 C--N 1.385 2.12 0 CA-C-N 112.898 -1.955 . . . . 0.0 110.163 -171.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.698 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.7 t90 -67.45 -31.55 71.79 Favored 'General case' 0 C--N 1.381 1.95 0 O-C-N 121.305 -0.872 . . . . 0.0 109.472 168.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.774 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 65.0 m-85 -74.62 -40.24 61.64 Favored 'General case' 0 C--O 1.273 2.338 0 O-C-N 121.436 -0.79 . . . . 0.0 111.975 172.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.519 ' N ' ' O ' ' P' ' 154' ' ' LYS . 39.3 mt-30 -54.25 -59.67 4.36 Favored 'General case' 0 C--N 1.378 1.823 0 O-C-N 119.592 -1.943 . . . . 0.0 106.244 170.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -57.11 -24.74 56.27 Favored 'General case' 0 C--N 1.389 2.32 0 CA-C-O 117.509 -1.234 . . . . 0.0 109.935 -169.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.548 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 3.1 t60 -79.08 -41.84 27.79 Favored 'General case' 0 C--O 1.284 2.92 0 CA-C-N 121.779 2.082 . . . . 0.0 111.323 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.674 ' CZ ' ' HD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.264 1.818 0 CA-C-N 122.946 2.612 . . . . 0.0 109.955 -176.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.514 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.0 m-85 . . . . . 0 C--O 1.257 1.452 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.82 148.05 52.44 Favored 'General case' 0 C--N 1.382 1.994 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 -170.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' P' ' 122' ' ' TYR . 31.5 ttmt -43.24 -36.37 1.76 Allowed 'General case' 0 C--N 1.382 1.979 0 CA-C-N 113.425 -1.716 . . . . 0.0 109.218 -177.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' P' ' 122' ' ' TYR . . . -53.68 -66.78 0.33 Allowed 'General case' 0 C--N 1.382 1.978 0 CA-C-O 124.178 1.942 . . . . 0.0 109.14 174.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.0 mt-30 -48.52 -49.35 36.44 Favored 'General case' 0 C--N 1.382 2.001 0 CA-C-N 112.448 -2.16 . . . . 0.0 109.527 177.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.721 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.5 m -51.6 -54.27 29.51 Favored 'General case' 0 C--N 1.384 2.101 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 171.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.664 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.9 OUTLIER -52.96 -46.5 68.23 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 122.428 1.109 . . . . 0.0 110.095 -172.085 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.713 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.89 -38.74 86.83 Favored 'General case' 0 C--N 1.379 1.871 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.87 179.84 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' P' ' 121' ' ' THR . 1.3 mt -60.56 -50.23 74.36 Favored 'General case' 0 C--N 1.385 2.112 0 O-C-N 120.305 -1.497 . . . . 0.0 109.525 172.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.457 ' O ' ' N ' ' P' ' 129' ' ' ARG . 23.4 mt-10 -55.81 -50.35 70.77 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-O 122.626 1.203 . . . . 0.0 109.653 177.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.664 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.46 -68.38 0.19 Allowed 'General case' 0 C--N 1.378 1.808 0 CA-C-N 112.09 -2.323 . . . . 0.0 108.844 175.184 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.769 ' CG ' HD13 ' P' ' 142' ' ' LEU . 1.1 mmt85 -60.56 -36.19 77.89 Favored 'General case' 0 C--N 1.386 2.165 0 CA-C-N 113.06 -1.882 . . . . 0.0 108.418 -170.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.796 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 13.7 t80 -70.2 -48.09 58.67 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-N 119.066 0.848 . . . . 0.0 110.123 176.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' P' ' 125' ' ' GLU . 14.7 mtm180 -62.5 -18.88 62.88 Favored 'General case' 0 C--N 1.381 1.945 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 -168.132 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -95.35 -41.04 9.21 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 123.975 1.845 . . . . 0.0 107.059 -173.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.442 ' OE1' HD21 ' P' ' 134' ' ' LEU . 1.8 tt0 -156.46 123.59 5.3 Favored 'General case' 0 C--N 1.393 2.487 0 CA-C-N 111.888 -2.414 . . . . 0.0 108.982 -156.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . 0.445 ' NH1' ' HG3' ' P' ' 132' ' ' ARG . 0.0 OUTLIER -77.73 -16.54 58.37 Favored 'General case' 0 C--N 1.384 2.08 0 CA-C-N 111.805 -2.452 . . . . 0.0 110.249 -172.021 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . 0.458 ' HD1' ' HA ' ' P' ' 133' ' ' TYR . 0.2 OUTLIER -155.27 123.84 6.02 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-O 124.886 2.279 . . . . 0.0 109.308 -154.255 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.523 HD11 ' HD3' ' P' ' 127' ' ' ARG . 30.9 mt -136.05 136.93 40.63 Favored 'General case' 0 C--N 1.404 2.954 0 O-C-N 119.884 -1.76 . . . . 0.0 109.359 -164.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . 0.402 ' HB2' ' HD2' ' P' ' 137' ' ' PRO . 0.1 OUTLIER -82.45 151.71 26.44 Favored 'General case' 0 C--N 1.383 2.05 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 172.948 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.68 -39.49 76.98 Favored Pre-proline 0 CA--C 1.588 2.406 0 O-C-N 121.405 -0.81 . . . . 0.0 109.259 -165.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.402 ' HD2' ' HB2' ' P' ' 135' ' ' SER . 0.1 OUTLIER -55.71 -42.56 66.24 Favored 'Trans proline' 0 C--N 1.396 3.033 0 N-CA-C 119.2 2.731 . . . . 0.0 119.2 175.638 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.413 ' HB3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -49.32 -71.28 0.07 Allowed 'General case' 0 C--N 1.379 1.855 0 CA-C-O 124.626 2.155 . . . . 0.0 107.548 162.771 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.824 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.26 -37.07 77.75 Favored 'General case' 0 C--N 1.391 2.376 0 CA-C-N 109.563 -3.471 . . . . 0.0 108.492 -157.37 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.636 ' O ' ' N ' ' P' ' 144' ' ' SER . 2.4 mt-10 -53.29 -40.3 64.63 Favored 'General case' 0 C--N 1.381 1.952 0 CA-C-O 123.103 1.43 . . . . 0.0 108.023 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . 0.424 ' O ' ' HB3' ' P' ' 144' ' ' SER . 3.9 t-160 -63.3 -36.0 82.23 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-N 112.937 -1.938 . . . . 0.0 108.445 -171.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.769 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.7 tp -66.02 -43.19 88.39 Favored 'General case' 0 C--N 1.383 2.024 0 CA-C-O 123.037 1.399 . . . . 0.0 109.16 168.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.628 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.07 -33.17 64.78 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 112.75 -2.023 . . . . 0.0 108.28 173.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.636 ' N ' ' O ' ' P' ' 140' ' ' GLU . 7.4 t -73.5 -44.26 58.2 Favored 'General case' 0 C--N 1.387 2.228 0 CA-C-N 113.631 -1.622 . . . . 0.0 109.698 -177.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 83.0 mt -68.04 -44.22 76.9 Favored 'General case' 0 C--N 1.38 1.933 0 CA-C-O 124.793 2.235 . . . . 0.0 108.255 -163.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 1.009 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -100.2 -13.08 8.31 Favored 'Isoleucine or valine' 0 C--N 1.39 2.34 0 CA-C-N 110.931 -2.85 . . . . 0.0 107.916 -167.696 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 82.37 34.74 0.07 Allowed 'General case' 0 C--N 1.382 1.993 0 CA-C-O 125.508 2.575 . . . . 0.0 107.942 152.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 1.009 HD12 HD11 ' P' ' 146' ' ' ILE . 9.3 mt -96.26 169.59 9.83 Favored 'General case' 0 C--N 1.397 2.637 0 CA-C-N 111.573 -2.558 . . . . 0.0 109.516 170.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.648 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.5 p -91.56 139.81 25.17 Favored Pre-proline 0 CA--C 1.593 2.597 0 CA-C-O 122.661 1.22 . . . . 0.0 108.543 170.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.417 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 15.0 Cg_exo -56.07 -35.31 94.67 Favored 'Trans proline' 1 C--N 1.415 4.047 0 C-N-CA 122.688 2.259 . . . . 0.0 112.92 -159.674 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 1.3 m -59.65 -28.5 67.3 Favored 'General case' 0 C--N 1.384 2.071 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.866 167.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.648 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -72.8 -30.83 64.39 Favored 'General case' 0 C--O 1.271 2.197 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.609 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.4 t -64.35 -74.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 122.094 2.224 . . . . 0.0 109.326 164.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.824 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -38.22 -45.71 0.99 Allowed 'General case' 0 C--N 1.385 2.128 0 C-N-CA 125.452 1.501 . . . . 0.0 110.873 -173.069 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . 0.542 HD13 ' HA ' ' P' ' 155' ' ' ILE . 0.7 OUTLIER -59.28 -64.72 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.382 2.015 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 -179.445 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.721 ' HB3' HD22 ' P' ' 124' ' ' LEU . 2.1 t90 -49.6 -30.9 9.53 Favored 'General case' 0 C--N 1.385 2.126 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -176.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.796 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 45.9 m-85 -74.57 -44.93 48.54 Favored 'General case' 0 C--O 1.278 2.598 0 O-C-N 121.252 -0.905 . . . . 0.0 112.228 171.215 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -46.05 -64.31 0.78 Allowed 'General case' 0 C--N 1.378 1.815 0 O-C-N 119.0 -2.312 . . . . 0.0 107.005 167.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -55.97 -21.54 21.62 Favored 'General case' 0 C--N 1.386 2.193 0 CA-C-O 117.431 -1.271 . . . . 0.0 110.551 -164.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.534 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 1.0 OUTLIER -80.69 -41.58 23.44 Favored 'General case' 0 C--O 1.292 3.31 0 CA-C-N 121.621 2.01 . . . . 0.0 112.436 176.73 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.507 ' NH2' ' HB3' ' P' ' 157' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.267 1.984 0 CA-C-N 123.825 3.011 . . . . 0.0 109.116 -167.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 116' ' ' PHE . . . . . 0.4 ' CD1' ' CD2' ' P' ' 148' ' ' LEU . 2.1 m-85 . . . . . 0 C--O 1.257 1.496 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.1 p -66.01 149.48 50.17 Favored 'General case' 0 C--N 1.383 2.026 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 -171.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -45.06 -36.9 3.81 Favored 'General case' 0 C--N 1.381 1.973 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.067 -177.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.5 -57.91 9.02 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 113.136 -1.847 . . . . 0.0 109.655 175.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' P' P ' 120' ' ' GLN . . . . . 0.572 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.7 mt-30 -60.9 -48.66 80.77 Favored 'General case' 0 C--N 1.382 2.01 0 C-N-CA 126.728 2.011 . . . . 0.0 109.694 179.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 121' ' ' THR . . . . . 0.691 ' HA ' HD12 ' P' ' 124' ' ' LEU . 5.7 m -47.6 -54.68 11.15 Favored 'General case' 0 C--N 1.383 2.062 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 169.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 122' ' ' TYR . . . . . 0.57 ' CZ ' ' HG3' ' P' ' 126' ' ' ARG . 0.0 OUTLIER -52.3 -51.17 60.1 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.09 -170.361 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' P' P ' 123' ' ' GLU . . . . . 0.942 ' CD ' HG22 ' P' ' 146' ' ' ILE . 7.8 mt-10 -64.89 -37.38 87.45 Favored 'General case' 0 C--N 1.379 1.89 0 CA-C-N 113.964 -1.471 . . . . 0.0 107.601 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 124' ' ' LEU . . . . . 0.705 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.3 mt -60.82 -49.67 76.56 Favored 'General case' 0 C--N 1.384 2.097 0 O-C-N 120.967 -1.083 . . . . 0.0 110.28 171.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 125' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' P' ' 129' ' ' ARG . 27.2 mt-10 -53.97 -55.39 27.53 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-O 122.347 1.07 . . . . 0.0 108.394 176.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 126' ' ' ARG . . . . . 0.603 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -39.08 -68.38 0.17 Allowed 'General case' 0 C--N 1.379 1.861 0 CA-C-N 111.935 -2.393 . . . . 0.0 108.882 179.697 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' P' P ' 127' ' ' ARG . . . . . 0.889 ' HG2' HD13 ' P' ' 142' ' ' LEU . 0.0 OUTLIER -58.54 -34.47 71.05 Favored 'General case' 0 C--N 1.394 2.536 0 CA-C-N 112.673 -2.058 . . . . 0.0 108.469 -174.831 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' P' P ' 128' ' ' PHE . . . . . 0.715 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 9.0 t80 -67.73 -50.94 54.72 Favored 'General case' 0 C--N 1.388 2.264 0 O-C-N 121.213 -0.93 . . . . 0.0 110.382 176.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 129' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' P' ' 125' ' ' GLU . 3.2 mmm180 -62.56 -13.15 27.79 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 112.894 -1.957 . . . . 0.0 108.073 -165.353 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -107.88 -39.74 5.46 Favored 'General case' 0 C--N 1.379 1.886 0 C-N-CA 126.319 1.848 . . . . 0.0 107.444 -169.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' P' P ' 131' ' ' GLN . . . . . 0.511 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.4 OUTLIER -153.99 109.08 3.13 Favored 'General case' 0 C--N 1.386 2.164 0 CA-C-N 112.003 -2.362 . . . . 0.0 109.34 -152.914 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -77.04 -18.09 58.33 Favored 'General case' 0 C--N 1.393 2.479 0 CA-C-N 112.45 -2.159 . . . . 0.0 110.556 -167.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' P' P ' 133' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -156.81 112.51 2.92 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-N 114.212 -1.358 . . . . 0.0 108.065 -154.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' P' P ' 134' ' ' LEU . . . . . 0.599 HD11 ' HB3' ' P' ' 127' ' ' ARG . 20.4 mt -127.88 130.63 48.85 Favored 'General case' 0 C--N 1.398 2.701 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 -154.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.19 156.79 20.17 Favored 'General case' 0 C--N 1.382 1.987 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 136' ' ' ALA . . . . . 0.463 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.36 -43.3 98.03 Favored Pre-proline 0 CA--C 1.585 2.319 0 O-C-N 121.452 -0.78 . . . . 0.0 109.377 -158.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 137' ' ' PRO . . . . . 0.463 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 0.2 OUTLIER -56.5 -40.17 86.35 Favored 'Trans proline' 0 C--N 1.395 3.001 0 N-CA-C 119.056 2.675 . . . . 0.0 119.056 176.694 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' P' P ' 138' ' ' GLU . . . . . 0.459 ' HB3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -49.79 -73.7 0.04 OUTLIER 'General case' 0 C--N 1.38 1.902 0 CA-C-O 124.049 1.88 . . . . 0.0 107.497 161.721 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' P' P ' 139' ' ' ARG . . . . . 0.921 ' CZ ' ' HG3' ' P' ' 154' ' ' LYS . 2.1 ptt180 -69.79 -33.53 72.51 Favored 'General case' 0 C--N 1.391 2.386 0 CA-C-N 109.722 -3.399 . . . . 0.0 108.774 -156.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 140' ' ' GLU . . . . . 0.682 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 1.7 mt-10 -53.1 -45.99 68.49 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-O 123.578 1.656 . . . . 0.0 108.127 174.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -66.99 -35.49 80.07 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 112.439 -2.164 . . . . 0.0 109.417 -164.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' P' P ' 142' ' ' LEU . . . . . 0.889 HD13 ' HG2' ' P' ' 127' ' ' ARG . 1.1 tp -65.31 -41.79 93.67 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-O 123.369 1.557 . . . . 0.0 108.981 169.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 143' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -57.04 -36.41 70.46 Favored 'General case' 0 C--N 1.39 2.36 0 CA-C-N 112.224 -2.262 . . . . 0.0 107.971 173.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 144' ' ' SER . . . . . 0.555 ' N ' ' O ' ' P' ' 140' ' ' GLU . 2.1 t -69.76 -43.07 72.98 Favored 'General case' 0 C--N 1.388 2.275 0 CA-C-N 113.22 -1.809 . . . . 0.0 111.083 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 82.5 mt -69.04 -48.14 63.63 Favored 'General case' 0 C--N 1.38 1.891 0 CA-C-O 124.851 2.263 . . . . 0.0 108.205 -163.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' P' P ' 146' ' ' ILE . . . . . 0.966 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -92.02 -13.89 8.69 Favored 'Isoleucine or valine' 0 C--N 1.389 2.325 0 CA-C-N 110.675 -2.966 . . . . 0.0 107.958 -169.407 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 82.27 36.13 0.07 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 125.761 2.696 . . . . 0.0 107.66 152.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' P' P ' 148' ' ' LEU . . . . . 0.966 HD12 HD11 ' P' ' 146' ' ' ILE . 8.3 mt -95.18 173.82 7.37 Favored 'General case' 0 C--N 1.396 2.594 0 CA-C-N 111.353 -2.658 . . . . 0.0 109.083 166.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 149' ' ' THR . . . . . 0.426 ' O ' ' N ' ' P' ' 152' ' ' GLN . 16.6 p -89.16 148.22 40.32 Favored Pre-proline 0 CA--C 1.586 2.349 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 164.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 150' ' ' PRO . . . . . 0.544 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 86.6 Cg_exo -50.36 -51.99 9.89 Favored 'Trans proline' 0 C--N 1.408 3.69 0 C-N-CA 123.48 2.787 . . . . 0.0 113.543 -169.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -11.59 3.6 Favored 'General case' 0 C--N 1.388 2.252 0 CA-C-N 113.341 -1.754 . . . . 0.0 110.782 175.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 152' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' P' ' 149' ' ' THR . 43.6 mt-30 -86.31 -30.55 22.17 Favored 'General case' 0 C--O 1.279 2.656 0 CA-C-N 120.0 1.273 . . . . 0.0 108.443 167.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 153' ' ' VAL . . . . . 0.723 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.4 t -63.52 -72.93 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.38 1.919 0 CA-C-N 123.534 2.879 . . . . 0.0 109.779 163.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 154' ' ' LYS . . . . . 0.921 ' HG3' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -32.43 -56.11 0.34 Allowed 'General case' 0 C--N 1.385 2.117 0 C-N-CA 124.358 1.063 . . . . 0.0 110.822 -176.68 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.81 -45.13 95.12 Favored 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 113.549 -1.66 . . . . 0.0 108.937 -171.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 156' ' ' TRP . . . . . 0.705 ' HB3' HD22 ' P' ' 124' ' ' LEU . 2.7 t90 -62.97 -31.54 72.67 Favored 'General case' 0 C--N 1.381 1.947 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.06 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 157' ' ' PHE . . . . . 0.723 ' CE2' HG13 ' P' ' 153' ' ' VAL . 66.0 m-85 -74.87 -35.57 62.32 Favored 'General case' 0 C--O 1.279 2.623 0 O-C-N 121.275 -0.89 . . . . 0.0 111.819 170.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 158' ' ' GLN . . . . . 0.549 ' N ' ' O ' ' P' ' 154' ' ' LYS . 33.0 mt-30 -56.96 -62.76 1.52 Allowed 'General case' 0 C--N 1.378 1.817 0 O-C-N 119.047 -2.283 . . . . 0.0 106.802 169.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -56.65 -24.91 51.71 Favored 'General case' 0 C--N 1.393 2.46 0 CA-C-O 117.062 -1.447 . . . . 0.0 109.525 -166.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' P' P ' 160' ' ' HIS . . . . . 0.544 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.1 t60 -74.38 -49.19 23.67 Favored 'General case' 0 C--O 1.283 2.835 0 CA-C-N 121.463 1.938 . . . . 0.0 109.914 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' P' P ' 161' ' ' ARG . . . . . 0.562 HH21 ' HB3' ' P' ' 157' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.267 2.003 0 CA-C-N 122.19 2.268 . . . . 0.0 109.527 -160.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.556 3.755 0 N19-C1'-C2' 119.613 3.383 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.639 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.561 3.299 1 P-O3'-C3' 124.761 4.218 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.639 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.861 0 C2'-C3'-O3' 116.949 2.352 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.614 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.337 0 P-O3'-C3' 122.852 2.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.534 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.88 1 P-O3'-C3' 125.527 4.856 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.517 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.977 0 N19-C1'-C2' 118.986 2.992 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.935 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.627 1 P-O3'-C3' 125.268 4.64 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.935 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.449 0 P-O3'-C3' 123.177 2.897 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.655 " H5'" ' HE2' ' P' ' 111' ' ' LYS . . . . . . . . 0 C5'--C4' 1.538 3.378 0 O4'-C4'-C3' 108.452 2.852 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.591 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.858 0 P-O3'-C3' 123.228 2.94 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.573 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.46 0 O4'-C4'-C3' 108.412 2.812 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . 0.441 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.437 1 P-O3'-C3' 125.018 4.432 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.636 " H2'" ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.578 0 O4'-C4'-C3' 108.387 2.787 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.841 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.691 0 C2'-C3'-O3' 116.666 2.247 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.943 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.832 1 O4'-C1'-N19 111.396 4.494 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.943 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.452 0 C3'-C2'-C1' 106.442 2.673 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.752 0 O5'-C5'-C4' 115.063 3.473 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.5 ' C4 ' ' N6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.617 1 P-O3'-C3' 125.071 4.476 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.5 ' N6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.358 0 O4'-C4'-C3' 108.201 2.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.454 " H1'" ' N3 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.454 0 O4'-C4'-C3' 108.208 2.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.507 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.571 4.291 0 O4'-C1'-N19 105.244 -3.195 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.507 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.481 1 P-O3'-C3' 127.073 6.144 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.573 ' C2 ' ' C2 ' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.635 0 O4'-C4'-C3' 107.991 2.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.535 ' C2 ' ' N3 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.74 0 P-O3'-C3' 123.929 3.524 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.442 H5'' H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.728 0 P-O3'-C3' 124.109 3.674 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.56 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.182 0 N19-C1'-C2' 119.066 3.041 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.615 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.683 0 P-O3'-C3' 123.472 3.143 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.615 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.562 0 C4'-C3'-C2' 100.642 -2.558 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.614 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.633 0 P-O3'-C3' 124.11 3.675 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.594 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.346 0 O4'-C4'-C3' 108.09 2.49 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.594 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.646 0 O4'-C4'-C3' 108.348 2.748 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . 0.476 ' C2 ' ' N2 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.891 0 O4'-C1'-N19 109.315 1.894 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.528 3.462 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.6 m -178.25 136.93 0.17 Allowed 'General case' 0 C--N 1.382 2.008 0 CA-C-N 113.674 -1.603 . . . . 0.0 108.654 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 170.01 -38.31 0.0 OUTLIER 'General case' 0 C--N 1.388 2.268 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.023 -171.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . 116.86 -90.29 0.51 Allowed Glycine 0 C--N 1.381 3.065 0 N-CA-C 108.92 -1.672 . . . . 0.0 108.92 -162.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.709 HD22 ' HD2' ' P' ' 106' ' ' PRO . 0.6 OUTLIER 170.89 149.44 0.17 Allowed Pre-proline 0 CA--C 1.581 2.159 0 CA-C-N 113.663 -1.268 . . . . 0.0 108.689 -166.167 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.709 ' HD2' HD22 ' P' ' 105' ' ' LEU . 73.3 Cg_exo -50.28 92.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.396 3.069 0 C-N-CA 122.777 2.318 . . . . 0.0 110.315 155.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -141.59 146.46 36.3 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-O 122.392 1.091 . . . . 0.0 109.183 162.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . 0.85 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -157.56 54.86 0.49 Allowed 'General case' 0 C--N 1.381 1.976 0 CA-C-N 113.701 -1.591 . . . . 0.0 108.091 -169.304 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.505 ' HB3' ' HE3' ' P' ' 109' ' ' LYS . 0.0 OUTLIER -84.92 168.39 15.06 Favored 'General case' 0 C--N 1.38 1.923 0 CA-C-N 113.623 -1.626 . . . . 0.0 108.829 -155.215 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.85 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.7 OUTLIER -144.18 100.97 3.64 Favored 'General case' 0 C--N 1.381 1.966 0 CA-C-N 113.98 -1.463 . . . . 0.0 108.873 -155.185 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.655 ' HE2' " H5'" ' A' ' 9' ' ' ' DG' . 0.3 OUTLIER -104.97 95.93 6.19 Favored 'General case' 0 C--N 1.381 1.94 0 CA-C-N 113.654 -1.612 . . . . 0.0 107.452 170.491 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.21 146.63 30.38 Favored 'General case' 0 C--N 1.378 1.817 0 CA-C-N 113.149 -1.841 . . . . 0.0 106.827 160.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 1.012 ' CD ' HD21 ' P' ' 115' ' ' LEU . 1.3 ttm180 -59.68 117.88 5.47 Favored 'General case' 0 C--N 1.388 2.277 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 -166.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.542 ' O ' HG13 ' P' ' 114' ' ' VAL . 11.7 p -107.12 58.85 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.023 0 CA-C-O 124.948 2.309 . . . . 0.0 108.018 -154.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 1.012 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.07 136.06 38.64 Favored 'General case' 0 C--N 1.39 2.366 0 CA-C-N 111.232 -2.713 . . . . 0.0 109.963 -155.328 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.513 ' CE2' ' HB2' ' P' ' 156' ' ' TRP . 1.0 OUTLIER -90.28 145.76 24.74 Favored 'General case' 0 C--N 1.381 1.966 0 CA-C-N 113.499 -1.682 . . . . 0.0 108.461 178.382 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -68.14 147.53 52.17 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -174.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' P' ' 122' ' ' TYR . 34.7 ttmt -43.96 -37.16 2.77 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 112.824 -1.989 . . . . 0.0 109.165 -177.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . 0.411 ' O ' ' HB3' ' P' ' 122' ' ' TYR . . . -53.5 -65.26 0.6 Allowed 'General case' 0 C--N 1.383 2.024 0 CA-C-O 124.071 1.891 . . . . 0.0 109.279 174.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.566 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.6 mt-30 -48.24 -49.58 32.7 Favored 'General case' 0 C--N 1.382 1.991 0 CA-C-N 112.56 -2.109 . . . . 0.0 109.394 175.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.616 ' HA ' HD12 ' P' ' 124' ' ' LEU . 22.6 m -49.07 -55.76 11.14 Favored 'General case' 0 C--N 1.382 1.987 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 170.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.686 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.19 -46.1 68.85 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-O 122.504 1.145 . . . . 0.0 110.224 -169.47 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.664 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.1 OUTLIER -66.16 -40.05 90.23 Favored 'General case' 0 C--N 1.379 1.883 0 CA-C-N 113.983 -1.462 . . . . 0.0 107.927 179.102 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.839 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -61.02 -48.68 80.65 Favored 'General case' 0 C--N 1.385 2.139 0 O-C-N 120.484 -1.385 . . . . 0.0 110.226 172.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.404 ' O ' ' N ' ' P' ' 129' ' ' ARG . 26.0 mt-10 -53.17 -56.12 18.86 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 122.191 0.996 . . . . 0.0 108.598 175.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.686 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.53 -62.0 0.74 Allowed 'General case' 0 C--N 1.379 1.855 0 CA-C-N 112.172 -2.285 . . . . 0.0 108.705 179.113 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.536 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.4 OUTLIER -66.85 -30.51 70.71 Favored 'General case' 0 C--N 1.395 2.571 0 CA-C-N 112.233 -2.258 . . . . 0.0 108.282 -170.63 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.824 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.4 t80 -69.74 -50.82 39.77 Favored 'General case' 0 C--N 1.387 2.232 0 O-C-N 121.067 -1.021 . . . . 0.0 110.96 171.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.448 ' HA ' ' NE ' ' P' ' 129' ' ' ARG . 0.4 OUTLIER -62.26 -12.01 18.13 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-N 113.338 -1.755 . . . . 0.0 108.177 -167.218 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -102.66 -43.33 5.63 Favored 'General case' 0 C--N 1.381 1.945 0 CA-C-O 123.985 1.85 . . . . 0.0 107.258 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.425 ' HG2' ' CD2' ' P' ' 134' ' ' LEU . 2.8 tp-100 -151.69 128.74 11.08 Favored 'General case' 0 C--N 1.387 2.209 0 CA-C-N 111.608 -2.542 . . . . 0.0 110.822 -154.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -79.33 -27.94 42.08 Favored 'General case' 0 C--N 1.389 2.29 0 CA-C-N 112.003 -2.362 . . . . 0.0 111.46 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.495 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 9.2 m-85 -158.66 114.48 2.65 Favored 'General case' 0 C--N 1.377 1.79 0 CA-C-O 122.679 1.228 . . . . 0.0 109.009 -150.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.676 HD22 ' HG3' ' P' ' 138' ' ' GLU . 36.6 mt -122.92 136.08 54.73 Favored 'General case' 0 C--N 1.404 2.957 0 CA-C-N 114.393 -1.276 . . . . 0.0 108.267 -160.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.11 155.79 26.09 Favored 'General case' 0 C--N 1.383 2.025 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 166.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.539 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.34 -49.86 90.43 Favored Pre-proline 0 CA--C 1.584 2.269 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -161.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 84.1 Cg_exo -57.87 -28.89 84.38 Favored 'Trans proline' 0 C--N 1.4 3.277 0 C-N-CA 121.122 1.215 . . . . 0.0 114.932 -174.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.676 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -53.92 -71.36 0.08 Allowed 'General case' 0 C--N 1.38 1.9 0 CA-C-O 124.606 2.146 . . . . 0.0 106.44 160.782 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.904 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.96 -38.69 79.57 Favored 'General case' 0 C--N 1.39 2.334 0 CA-C-N 109.828 -3.351 . . . . 0.0 108.785 -155.33 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.643 ' O ' ' N ' ' P' ' 144' ' ' SER . 5.6 mt-10 -52.84 -39.58 62.63 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 122.849 1.309 . . . . 0.0 108.183 177.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -64.83 -36.47 84.44 Favored 'General case' 0 C--N 1.379 1.879 0 CA-C-N 112.926 -1.943 . . . . 0.0 108.562 -170.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.656 ' O ' HG23 ' P' ' 146' ' ' ILE . 3.2 tp -64.84 -43.2 93.83 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-O 123.104 1.431 . . . . 0.0 109.116 167.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.635 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -57.31 -32.43 66.67 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 112.597 -2.092 . . . . 0.0 108.45 175.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.643 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.4 OUTLIER -73.71 -44.91 55.17 Favored 'General case' 0 C--N 1.386 2.158 0 CA-C-N 113.899 -1.501 . . . . 0.0 109.552 -178.07 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 78.5 mt -67.26 -42.84 83.24 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-O 124.598 2.142 . . . . 0.0 108.349 -163.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.994 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -101.82 -13.01 8.55 Favored 'Isoleucine or valine' 0 C--N 1.389 2.292 0 CA-C-N 111.05 -2.796 . . . . 0.0 107.817 -167.081 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 82.13 34.7 0.08 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-O 125.597 2.618 . . . . 0.0 107.98 152.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.994 HD12 HD11 ' P' ' 146' ' ' ILE . 8.4 mt -96.28 170.04 9.52 Favored 'General case' 0 C--N 1.397 2.633 0 CA-C-N 111.556 -2.565 . . . . 0.0 109.468 170.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.651 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.4 p -91.21 139.71 25.61 Favored Pre-proline 0 CA--C 1.592 2.58 0 CA-C-O 122.729 1.252 . . . . 0.0 108.718 169.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.434 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 16.2 Cg_exo -56.03 -33.9 90.89 Favored 'Trans proline' 1 C--N 1.415 4.075 0 C-N-CA 122.727 2.284 . . . . 0.0 113.114 -159.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -37.57 72.62 Favored 'General case' 0 C--N 1.383 2.045 0 C-N-CA 119.534 -0.866 . . . . 0.0 109.807 166.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.651 ' N ' ' O ' ' P' ' 149' ' ' THR . 49.0 mt-30 -68.51 -28.48 67.04 Favored 'General case' 0 C--N 1.387 2.225 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 -175.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.595 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.1 t -64.53 -70.31 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.193 0 CA-C-N 121.183 1.811 . . . . 0.0 109.517 165.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.904 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.95 -58.59 0.44 Allowed 'General case' 0 C--N 1.384 2.106 0 C-N-CA 125.013 1.325 . . . . 0.0 110.959 -178.143 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.512 HG21 " C5'" ' A' ' 8' ' ' ' DA' . 33.4 mm -60.19 -39.33 80.29 Favored 'Isoleucine or valine' 0 C--N 1.382 1.989 0 CA-C-N 113.106 -1.861 . . . . 0.0 109.114 -172.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.839 ' HB3' HD22 ' P' ' 124' ' ' LEU . 3.8 t90 -67.21 -32.08 72.9 Favored 'General case' 0 C--N 1.382 2.003 0 O-C-N 121.373 -0.829 . . . . 0.0 109.088 172.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.824 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 49.2 m-85 -74.66 -40.72 61.28 Favored 'General case' 0 C--O 1.273 2.337 0 O-C-N 120.927 -1.108 . . . . 0.0 111.972 173.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.497 ' OE1' HD13 ' P' ' 155' ' ' ILE . 77.8 mt-30 -52.37 -58.14 7.63 Favored 'General case' 0 C--N 1.377 1.778 0 O-C-N 119.771 -1.831 . . . . 0.0 106.765 170.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -55.84 -25.62 42.85 Favored 'General case' 0 C--N 1.388 2.27 0 CA-C-O 117.709 -1.138 . . . . 0.0 109.659 -168.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.575 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 2.1 t60 -79.75 -42.89 23.61 Favored 'General case' 0 C--O 1.286 2.992 0 CA-C-N 121.526 1.967 . . . . 0.0 111.878 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.616 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -67.53 -35.4 79.02 Favored 'General case' 0 C--O 1.267 2.003 0 CA-C-N 123.57 2.896 . . . . 0.0 110.785 -167.35 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . 0.589 ' HE2' ' CZ ' ' P' ' 166' ' ' ARG . 12.6 t80 -69.09 -37.96 78.71 Favored 'General case' 0 C--N 1.38 1.925 0 O-C-N 119.939 -1.726 . . . . 0.0 109.802 168.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.08 -36.81 84.82 Favored 'General case' 0 C--N 1.381 1.945 0 O-C-N 121.287 -0.883 . . . . 0.0 109.636 -167.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.616 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.6 OUTLIER -52.8 -59.84 4.0 Favored 'General case' 0 C--N 1.379 1.857 0 CA-C-O 125.179 2.419 . . . . 0.0 106.601 -175.37 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.423 ' HG2' HG23 ' P' ' 164' ' ' THR . 8.2 mmmt -58.74 -44.76 90.57 Favored 'General case' 0 C--N 1.387 2.221 1 CA-C-N 108.203 -4.089 . . . . 0.0 107.866 -159.583 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . 0.589 ' CZ ' ' HE2' ' P' ' 162' ' ' TYR . 5.7 mtt180 -55.36 -47.46 75.72 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-N 112.348 -2.205 . . . . 0.0 110.641 177.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -49.86 -37.66 31.98 Favored 'General case' 0 C--N 1.387 2.203 0 CA-C-O 123.347 1.546 . . . . 0.0 108.356 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.56 -23.2 40.1 Favored 'General case' 0 C--N 1.39 2.356 0 CA-C-N 111.884 -2.416 . . . . 0.0 109.447 -168.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -60.61 -33.2 72.4 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-O 122.55 1.167 . . . . 0.0 109.398 170.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.55 -39.21 90.26 Favored 'General case' 0 C--N 1.384 2.097 0 CA-C-N 113.772 -1.558 . . . . 0.0 108.117 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -89.89 88.96 7.53 Favored 'General case' 0 C--N 1.381 1.949 0 CA-C-N 113.819 -1.537 . . . . 0.0 109.182 -159.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 126.31 -79.47 0.37 Allowed Glycine 0 C--N 1.382 3.086 0 N-CA-C 108.947 -1.661 . . . . 0.0 108.947 -156.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 159.01 173.57 0.01 OUTLIER 'General case' 0 C--N 1.382 1.998 0 CA-C-N 113.517 -1.341 . . . . 0.0 109.969 156.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -81.33 51.29 1.6 Allowed 'General case' 0 C--N 1.381 1.949 0 CA-C-N 112.101 -2.318 . . . . 0.0 110.286 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -78.16 99.94 1.6 Allowed Glycine 0 C--N 1.383 3.166 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 -158.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -146.4 121.22 5.39 Favored Pre-proline 0 CA--C 1.58 2.101 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 -174.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 CA--C 1.594 3.483 0 C-N-CA 121.493 1.462 . . . . 0.0 111.641 169.992 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.64 0 N19-C1'-C2' 119.646 3.404 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.707 " C2'" ' H71' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.385 0 O4'-C4'-C3' 108.158 2.558 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.707 ' H71' " C2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.858 0 C2'-C3'-O3' 117.056 2.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.609 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.697 0 P-O3'-C3' 123.473 3.145 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.547 ' H71' " H2'" ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.95 0 N19-C1'-C2' 118.132 2.458 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.558 H2'' ' C8 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.566 3.804 1 P-O3'-C3' 129.012 7.76 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.657 ' OP1' HD13 ' P' ' 115' ' ' LEU . . . . . . . . 0 C5'--C4' 1.539 3.538 2 P-O3'-C3' 130.556 9.047 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.653 H2'' " O5'" ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.719 0 C3'-C2'-C1' 107.312 3.294 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.653 " O5'" H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.375 0 O4'-C4'-C3' 108.183 2.583 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.603 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.791 0 C2'-C3'-O3' 116.717 2.265 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.516 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.345 0 P-O3'-C3' 122.672 2.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . 0.473 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.352 0 O4'-C4'-C3' 107.96 2.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.5 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.568 0 O4'-C4'-C3' 108.211 2.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.5 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.551 0 P-O3'-C3' 124.437 3.947 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.905 ' C4 ' ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.541 3.749 1 O4'-C1'-N19 111.35 4.438 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.905 ' H71' ' C4 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.636 0 O4'-C1'-N19 109.728 2.41 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.634 0 O5'-C5'-C4' 115.071 3.479 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.568 3.951 0 O4'-C4'-C3' 108.207 2.607 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.458 0 O4'-C4'-C3' 108.234 2.634 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.556 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.298 0 O4'-C4'-C3' 108.017 2.417 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.647 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.572 4.375 0 N19-C1'-C2' 119.049 3.031 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.647 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.53 0 P-O3'-C3' 123.069 2.808 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.639 ' OP2' ' HD1' ' P' ' 162' ' ' TYR . . . . . . . . 0 C5'--C4' 1.538 3.352 0 C3'-C2'-C1' 107.035 3.096 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.619 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 P-O3'-C3' 123.666 3.305 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.503 " H5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.176 0 C2'-C3'-O3' 117.179 2.437 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.579 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.225 0 P-O3'-C3' 123.967 3.556 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.579 ' C8 ' H2'' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.554 3.568 0 P-O3'-C3' 123.603 3.253 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.535 ' C8 ' H2'' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.348 0 C3'-C2'-C1' 105.732 2.166 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.609 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.54 3.592 0 O4'-C4'-C3' 108.313 2.713 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.441 0 O4'-C4'-C3' 108.149 2.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.537 0 P-O3'-C3' 123.627 3.272 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . 0.472 ' C2 ' ' N2 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.829 0 O4'-C1'-N19 109.356 1.944 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.478 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.73 -59.4 1.75 Allowed 'General case' 0 C--N 1.381 1.977 0 CA-C-N 113.705 -1.589 . . . . 0.0 108.641 -176.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 169.96 23.32 0.0 OUTLIER 'General case' 0 C--N 1.395 2.559 0 CA-C-N 113.403 -1.726 . . . . 0.0 109.432 -169.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . 145.7 -118.6 1.1 Allowed Glycine 0 C--N 1.38 2.994 0 N-CA-C 108.815 -1.714 . . . . 0.0 108.815 -161.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.88 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.1 OUTLIER -172.17 154.88 3.43 Favored Pre-proline 0 CA--C 1.581 2.16 0 CA-C-N 113.717 -1.242 . . . . 0.0 108.573 177.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.88 ' HD2' HD13 ' P' ' 105' ' ' LEU . 66.8 Cg_exo -48.93 92.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.111 0 C-N-CA 122.854 2.37 . . . . 0.0 110.399 155.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -147.13 126.8 13.36 Favored 'General case' 0 C--N 1.38 1.92 0 CA-C-O 122.422 1.106 . . . . 0.0 109.178 159.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 22.5 mtmm -98.2 43.9 1.05 Allowed 'General case' 0 C--N 1.381 1.964 0 CA-C-N 113.705 -1.589 . . . . 0.0 107.853 175.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.488 ' HG3' ' N ' ' P' ' 110' ' ' ARG . 0.6 OUTLIER -94.45 162.49 13.8 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 113.35 -1.75 . . . . 0.0 109.821 175.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.488 ' N ' ' HG3' ' P' ' 109' ' ' LYS . 34.9 mmt-85 -118.75 -155.97 0.63 Allowed 'General case' 0 C--N 1.378 1.835 0 CA-C-N 113.723 -1.58 . . . . 0.0 107.231 -164.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' P' ' 111' ' ' LYS . 0.1 OUTLIER -140.18 116.89 10.9 Favored 'General case' 0 C--N 1.383 2.055 0 CA-C-N 112.06 -2.337 . . . . 0.0 108.026 176.326 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 3.3 mtp85 -76.5 150.48 36.63 Favored 'General case' 0 C--N 1.382 1.996 0 CA-C-N 113.656 -1.611 . . . . 0.0 108.037 154.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.967 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.3 OUTLIER -73.27 115.52 12.72 Favored 'General case' 0 C--N 1.387 2.201 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 -165.663 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.499 ' O ' HG13 ' P' ' 114' ' ' VAL . 13.9 p -107.82 59.09 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.048 0 CA-C-O 124.961 2.315 . . . . 0.0 108.012 -154.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.967 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.24 141.8 39.84 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 111.093 -2.776 . . . . 0.0 109.941 -155.433 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -92.25 145.57 24.39 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 113.703 -1.59 . . . . 0.0 108.51 -178.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.03 148.1 51.48 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -174.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' P' ' 122' ' ' TYR . 38.4 ttmt -44.02 -37.19 2.84 Favored 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.084 -1.871 . . . . 0.0 109.187 -178.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.58 -62.15 1.84 Allowed 'General case' 0 C--N 1.382 2.011 0 CA-C-O 124.036 1.874 . . . . 0.0 109.394 175.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.566 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.6 mt-30 -52.96 -48.16 67.58 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-N 112.617 -2.083 . . . . 0.0 109.587 177.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.645 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.0 m -49.33 -55.81 11.61 Favored 'General case' 0 C--N 1.384 2.093 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 169.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.546 ' CE1' ' CZ ' ' P' ' 126' ' ' ARG . 2.9 t80 -53.11 -48.11 68.08 Favored 'General case' 0 C--N 1.382 2.018 0 CA-C-O 122.628 1.204 . . . . 0.0 109.949 -169.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.971 ' CD ' HG22 ' P' ' 146' ' ' ILE . 4.2 mt-10 -66.02 -38.11 87.6 Favored 'General case' 0 C--N 1.378 1.807 0 CA-C-N 113.979 -1.464 . . . . 0.0 107.604 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.717 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.1 mt -60.76 -50.3 74.03 Favored 'General case' 0 C--N 1.385 2.114 0 O-C-N 120.658 -1.276 . . . . 0.0 110.062 171.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.474 ' O ' ' N ' ' P' ' 129' ' ' ARG . 15.5 mt-10 -54.3 -53.65 50.89 Favored 'General case' 0 C--N 1.379 1.887 0 CA-C-O 122.477 1.132 . . . . 0.0 109.014 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.578 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -39.94 -65.04 0.43 Allowed 'General case' 0 C--N 1.379 1.886 0 CA-C-N 111.96 -2.382 . . . . 0.0 108.76 177.46 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.878 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -63.78 -32.7 74.29 Favored 'General case' 0 C--N 1.394 2.519 0 CA-C-N 112.405 -2.18 . . . . 0.0 108.34 -170.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.765 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 7.3 t80 -68.76 -51.01 45.77 Favored 'General case' 0 C--N 1.386 2.174 0 CA-C-O 121.973 0.892 . . . . 0.0 110.373 173.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' P' ' 125' ' ' GLU . 8.9 mmm180 -62.36 -12.21 19.94 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.306 -1.77 . . . . 0.0 108.198 -165.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -107.75 -40.97 5.13 Favored 'General case' 0 C--N 1.379 1.878 0 C-N-CA 126.234 1.814 . . . . 0.0 107.626 -172.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.502 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.4 OUTLIER -156.11 97.89 1.83 Allowed 'General case' 0 C--N 1.387 2.22 0 CA-C-N 111.952 -2.385 . . . . 0.0 110.263 -153.164 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . 0.541 ' HG2' ' CD2' ' P' ' 133' ' ' TYR . 0.1 OUTLIER -76.98 -6.91 54.47 Favored 'General case' 0 C--N 1.394 2.501 0 CA-C-N 112.035 -2.348 . . . . 0.0 110.97 -163.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.563 ' CD1' ' CZ ' ' P' ' 161' ' ' ARG . 4.0 m-85 -161.6 112.42 1.68 Allowed 'General case' 0 C--N 1.381 1.946 0 CA-C-N 114.671 -1.15 . . . . 0.0 108.511 -154.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.611 HD22 ' HG3' ' P' ' 138' ' ' GLU . 30.3 mt -130.64 136.02 48.43 Favored 'General case' 0 C--N 1.396 2.599 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 -156.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.52 156.11 25.43 Favored 'General case' 0 C--N 1.381 1.959 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 167.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.537 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.36 -50.2 88.65 Favored Pre-proline 0 CA--C 1.582 2.185 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -162.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.537 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 89.3 Cg_exo -57.23 -29.83 85.15 Favored 'Trans proline' 0 C--N 1.401 3.323 0 C-N-CA 120.836 1.024 . . . . 0.0 114.624 -174.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.611 ' HG3' HD22 ' P' ' 134' ' ' LEU . 1.6 mm-40 -54.29 -71.41 0.08 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-O 124.26 1.981 . . . . 0.0 106.48 161.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.933 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.56 -34.52 74.31 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 110.008 -3.269 . . . . 0.0 109.026 -155.35 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.626 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 7.4 mt-10 -52.3 -43.77 64.67 Favored 'General case' 0 C--N 1.38 1.908 0 CA-C-O 123.356 1.551 . . . . 0.0 108.03 174.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -63.27 -36.3 83.2 Favored 'General case' 0 C--N 1.38 1.911 0 CA-C-N 112.406 -2.179 . . . . 0.0 108.738 -168.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.878 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.1 tp -66.24 -42.8 88.09 Favored 'General case' 0 C--N 1.383 2.063 0 CA-C-O 122.987 1.375 . . . . 0.0 109.167 170.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.52 -34.58 67.16 Favored 'General case' 0 C--N 1.387 2.224 0 CA-C-N 112.742 -2.026 . . . . 0.0 108.183 172.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.607 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -71.38 -42.61 68.2 Favored 'General case' 0 C--N 1.388 2.263 0 CA-C-N 113.427 -1.715 . . . . 0.0 110.395 -178.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 80.9 mt -68.63 -46.54 68.94 Favored 'General case' 0 C--N 1.38 1.917 0 CA-C-O 124.682 2.182 . . . . 0.0 108.226 -163.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.99 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.53 -13.01 8.27 Favored 'Isoleucine or valine' 0 C--N 1.389 2.302 0 CA-C-N 110.926 -2.852 . . . . 0.0 107.967 -168.366 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 82.18 35.5 0.07 Allowed 'General case' 0 C--N 1.381 1.956 0 CA-C-O 125.721 2.677 . . . . 0.0 107.652 152.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.99 HD12 HD11 ' P' ' 146' ' ' ILE . 8.6 mt -95.61 172.72 7.88 Favored 'General case' 0 C--N 1.397 2.635 0 CA-C-N 111.45 -2.614 . . . . 0.0 109.133 168.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.588 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.0 p -90.61 141.47 27.15 Favored Pre-proline 0 CA--C 1.589 2.462 0 CA-C-O 122.797 1.284 . . . . 0.0 108.267 166.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.545 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 0.4 OUTLIER -48.29 -47.0 21.13 Favored 'Trans proline' 0 C--N 1.405 3.502 0 C-N-CA 124.954 3.769 . . . . 0.0 115.424 -167.533 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . 0.401 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -52.86 -31.03 37.13 Favored 'General case' 0 C--N 1.384 2.073 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.07 169.327 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.588 ' N ' ' O ' ' P' ' 149' ' ' THR . 46.8 mt-30 -74.66 -27.94 60.64 Favored 'General case' 0 C--N 1.392 2.42 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.709 HG13 ' CD2' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -64.15 -70.94 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.024 0 CA-C-N 122.116 2.235 . . . . 0.0 109.513 162.76 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.933 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.77 -59.57 0.4 Allowed 'General case' 0 C--N 1.387 2.199 0 CA-C-O 122.728 1.251 . . . . 0.0 110.583 -176.497 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.437 HG21 " H5'" ' A' ' 8' ' ' ' DA' . 13.4 mm -56.2 -43.03 75.19 Favored 'Isoleucine or valine' 0 C--N 1.383 2.029 0 CA-C-N 112.995 -1.911 . . . . 0.0 109.112 -174.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.717 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.6 t90 -67.23 -31.58 72.04 Favored 'General case' 0 C--N 1.383 2.033 0 O-C-N 120.876 -1.14 . . . . 0.0 109.324 174.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.765 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 44.6 m-85 -75.55 -41.98 53.5 Favored 'General case' 0 C--O 1.275 2.406 0 O-C-N 121.053 -1.029 . . . . 0.0 111.888 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.443 ' N ' ' O ' ' P' ' 154' ' ' LYS . 51.4 mt-30 -49.5 -59.67 3.54 Favored 'General case' 0 C--N 1.378 1.826 0 O-C-N 119.296 -2.127 . . . . 0.0 107.005 169.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -55.83 -25.0 39.74 Favored 'General case' 0 C--N 1.389 2.295 0 CA-C-O 117.713 -1.137 . . . . 0.0 109.386 -166.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.535 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.6 OUTLIER -76.5 -46.84 24.97 Favored 'General case' 0 C--O 1.282 2.801 0 CA-C-N 121.213 1.824 . . . . 0.0 111.286 175.359 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.606 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -66.66 -35.35 79.94 Favored 'General case' 0 C--N 1.378 1.841 0 CA-C-N 122.985 2.629 . . . . 0.0 110.543 -161.654 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . 0.639 ' HD1' ' OP2' ' B' ' 23' ' ' ' DA' . 82.0 t80 -68.86 -36.2 77.84 Favored 'General case' 0 C--N 1.38 1.929 0 O-C-N 120.135 -1.603 . . . . 0.0 109.652 171.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -65.05 -40.33 94.59 Favored 'General case' 0 C--N 1.381 1.965 0 O-C-N 121.668 -0.645 . . . . 0.0 109.293 -169.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.606 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.6 OUTLIER -53.71 -60.3 3.5 Favored 'General case' 0 C--N 1.379 1.873 0 CA-C-O 125.199 2.428 . . . . 0.0 106.484 -172.492 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.452 ' HG2' HG23 ' P' ' 164' ' ' THR . 9.9 mmmt -58.91 -46.61 87.48 Favored 'General case' 0 C--N 1.388 2.247 1 CA-C-N 108.208 -4.087 . . . . 0.0 108.285 -163.668 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . 0.514 ' HG3' ' CZ ' ' P' ' 162' ' ' TYR . 2.0 ttt180 -45.2 -49.52 12.15 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-N 112.798 -2.001 . . . . 0.0 111.505 173.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -60.4 -33.41 72.44 Favored 'General case' 0 C--N 1.381 1.95 0 CA-C-N 113.59 -1.641 . . . . 0.0 108.595 -174.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.34 -21.56 39.07 Favored 'General case' 0 C--N 1.387 2.206 0 CA-C-N 111.908 -2.405 . . . . 0.0 109.603 -174.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -54.73 -32.97 60.46 Favored 'General case' 0 C--N 1.383 2.04 0 CA-C-O 123.189 1.471 . . . . 0.0 109.559 167.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.07 -27.99 64.03 Favored 'General case' 0 C--N 1.386 2.179 0 CA-C-N 112.838 -1.983 . . . . 0.0 109.257 -163.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 4.7 mttt -87.13 105.31 17.1 Favored 'General case' 0 C--N 1.379 1.862 0 CA-C-N 113.55 -1.659 . . . . 0.0 107.985 -167.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 46.06 76.3 0.14 Allowed Glycine 0 CA--C 1.563 3.047 0 N-CA-C 108.558 -1.817 . . . . 0.0 108.558 -153.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . 0.251 37.5 m-85 -29.72 144.66 0.01 OUTLIER 'General case' 0 C--N 1.389 2.295 0 CA-C-O 123.966 1.841 . . . . 0.0 109.431 168.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.46 55.3 3.44 Favored 'General case' 0 C--N 1.392 2.415 0 CA-C-N 111.042 -2.799 . . . . 0.0 109.218 176.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -63.93 100.97 0.43 Allowed Glycine 0 C--N 1.38 2.999 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 -166.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . 0.534 ' CG ' ' HD2' ' P' ' 177' ' ' PRO . 1.6 t-80 -137.74 164.69 39.42 Favored Pre-proline 0 CA--C 1.58 2.104 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 -161.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . 0.534 ' HD2' ' CG ' ' P' ' 176' ' ' HIS . 65.9 Cg_exo . . . . . 0 CA--C 1.594 3.51 0 C-N-CA 121.503 1.469 . . . . 0.0 111.568 161.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.792 0 O5'-C5'-C4' 114.37 2.978 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.634 H2'' ' H71' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.366 1 P-O3'-C3' 127.271 6.309 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.634 ' H71' H2'' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.901 0 C2'-C3'-O3' 117.014 2.376 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.637 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.561 0 P-O3'-C3' 123.556 3.213 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.529 ' C2 ' ' C2 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.841 0 N19-C1'-C2' 118.473 2.671 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.549 ' C5 ' ' N6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.035 0 C3'-C2'-C1' 106.804 2.931 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.987 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.67 1 P-O3'-C3' 126.862 5.968 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.987 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.537 3.2 0 P-O3'-C3' 123.76 3.383 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.867 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.554 0 P-O3'-C3' 123.805 3.421 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.607 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.834 0 P-O3'-C3' 123.608 3.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.496 H2'' ' C8 ' ' A' ' 12' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.556 0 O4'-C4'-C3' 108.521 2.921 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . 0.496 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.315 1 P-O3'-C3' 125.049 4.457 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.522 H2'' " C5'" ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.624 0 O4'-C4'-C3' 108.375 2.775 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.522 " C5'" H2'' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.638 0 P-O3'-C3' 122.638 2.448 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.585 " C2'" ' H73' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.543 3.955 1 O4'-C1'-N19 111.58 4.725 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.585 ' H73' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.546 0 P-O3'-C3' 122.199 2.083 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.785 0 O5'-C5'-C4' 115.079 3.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.599 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.666 1 P-O3'-C3' 126.96 6.05 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.599 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.482 0 P-O3'-C3' 123.182 2.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.548 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.464 0 P-O3'-C3' 123.185 2.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.645 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.571 4.311 0 N19-C1'-C2' 118.987 2.992 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.645 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.56 0 P-O3'-C3' 123.231 2.942 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.532 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.562 3.395 0 O4'-C4'-C3' 108.393 2.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.532 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.632 0 O4'-C4'-C3' 108.848 3.248 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.513 " H5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.177 1 P-O3'-C3' 126.345 5.538 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.564 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C3'--C2' 1.559 4.135 0 N19-C1'-C2' 119.18 3.112 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.606 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.706 1 P-O3'-C3' 124.696 4.164 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.606 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.58 0 C4'-C3'-C2' 100.391 -2.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.637 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.554 1 P-O3'-C3' 124.767 4.223 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.375 0 O4'-C4'-C3' 107.915 2.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.541 0 O4'-C4'-C3' 108.195 2.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.857 0 P-O3'-C3' 122.007 1.922 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.518 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 29.6 m -106.37 74.04 1.0 Allowed 'General case' 0 C--N 1.381 1.969 0 CA-C-N 113.652 -1.613 . . . . 0.0 108.694 164.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 170.15 -38.34 0.0 OUTLIER 'General case' 0 C--N 1.389 2.303 0 CA-C-N 113.534 -1.666 . . . . 0.0 107.942 -168.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -104.9 94.28 1.0 Allowed Glycine 0 C--N 1.381 3.055 0 N-CA-C 108.94 -1.664 . . . . 0.0 108.94 -164.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.558 HD23 ' HD2' ' P' ' 106' ' ' PRO . 0.2 OUTLIER -86.52 -175.95 0.68 Allowed Pre-proline 0 CA--C 1.582 2.176 0 CA-C-N 113.662 -1.269 . . . . 0.0 108.788 173.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.558 ' HD2' HD23 ' P' ' 105' ' ' LEU . 96.2 Cg_exo -54.3 91.47 0.04 OUTLIER 'Trans proline' 0 C--N 1.397 3.081 0 C-N-CA 122.763 2.308 . . . . 0.0 110.314 155.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -126.81 -178.54 4.43 Favored 'General case' 0 C--N 1.382 2.018 0 CA-C-O 122.451 1.12 . . . . 0.0 109.176 167.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -95.56 98.76 10.75 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-N 113.675 -1.602 . . . . 0.0 108.136 171.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 1.047 ' HE3' ' CG ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -58.84 100.36 0.07 Allowed 'General case' 0 C--N 1.382 1.989 0 CA-C-N 113.662 -1.608 . . . . 0.0 109.089 -176.655 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 1.047 ' CG ' ' HE3' ' P' ' 109' ' ' LYS . 4.1 mmt85 71.26 98.37 0.07 Allowed 'General case' 0 C--N 1.411 3.247 0 CA-C-N 112.557 -2.111 . . . . 0.0 108.616 156.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.667 ' HD2' " O3'" ' A' ' 8' ' ' ' DA' . 0.7 OUTLIER -79.52 88.72 5.06 Favored 'General case' 0 C--N 1.384 2.097 0 CA-C-N 113.096 -1.866 . . . . 0.0 108.154 171.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 2.8 mtp85 -70.73 177.44 3.57 Favored 'General case' 0 C--N 1.393 2.459 0 CA-C-N 111.675 -2.511 . . . . 0.0 108.779 156.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.941 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.9 OUTLIER -84.93 119.04 24.91 Favored 'General case' 0 C--N 1.386 2.173 0 CA-C-N 113.614 -1.63 . . . . 0.0 106.897 168.846 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.513 ' O ' HG13 ' P' ' 114' ' ' VAL . 13.8 p -110.2 58.36 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.129 0 CA-C-O 124.972 2.32 . . . . 0.0 107.844 -155.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.941 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.56 139.36 39.54 Favored 'General case' 0 C--N 1.391 2.379 0 CA-C-N 110.852 -2.885 . . . . 0.0 109.792 -155.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.59 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 0.9 OUTLIER -92.05 146.5 23.68 Favored 'General case' 0 C--N 1.381 1.942 0 CA-C-N 113.946 -1.479 . . . . 0.0 108.216 -178.123 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -65.95 147.53 53.21 Favored 'General case' 0 C--N 1.382 2.011 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 -172.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.457 ' O ' ' N ' ' P' ' 122' ' ' TYR . 33.4 ttmt -42.65 -35.94 1.26 Allowed 'General case' 0 C--N 1.382 1.99 0 CA-C-N 113.547 -1.66 . . . . 0.0 109.594 -176.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.08 -68.12 0.21 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 124.078 1.894 . . . . 0.0 109.146 173.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.55 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.1 mt-30 -46.45 -50.58 16.62 Favored 'General case' 0 C--N 1.382 1.999 0 C-N-CA 127.166 2.186 . . . . 0.0 109.966 175.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.684 ' HA ' HD12 ' P' ' 124' ' ' LEU . 20.2 m -50.78 -57.26 8.82 Favored 'General case' 0 C--N 1.384 2.068 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 170.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.563 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.18 -46.25 68.87 Favored 'General case' 0 C--N 1.383 2.047 0 CA-C-O 122.329 1.061 . . . . 0.0 109.818 -170.217 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.959 ' CD ' HG22 ' P' ' 146' ' ' ILE . 6.5 mt-10 -66.86 -37.11 83.81 Favored 'General case' 0 C--N 1.379 1.872 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.496 178.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.759 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.2 mt -60.4 -51.24 70.34 Favored 'General case' 0 C--N 1.382 2.009 0 O-C-N 119.89 -1.756 . . . . 0.0 110.401 169.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.443 ' O ' ' N ' ' P' ' 129' ' ' ARG . 16.2 mt-10 -54.63 -52.88 60.89 Favored 'General case' 0 C--N 1.379 1.859 0 CA-C-O 122.434 1.111 . . . . 0.0 109.267 177.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.563 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -38.96 -67.62 0.2 Allowed 'General case' 0 C--N 1.379 1.891 0 CA-C-N 111.823 -2.444 . . . . 0.0 108.717 176.04 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.74 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.3 OUTLIER -62.28 -32.64 73.39 Favored 'General case' 0 C--N 1.393 2.462 0 CA-C-N 112.484 -2.144 . . . . 0.0 108.289 -170.117 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.804 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 12.6 t80 -68.8 -50.48 49.82 Favored 'General case' 0 C--N 1.388 2.247 0 CA-C-O 122.073 0.939 . . . . 0.0 110.77 174.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' P' ' 125' ' ' GLU . 8.6 mmm180 -62.33 -11.81 17.48 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.083 -1.871 . . . . 0.0 108.128 -167.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . 0.484 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 33.6 mt-30 -107.99 -40.46 5.23 Favored 'General case' 0 C--N 1.379 1.886 0 C-N-CA 126.378 1.871 . . . . 0.0 107.772 -172.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.5 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -155.19 102.48 2.3 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 111.943 -2.39 . . . . 0.0 109.501 -153.442 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . 0.644 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -77.15 -15.79 59.39 Favored 'General case' 0 C--N 1.387 2.205 0 CA-C-N 112.323 -2.217 . . . . 0.0 110.335 -165.629 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.775 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 2.6 m-30 -154.84 115.69 3.95 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.999 -1.455 . . . . 0.0 108.544 -158.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.504 HD22 ' HB3' ' P' ' 138' ' ' GLU . 21.1 mt -130.08 134.18 47.19 Favored 'General case' 0 C--N 1.398 2.717 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -157.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.2 154.11 25.62 Favored 'General case' 0 C--N 1.381 1.959 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 171.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.492 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.86 -45.89 99.58 Favored Pre-proline 0 CA--C 1.584 2.251 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -158.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 0.1 OUTLIER -52.55 -41.1 70.34 Favored 'Trans proline' 0 C--N 1.396 3.05 0 C-N-CA 122.631 2.22 . . . . 0.0 117.647 179.337 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.504 ' HB3' HD22 ' P' ' 134' ' ' LEU . 1.6 mm-40 -50.2 -69.45 0.11 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-O 123.509 1.623 . . . . 0.0 107.135 166.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.577 ' HB2' HG11 ' P' ' 153' ' ' VAL . 1.0 OUTLIER -69.12 -35.56 76.55 Favored 'General case' 0 C--N 1.389 2.291 0 CA-C-N 110.072 -3.24 . . . . 0.0 108.494 -158.339 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.63 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.2 mt-10 -53.29 -41.05 65.21 Favored 'General case' 0 C--N 1.38 1.926 0 CA-C-O 123.112 1.434 . . . . 0.0 108.539 176.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -64.67 -35.8 82.2 Favored 'General case' 0 C--N 1.38 1.921 0 CA-C-N 112.81 -1.996 . . . . 0.0 108.804 -169.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.74 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.3 tp -65.64 -42.99 90.84 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-O 123.211 1.482 . . . . 0.0 109.198 168.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.9 -33.89 67.38 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.429 -2.169 . . . . 0.0 108.227 174.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.629 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.7 m -73.28 -42.72 62.12 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 113.699 -1.591 . . . . 0.0 109.752 -178.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 78.7 mt -66.62 -48.02 70.79 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 124.659 2.171 . . . . 0.0 108.318 -165.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.986 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.56 -12.84 8.31 Favored 'Isoleucine or valine' 0 C--N 1.389 2.322 0 CA-C-N 110.821 -2.9 . . . . 0.0 107.933 -167.11 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 82.44 35.03 0.07 Allowed 'General case' 0 C--N 1.381 1.939 0 CA-C-O 125.755 2.693 . . . . 0.0 107.865 152.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.986 HD12 HD11 ' P' ' 146' ' ' ILE . 8.8 mt -96.17 170.81 9.0 Favored 'General case' 0 C--N 1.397 2.659 0 CA-C-N 111.571 -2.559 . . . . 0.0 109.382 169.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.643 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.2 p -92.46 140.15 24.04 Favored Pre-proline 0 CA--C 1.592 2.566 0 CA-C-O 122.738 1.256 . . . . 0.0 108.752 170.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.448 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 21.4 Cg_exo -55.08 -33.48 83.79 Favored 'Trans proline' 1 C--N 1.415 4.036 0 C-N-CA 122.902 2.401 . . . . 0.0 113.815 -160.234 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.21 -38.26 73.46 Favored 'General case' 0 C--N 1.382 2.003 0 C-N-CA 119.084 -1.046 . . . . 0.0 109.442 166.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.643 ' N ' ' O ' ' P' ' 149' ' ' THR . 49.1 mt-30 -69.36 -28.4 66.17 Favored 'General case' 0 C--N 1.387 2.214 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 -174.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.627 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.1 t -64.2 -71.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.186 0 CA-C-N 121.394 1.906 . . . . 0.0 109.259 164.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.627 ' N ' HG12 ' P' ' 153' ' ' VAL . 0.0 OUTLIER -34.69 -58.46 0.5 Allowed 'General case' 0 C--N 1.384 2.093 0 C-N-CA 125.012 1.325 . . . . 0.0 110.54 -176.175 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 28.8 mm -60.65 -38.85 79.69 Favored 'Isoleucine or valine' 0 C--N 1.381 1.969 0 CA-C-N 113.328 -1.76 . . . . 0.0 108.859 -172.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.759 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.1 t90 -67.66 -31.88 72.17 Favored 'General case' 0 C--N 1.384 2.07 0 O-C-N 121.168 -0.957 . . . . 0.0 109.451 172.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.804 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 62.9 m-85 -75.18 -40.14 59.63 Favored 'General case' 0 C--O 1.274 2.358 0 O-C-N 121.231 -0.918 . . . . 0.0 112.115 173.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.431 ' N ' ' O ' ' P' ' 154' ' ' LYS . 77.1 mt-30 -51.72 -61.76 2.05 Favored 'General case' 0 C--N 1.376 1.754 0 O-C-N 119.709 -1.869 . . . . 0.0 106.479 168.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -56.43 -24.19 43.62 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-O 117.446 -1.264 . . . . 0.0 109.448 -167.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.518 ' O ' HG22 ' P' ' 164' ' ' THR . 3.1 t60 -78.33 -39.66 38.91 Favored 'General case' 0 C--O 1.282 2.785 0 CA-C-N 121.606 2.003 . . . . 0.0 111.489 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.775 ' HD3' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -68.51 -31.07 70.06 Favored 'General case' 0 C--O 1.265 1.903 0 CA-C-N 122.668 2.485 . . . . 0.0 111.137 -177.692 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -67.89 -45.9 73.16 Favored 'General case' 0 C--N 1.38 1.904 0 CA-C-N 120.738 1.608 . . . . 0.0 108.495 172.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . 0.403 ' HG3' ' N ' ' P' ' 164' ' ' THR . 0.0 OUTLIER -65.17 -39.52 93.04 Favored 'General case' 0 C--N 1.381 1.973 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -164.25 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.538 HG23 ' HG2' ' P' ' 165' ' ' LYS . 0.5 OUTLIER -52.11 -61.45 2.26 Favored 'General case' 0 C--N 1.378 1.841 0 CA-C-O 124.475 2.083 . . . . 0.0 106.937 -173.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.538 ' HG2' HG23 ' P' ' 164' ' ' THR . 5.1 mmmt -59.53 -51.24 70.69 Favored 'General case' 0 C--N 1.385 2.119 1 CA-C-N 108.256 -4.066 . . . . 0.0 108.483 -160.529 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 13.0 ttt85 -52.41 -40.3 61.96 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 112.459 -2.155 . . . . 0.0 109.22 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.52 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -63.11 -33.81 76.26 Favored 'General case' 0 C--N 1.385 2.125 0 CA-C-N 112.791 -2.004 . . . . 0.0 109.05 -172.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.62 -21.09 38.49 Favored 'General case' 0 C--N 1.388 2.265 0 CA-C-N 112.149 -2.296 . . . . 0.0 109.267 -173.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -57.19 -29.28 63.56 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.701 1.239 . . . . 0.0 110.042 168.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -73.6 -35.34 65.38 Favored 'General case' 0 C--N 1.386 2.18 0 CA-C-N 113.6 -1.636 . . . . 0.0 108.243 -166.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 6.8 mttt -83.88 94.56 8.26 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 113.947 -1.478 . . . . 0.0 109.169 -155.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 116.33 -83.48 0.34 Allowed Glycine 0 C--N 1.383 3.15 0 N-CA-C 108.738 -1.745 . . . . 0.0 108.738 -155.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . 0.423 ' O ' ' HD1' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 155.19 170.8 0.01 OUTLIER 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.399 -1.4 . . . . 0.0 109.786 166.367 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -81.68 51.51 1.71 Allowed 'General case' 0 C--N 1.381 1.941 0 CA-C-N 112.103 -2.317 . . . . 0.0 110.009 174.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -93.53 -38.3 5.33 Favored Glycine 0 C--N 1.384 3.24 0 O-C-N 120.185 -1.572 . . . . 0.0 109.177 -155.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -131.72 116.89 16.14 Favored Pre-proline 0 CA--C 1.581 2.145 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 -169.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo . . . . . 0 CA--C 1.594 3.478 0 C-N-CA 121.432 1.421 . . . . 0.0 111.574 164.117 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.83 0 N19-C1'-C2' 119.027 3.017 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.542 ' N1 ' ' C2 ' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.542 3.88 1 P-O3'-C3' 128.413 7.261 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.496 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.912 0 C2'-C3'-O3' 117.214 2.45 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.544 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.643 0 P-O3'-C3' 123.894 3.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.539 H5'' H2'' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.558 3.952 1 P-O3'-C3' 131.945 10.204 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.509 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.85 1 P-O3'-C3' 127.305 6.338 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 1.005 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.514 0 C3'-C2'-C1' 106.982 3.058 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 1.005 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.474 0 C4'-C3'-C2' 100.216 -2.984 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.725 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.402 0 P-O3'-C3' 123.281 2.985 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.502 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.887 0 P-O3'-C3' 123.363 3.053 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.512 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.474 0 P-O3'-C3' 123.01 2.759 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.604 0 C4'-C3'-C2' 100.456 -2.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.638 " H2'" ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.735 1 P-O3'-C3' 125.191 4.576 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.638 ' H72' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.688 0 O4'-C4'-C3' 108.017 2.417 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.712 ' N9 ' ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.904 1 O4'-C1'-N19 111.301 4.376 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.712 ' H71' ' N9 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.528 0 P-O3'-C3' 122.166 2.055 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.558 0 O5'-C5'-C4' 115.074 3.482 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.465 H2'' ' C8 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.579 0 O4'-C4'-C3' 108.304 2.704 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.465 ' C8 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.338 0 O4'-C4'-C3' 108.122 2.522 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.535 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.393 0 O4'-C4'-C3' 108.108 2.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.535 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.572 4.381 0 N19-C1'-C2' 119.164 3.102 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.518 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.556 3.762 1 P-O3'-C3' 126.531 5.692 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.576 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.533 0 C3'-C2'-C1' 107.312 3.294 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.576 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.613 0 O4'-C4'-C3' 108.698 3.098 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.484 H2'' ' C6 ' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.771 0 O4'-C4'-C3' 108.412 2.812 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.484 ' C6 ' H2'' ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.568 3.978 0 N19-C1'-C2' 118.918 2.949 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.577 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.698 0 P-O3'-C3' 122.868 2.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.577 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.561 3.319 0 P-O3'-C3' 122.629 2.441 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.544 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.6 0 O4'-C4'-C3' 108.371 2.771 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.594 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.406 0 O4'-C4'-C3' 107.928 2.328 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.594 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.605 0 O4'-C4'-C3' 108.364 2.764 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . 0.542 ' C2 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.542 3.866 0 O4'-C1'-N19 109.406 2.008 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.514 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.94 142.0 23.07 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 113.685 -1.598 . . . . 0.0 108.664 -179.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 169.49 37.7 0.0 OUTLIER 'General case' 0 C--N 1.396 2.604 0 CA-C-N 113.342 -1.754 . . . . 0.0 109.5 -171.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . 0.551 ' O ' HD22 ' P' ' 105' ' ' LEU . . . 110.24 -49.3 0.86 Allowed Glycine 0 C--N 1.38 3.028 0 N-CA-C 108.72 -1.752 . . . . 0.0 108.72 162.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.585 HD12 ' HD2' ' P' ' 106' ' ' PRO . 3.4 mm? -134.57 161.56 62.94 Favored Pre-proline 0 CA--C 1.581 2.16 0 CA-C-N 113.746 -1.227 . . . . 0.0 108.69 161.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.585 ' HD2' HD12 ' P' ' 105' ' ' LEU . 0.1 OUTLIER -84.96 44.31 1.43 Allowed 'Trans proline' 0 C--N 1.394 2.939 0 C-N-CA 123.089 2.526 . . . . 0.0 110.484 169.736 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 52.8 m-20 -98.29 169.97 9.2 Favored 'General case' 0 C--N 1.383 2.033 0 CA-C-N 113.903 -1.499 . . . . 0.0 109.137 -173.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . 0.858 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -90.46 131.51 36.17 Favored 'General case' 0 C--N 1.382 2.009 0 CA-C-N 113.645 -1.616 . . . . 0.0 108.104 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.19 144.06 44.93 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 113.798 -1.547 . . . . 0.0 109.145 170.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.858 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.8 OUTLIER -110.22 50.4 0.8 Allowed 'General case' 0 C--N 1.382 1.979 0 CA-C-N 114.072 -1.422 . . . . 0.0 109.754 -155.116 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.62 ' HD3' " O3'" ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -124.08 101.09 7.04 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.667 -1.606 . . . . 0.0 109.094 171.241 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -102.95 152.58 21.15 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 112.085 -2.325 . . . . 0.0 108.237 154.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.984 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.8 OUTLIER -70.17 114.83 8.7 Favored 'General case' 0 C--N 1.387 2.201 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 -171.73 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.462 HG23 ' P ' ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -102.32 63.95 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.17 0 CA-C-O 125.811 2.72 . . . . 0.0 107.914 -157.482 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.984 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.36 109.42 10.06 Favored 'General case' 0 C--N 1.393 2.488 0 CA-C-N 111.166 -2.743 . . . . 0.0 109.232 -159.432 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.547 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.8 m-85 -75.72 143.2 42.2 Favored 'General case' 0 C--N 1.388 2.264 0 CA-C-N 112.603 -2.089 . . . . 0.0 108.05 -168.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . 0.409 ' O ' ' N ' ' P' ' 121' ' ' THR . 1.2 p -65.88 147.64 53.05 Favored 'General case' 0 C--N 1.382 2.006 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -169.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -42.85 -36.56 1.53 Allowed 'General case' 0 C--N 1.381 1.944 0 CA-C-N 113.843 -1.526 . . . . 0.0 109.286 -176.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.89 -65.54 0.55 Allowed 'General case' 0 C--N 1.382 2.014 0 CA-C-O 124.172 1.939 . . . . 0.0 109.261 174.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.566 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.0 mt-30 -50.96 -47.39 61.29 Favored 'General case' 0 C--N 1.381 1.967 0 CA-C-N 112.426 -2.17 . . . . 0.0 110.073 177.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.635 ' HA ' HD12 ' P' ' 124' ' ' LEU . 11.3 m -50.02 -57.83 6.76 Favored 'General case' 0 C--N 1.383 2.03 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 168.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.583 ' CE1' ' HG2' ' P' ' 126' ' ' ARG . 0.9 OUTLIER -52.86 -47.79 67.55 Favored 'General case' 0 C--N 1.383 2.038 0 CA-C-O 122.377 1.084 . . . . 0.0 110.017 -169.097 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.95 ' CD ' HG22 ' P' ' 146' ' ' ILE . 7.1 mt-10 -66.94 -35.86 80.93 Favored 'General case' 0 C--N 1.379 1.862 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.875 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.8 mt -60.43 -52.4 65.37 Favored 'General case' 0 C--N 1.383 2.043 0 O-C-N 120.044 -1.66 . . . . 0.0 110.592 168.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' P' ' 129' ' ' ARG . 15.8 mt-10 -53.77 -53.65 49.35 Favored 'General case' 0 C--N 1.379 1.854 0 CA-C-O 122.248 1.023 . . . . 0.0 108.874 177.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.583 ' HG2' ' CE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -38.05 -67.25 0.21 Allowed 'General case' 0 C--N 1.38 1.926 0 CA-C-N 111.683 -2.508 . . . . 0.0 108.679 176.403 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.725 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -64.14 -29.94 71.04 Favored 'General case' 0 C--N 1.394 2.501 0 CA-C-N 112.287 -2.233 . . . . 0.0 108.23 -169.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.8 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 12.3 t80 -69.44 -50.73 42.91 Favored 'General case' 0 C--N 1.389 2.29 0 O-C-N 121.134 -0.979 . . . . 0.0 110.956 172.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.45 ' N ' ' O ' ' P' ' 125' ' ' GLU . 10.1 mmm180 -62.28 -11.87 17.5 Favored 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.083 -1.872 . . . . 0.0 108.093 -166.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . 0.506 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 34.2 mt-30 -109.19 -39.74 5.16 Favored 'General case' 0 C--N 1.38 1.892 0 C-N-CA 126.355 1.862 . . . . 0.0 108.044 -171.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.505 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -153.15 109.36 3.35 Favored 'General case' 0 C--N 1.389 2.295 0 CA-C-N 112.24 -2.255 . . . . 0.0 109.217 -153.579 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -77.05 -19.77 56.73 Favored 'General case' 0 C--N 1.394 2.519 0 CA-C-N 112.171 -2.286 . . . . 0.0 110.806 -168.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.54 ' HE1' ' HD2' ' P' ' 161' ' ' ARG . 15.4 m-85 -159.82 114.34 2.31 Favored 'General case' 0 C--N 1.38 1.9 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.373 -153.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.614 HD22 ' HG3' ' P' ' 138' ' ' GLU . 27.1 mt -126.66 136.97 53.19 Favored 'General case' 0 C--N 1.399 2.754 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -158.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 155.16 25.93 Favored 'General case' 0 C--N 1.382 1.998 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 166.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.507 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.57 -49.62 91.2 Favored Pre-proline 0 CA--C 1.582 2.209 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.355 -161.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.507 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 81.3 Cg_exo -58.2 -28.69 84.99 Favored 'Trans proline' 0 C--N 1.401 3.297 0 C-N-CA 121.048 1.165 . . . . 0.0 114.894 -174.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.614 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.1 OUTLIER -54.03 -71.06 0.08 Allowed 'General case' 0 C--N 1.38 1.9 0 CA-C-O 124.704 2.192 . . . . 0.0 106.334 160.393 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.832 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.1 -40.14 82.66 Favored 'General case' 0 C--N 1.389 2.303 0 CA-C-N 109.965 -3.289 . . . . 0.0 108.885 -154.927 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.647 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 3.9 mt-10 -53.35 -39.17 63.93 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 123.163 1.459 . . . . 0.0 108.304 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -64.28 -35.46 80.91 Favored 'General case' 0 C--N 1.38 1.918 0 CA-C-N 112.945 -1.934 . . . . 0.0 108.732 -171.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.725 HD13 ' CG ' ' P' ' 127' ' ' ARG . 2.3 tp -65.47 -42.77 91.9 Favored 'General case' 0 C--N 1.383 2.023 0 CA-C-O 123.223 1.487 . . . . 0.0 109.038 168.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -57.04 -34.71 68.5 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-N 112.38 -2.191 . . . . 0.0 108.592 174.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.617 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 0.9 OUTLIER -73.51 -43.22 60.56 Favored 'General case' 0 C--N 1.387 2.225 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.19 -179.443 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . 0.725 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 75.0 mt -66.19 -48.06 71.9 Favored 'General case' 0 C--N 1.379 1.888 0 CA-C-O 124.743 2.211 . . . . 0.0 107.954 -164.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.987 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -94.68 -17.03 7.26 Favored 'Isoleucine or valine' 0 C--N 1.385 2.145 0 CA-C-N 110.544 -3.025 . . . . 0.0 107.84 -172.104 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . 0.725 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.0 OUTLIER 81.19 37.21 0.08 Allowed 'General case' 0 C--N 1.385 2.126 0 CA-C-N 111.494 -2.594 . . . . 0.0 108.112 152.777 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.987 HD12 HD11 ' P' ' 146' ' ' ILE . 6.1 mt -95.24 168.08 10.96 Favored 'General case' 0 C--N 1.39 2.35 0 CA-C-N 112.13 -2.305 . . . . 0.0 109.416 168.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.643 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.0 p -88.12 143.97 33.73 Favored Pre-proline 0 CA--C 1.587 2.392 0 CA-C-O 122.986 1.374 . . . . 0.0 108.273 172.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.402 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 1.3 Cg_endo -59.73 -38.44 80.85 Favored 'Trans proline' 1 C--N 1.415 4.031 0 C-N-CA 122.715 2.277 . . . . 0.0 112.073 -155.568 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . 0.518 HG22 HG12 ' P' ' 155' ' ' ILE . 0.4 OUTLIER -57.81 -29.47 64.93 Favored 'General case' 0 C--N 1.385 2.129 0 CA-C-O 118.081 -0.961 . . . . 0.0 110.343 167.754 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.643 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -73.64 -28.04 61.58 Favored 'General case' 0 C--N 1.388 2.258 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.618 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.3 t -64.38 -72.53 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 122.019 2.19 . . . . 0.0 109.439 164.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.832 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.27 -57.44 0.49 Allowed 'General case' 0 C--N 1.385 2.148 0 C-N-CA 125.188 1.395 . . . . 0.0 111.017 -177.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.518 HG12 HG22 ' P' ' 151' ' ' THR . 0.7 OUTLIER -53.04 -47.81 53.71 Favored 'Isoleucine or valine' 0 C--N 1.386 2.17 0 CA-C-N 112.86 -1.973 . . . . 0.0 108.967 -176.45 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.875 ' HB3' HD22 ' P' ' 124' ' ' LEU . 4.4 t90 -66.19 -31.06 71.67 Favored 'General case' 0 C--N 1.382 1.98 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.8 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 69.0 m-85 -74.82 -39.87 61.4 Favored 'General case' 0 C--O 1.274 2.373 0 O-C-N 121.257 -0.902 . . . . 0.0 112.057 174.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' P' ' 154' ' ' LYS . 24.7 mt-30 -49.71 -63.87 0.98 Allowed 'General case' 0 C--N 1.377 1.762 0 O-C-N 119.558 -1.964 . . . . 0.0 106.953 167.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -57.48 -13.55 3.79 Favored 'General case' 0 C--N 1.388 2.253 0 CA-C-O 118.129 -0.938 . . . . 0.0 111.024 -165.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.559 ' ND1' ' CE2' ' P' ' 128' ' ' PHE . 31.5 t-80 -78.44 -56.45 4.43 Favored 'General case' 0 C--O 1.279 2.655 0 CA-C-N 120.46 1.482 . . . . 0.0 110.92 167.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.548 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -65.63 -37.54 86.86 Favored 'General case' 0 C--O 1.267 2.016 0 O-C-N 118.639 -2.538 . . . . 0.0 110.587 -155.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -69.04 -35.87 77.08 Favored 'General case' 0 C--N 1.38 1.92 0 O-C-N 119.94 -1.725 . . . . 0.0 109.657 175.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -41.59 92.23 Favored 'General case' 0 C--N 1.381 1.938 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -170.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.548 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -52.2 -58.8 5.51 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-O 125.329 2.49 . . . . 0.0 106.57 -171.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.442 ' HG2' HG23 ' P' ' 164' ' ' THR . 9.6 mmmt -58.71 -41.94 87.48 Favored 'General case' 0 C--N 1.385 2.148 0 CA-C-N 108.51 -3.95 . . . . 0.0 109.348 -168.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.6 -47.54 63.55 Favored 'General case' 0 C--N 1.38 1.93 0 CA-C-N 112.754 -2.021 . . . . 0.0 111.109 175.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -45.92 -40.28 9.96 Favored 'General case' 0 C--N 1.382 2.004 0 CA-C-O 123.548 1.642 . . . . 0.0 108.207 177.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -81.2 -23.04 38.42 Favored 'General case' 0 C--N 1.392 2.427 0 CA-C-N 111.445 -2.616 . . . . 0.0 109.949 -166.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -60.7 -33.55 73.04 Favored 'General case' 0 C--N 1.383 2.035 0 CA-C-N 113.498 -1.683 . . . . 0.0 109.466 169.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -61.27 -41.27 96.65 Favored 'General case' 0 C--N 1.384 2.086 0 CA-C-N 114.25 -1.341 . . . . 0.0 108.104 177.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -85.41 85.53 7.43 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-N 113.73 -1.577 . . . . 0.0 109.073 -158.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 131.3 -80.62 0.34 Allowed Glycine 0 C--N 1.382 3.09 0 N-CA-C 108.896 -1.682 . . . . 0.0 108.896 -155.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . 0.485 ' O ' ' HD1' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 158.85 173.33 0.01 OUTLIER 'General case' 0 C--N 1.382 2.019 0 CA-C-O 123.023 1.392 . . . . 0.0 109.856 160.478 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.93 69.42 9.73 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-N 112.239 -2.255 . . . . 0.0 109.404 176.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -61.66 -159.3 0.11 Allowed Glycine 0 C--N 1.379 2.955 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 166.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 16.7 p-80 -103.45 136.26 19.25 Favored Pre-proline 0 CA--C 1.58 2.114 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -177.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo . . . . . 0 CA--C 1.594 3.522 0 C-N-CA 121.542 1.494 . . . . 0.0 111.58 178.002 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.788 0 O5'-C5'-C4' 114.352 2.966 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.641 ' O6 ' ' N4 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.364 0 P-O3'-C3' 122.723 2.519 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.587 ' H71' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.877 1 P-O3'-C3' 125.257 4.631 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.608 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.529 0 P-O3'-C3' 123.38 3.066 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.518 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.914 0 N19-C1'-C2' 118.154 2.471 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.518 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 1 C4'--C3' 1.57 4.169 1 P-O3'-C3' 127.428 6.44 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 1.023 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.57 4.236 0 P-O3'-C3' 124.262 3.802 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 1.023 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.543 3.998 1 P-O3'-C3' 126.51 5.675 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.585 ' C8 ' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.654 0 O4'-C4'-C3' 108.71 3.11 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.559 ' C7 ' ' C8 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.929 0 P-O3'-C3' 123.119 2.849 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.497 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.65 0 C3'-C2'-C1' 106.586 2.776 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . 0.579 H2'' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.402 1 P-O3'-C3' 129.43 8.108 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.579 ' C6 ' H2'' ' A' ' 12' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.644 0 O4'-C4'-C3' 108.335 2.735 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.602 0 O4'-C4'-C3' 108.686 3.086 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.935 ' C4 ' ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.541 3.718 1 O4'-C1'-N19 111.308 4.385 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.935 ' H71' ' C4 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.545 0 O4'-C1'-N19 109.725 2.406 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.674 0 O5'-C5'-C4' 115.074 3.481 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.533 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.64 1 P-O3'-C3' 126.964 6.053 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.533 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.491 1 P-O3'-C3' 129.171 7.892 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.569 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.349 0 O4'-C4'-C3' 107.924 2.324 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.569 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.573 4.477 0 O4'-C1'-N19 105.237 -3.203 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.553 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.557 3.881 0 P-O3'-C3' 123.745 3.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.643 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.661 1 P-O3'-C3' 124.868 4.306 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.643 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.465 0 O4'-C4'-C3' 108.613 3.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.524 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.156 0 C2'-C3'-O3' 117.026 2.38 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.587 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.568 3.989 0 P-O3'-C3' 124.148 3.706 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.605 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.567 1 P-O3'-C3' 126.338 5.532 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.625 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.375 0 P-O3'-C3' 122.546 2.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.625 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.678 1 P-O3'-C3' 125.869 5.141 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.43 0 O4'-C4'-C3' 107.944 2.344 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.641 ' N4 ' ' O6 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.632 0 O4'-C4'-C3' 108.285 2.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.905 0 O4'-C1'-N19 109.351 1.939 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.511 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.2 m -70.57 -45.2 65.87 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 113.703 -1.59 . . . . 0.0 108.682 -173.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 2.1 p30 170.3 -38.33 0.0 OUTLIER 'General case' 0 C--N 1.388 2.28 0 CA-C-N 113.518 -1.674 . . . . 0.0 107.965 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . 0.655 ' O ' HD22 ' P' ' 105' ' ' LEU . . . -121.81 -69.15 0.26 Allowed Glycine 0 C--N 1.382 3.084 0 N-CA-C 108.892 -1.683 . . . . 0.0 108.892 -162.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.655 HD22 ' O ' ' P' ' 104' ' ' GLY . 0.4 OUTLIER -171.66 151.69 2.94 Favored Pre-proline 0 CA--C 1.581 2.158 0 CA-C-N 113.658 -1.271 . . . . 0.0 108.553 -173.582 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -50.23 92.49 0.03 OUTLIER 'Trans proline' 0 C--N 1.396 3.074 0 C-N-CA 122.783 2.322 . . . . 0.0 110.354 155.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -81.39 100.6 9.34 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-O 122.485 1.136 . . . . 0.0 109.138 163.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 15.1 mtpt -128.1 -67.68 0.8 Allowed 'General case' 0 C--N 1.383 2.032 0 CA-C-N 113.707 -1.588 . . . . 0.0 108.142 -177.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.561 ' HE3' ' N ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -67.11 149.68 50.22 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 113.623 -1.626 . . . . 0.0 108.99 -171.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.576 ' HD2' ' C ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER 177.93 130.06 0.06 Allowed 'General case' 0 C--N 1.382 2.015 0 CA-C-O 123.832 1.777 . . . . 0.0 108.558 -155.372 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.826 ' HD3' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -138.81 111.83 7.9 Favored 'General case' 0 C--N 1.384 2.1 0 CA-C-N 112.606 -2.088 . . . . 0.0 107.501 156.673 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . 0.502 ' NH2' HG12 ' P' ' 114' ' ' VAL . 8.0 mtm180 -71.68 -176.12 1.54 Allowed 'General case' 0 C--N 1.385 2.131 0 CA-C-N 113.134 -1.848 . . . . 0.0 108.627 173.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 1.111 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.0 OUTLIER -91.89 95.37 9.79 Favored 'General case' 0 C--N 1.381 1.977 0 N-CA-C 105.911 -1.885 . . . . 0.0 105.911 162.796 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.712 HG22 ' OP2' ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -97.97 56.86 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.391 2.37 0 CA-C-O 125.472 2.558 . . . . 0.0 108.408 -169.245 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 1.111 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.1 OUTLIER -77.66 105.71 9.0 Favored 'General case' 0 C--N 1.388 2.259 0 CA-C-N 110.701 -2.954 . . . . 0.0 109.317 -157.33 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.495 ' CE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 -76.22 141.18 41.83 Favored 'General case' 0 C--N 1.392 2.441 0 CA-C-N 112.081 -2.327 . . . . 0.0 107.793 -162.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . 0.402 ' O ' ' N ' ' P' ' 121' ' ' THR . 1.3 p -65.62 147.56 53.2 Favored 'General case' 0 C--N 1.382 1.98 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -166.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' P' ' 122' ' ' TYR . 36.6 ttmt -42.62 -36.0 1.26 Allowed 'General case' 0 C--N 1.381 1.963 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.489 -176.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.04 -67.78 0.23 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 123.995 1.855 . . . . 0.0 109.207 173.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.569 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.6 mt-30 -47.68 -50.56 24.49 Favored 'General case' 0 C--N 1.382 2.014 0 CA-C-N 112.47 -2.15 . . . . 0.0 110.217 176.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.592 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.1 m -49.44 -58.73 4.61 Favored 'General case' 0 C--N 1.383 2.026 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 169.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.575 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 1.2 t80 -52.97 -47.2 68.33 Favored 'General case' 0 C--N 1.384 2.071 0 CA-C-O 122.435 1.112 . . . . 0.0 109.825 -169.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.977 ' CD ' HG22 ' P' ' 146' ' ' ILE . 3.2 mt-10 -66.81 -36.7 82.99 Favored 'General case' 0 C--O 1.265 1.91 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.063 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.794 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.7 mt -60.56 -52.19 66.21 Favored 'General case' 0 C--N 1.382 1.984 0 O-C-N 119.521 -1.987 . . . . 0.0 109.88 169.033 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.47 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.2 mt-10 -53.77 -51.35 63.71 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-O 122.245 1.021 . . . . 0.0 109.213 178.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.575 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.6 -69.68 0.12 Allowed 'General case' 0 C--N 1.379 1.874 0 CA-C-N 111.767 -2.47 . . . . 0.0 108.69 175.045 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.657 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.4 OUTLIER -58.2 -38.09 76.07 Favored 'General case' 0 C--N 1.391 2.398 0 CA-C-N 112.999 -1.91 . . . . 0.0 108.288 -171.768 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.83 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 20.8 t80 -69.71 -45.5 68.1 Favored 'General case' 0 C--N 1.381 1.958 0 O-C-N 121.559 -0.713 . . . . 0.0 110.817 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' P' ' 125' ' ' GLU . 13.8 mmm180 -62.33 -15.98 51.41 Favored 'General case' 0 C--N 1.38 1.915 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 -170.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . 0.425 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 37.0 mt-30 -104.41 -37.9 7.02 Favored 'General case' 0 C--N 1.38 1.908 0 C-N-CA 126.776 2.031 . . . . 0.0 107.503 -168.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.527 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -155.34 107.75 2.69 Favored 'General case' 0 C--N 1.387 2.232 0 CA-C-N 111.914 -2.403 . . . . 0.0 108.84 -153.86 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.86 -21.12 60.22 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 112.218 -2.265 . . . . 0.0 110.873 -167.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.536 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 33.8 m-85 -159.33 112.84 2.28 Favored 'General case' 0 C--N 1.38 1.901 0 CA-C-N 113.305 -1.77 . . . . 0.0 108.14 -153.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.657 HD11 ' CD ' ' P' ' 127' ' ' ARG . 18.6 mt -124.63 135.83 53.42 Favored 'General case' 0 C--N 1.396 2.611 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 -158.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.12 155.05 26.44 Favored 'General case' 0 C--N 1.381 1.973 0 O-C-N 120.612 -1.305 . . . . 0.0 107.498 167.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.513 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.42 -49.62 91.51 Favored Pre-proline 0 CA--C 1.583 2.22 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 -160.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.513 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 79.7 Cg_exo -58.15 -30.03 89.21 Favored 'Trans proline' 0 C--N 1.402 3.342 0 N-CA-C 114.87 1.065 . . . . 0.0 114.87 -175.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.586 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.3 OUTLIER -54.37 -69.46 0.13 Allowed 'General case' 0 C--N 1.38 1.912 0 CA-C-O 124.54 2.114 . . . . 0.0 106.378 161.164 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.93 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.08 -39.5 82.91 Favored 'General case' 0 C--N 1.392 2.428 0 CA-C-N 109.942 -3.299 . . . . 0.0 108.657 -154.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.633 ' O ' ' N ' ' P' ' 144' ' ' SER . 4.0 mt-10 -53.13 -38.03 62.31 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-O 122.498 1.142 . . . . 0.0 108.568 178.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -64.22 -37.03 86.03 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-N 113.142 -1.845 . . . . 0.0 109.347 -174.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.63 ' O ' HG23 ' P' ' 146' ' ' ILE . 0.4 OUTLIER -57.86 -47.33 83.02 Favored 'General case' 0 C--N 1.385 2.151 0 CA-C-O 123.125 1.44 . . . . 0.0 108.719 164.804 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -62.73 -31.71 72.69 Favored 'General case' 0 C--N 1.387 2.208 0 CA-C-N 112.104 -2.316 . . . . 0.0 109.087 -179.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.633 ' N ' ' O ' ' P' ' 140' ' ' GLU . 5.9 t -74.45 -41.95 59.94 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-N 114.243 -1.344 . . . . 0.0 109.037 -178.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . 0.462 HD13 ' OE1' ' P' ' 123' ' ' GLU . 39.5 mt -63.86 -46.62 84.18 Favored 'General case' 0 C--N 1.381 1.962 0 CA-C-O 124.52 2.105 . . . . 0.0 108.269 -167.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 1.022 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -101.41 -12.67 8.55 Favored 'Isoleucine or valine' 0 C--N 1.388 2.25 0 CA-C-N 110.739 -2.937 . . . . 0.0 108.155 -165.437 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 82.08 34.42 0.08 Allowed 'General case' 0 C--N 1.383 2.047 0 CA-C-O 125.547 2.594 . . . . 0.0 108.147 153.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 1.022 HD12 HD11 ' P' ' 146' ' ' ILE . 7.6 mt -96.49 169.47 9.88 Favored 'General case' 0 C--N 1.397 2.637 0 CA-C-N 111.652 -2.522 . . . . 0.0 109.475 169.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.613 ' O ' ' N ' ' P' ' 152' ' ' GLN . 21.5 p -91.31 145.29 31.17 Favored Pre-proline 0 CA--C 1.588 2.435 0 CA-C-O 122.91 1.338 . . . . 0.0 108.735 171.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.426 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 2.2 Cg_endo -62.07 -37.43 64.1 Favored 'Trans proline' 1 C--N 1.414 4.021 0 C-N-CA 122.682 2.255 . . . . 0.0 113.128 -155.864 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.92 -35.62 61.86 Favored 'General case' 0 C--N 1.384 2.066 0 C-N-CA 119.676 -0.81 . . . . 0.0 109.671 165.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.613 ' N ' ' O ' ' P' ' 149' ' ' THR . 44.3 mt-30 -70.48 -27.42 64.2 Favored 'General case' 0 C--N 1.389 2.296 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 -177.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.612 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.3 t -64.68 -71.84 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.105 0 CA-C-N 121.487 1.949 . . . . 0.0 109.666 163.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.93 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.8 -59.61 0.4 Allowed 'General case' 0 C--N 1.386 2.188 0 CA-C-O 122.668 1.223 . . . . 0.0 110.656 -178.163 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 10.2 mm -56.25 -41.89 71.85 Favored 'Isoleucine or valine' 0 C--N 1.381 1.948 0 CA-C-N 113.114 -1.857 . . . . 0.0 108.984 -174.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.794 ' HB3' HD22 ' P' ' 124' ' ' LEU . 7.4 t90 -68.24 -32.24 72.3 Favored 'General case' 0 C--N 1.382 1.98 0 O-C-N 120.962 -1.086 . . . . 0.0 109.637 173.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.83 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 59.6 m-85 -74.81 -40.48 61.07 Favored 'General case' 0 C--O 1.276 2.484 0 O-C-N 120.932 -1.105 . . . . 0.0 112.074 174.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' P' ' 154' ' ' LYS . 25.3 mt-30 -48.94 -64.19 0.88 Allowed 'General case' 0 C--N 1.377 1.795 0 O-C-N 119.543 -1.973 . . . . 0.0 106.674 167.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -55.94 -23.34 31.37 Favored 'General case' 0 C--N 1.389 2.285 0 CA-C-O 117.579 -1.2 . . . . 0.0 109.706 -163.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.527 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.7 OUTLIER -76.34 -47.64 22.78 Favored 'General case' 0 C--O 1.281 2.758 0 CA-C-N 121.239 1.836 . . . . 0.0 110.949 177.108 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.609 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -66.69 -36.36 82.34 Favored 'General case' 0 C--O 1.266 1.933 0 CA-C-N 122.815 2.552 . . . . 0.0 110.619 -161.925 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . 0.487 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 58.3 t80 -68.88 -35.79 77.31 Favored 'General case' 0 C--N 1.38 1.913 0 O-C-N 120.081 -1.637 . . . . 0.0 109.588 171.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -63.83 -39.27 93.83 Favored 'General case' 0 C--N 1.382 2.004 0 O-C-N 121.608 -0.683 . . . . 0.0 109.432 -169.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.609 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -54.95 -60.98 2.62 Favored 'General case' 0 C--N 1.378 1.836 0 CA-C-O 125.008 2.337 . . . . 0.0 106.416 -173.159 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.458 ' HG2' HG23 ' P' ' 164' ' ' THR . 7.7 mmmt -58.97 -46.56 87.8 Favored 'General case' 0 C--N 1.387 2.215 1 CA-C-N 108.171 -4.104 . . . . 0.0 108.1 -161.026 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 10.9 ttt180 -56.82 -42.52 79.73 Favored 'General case' 0 C--N 1.38 1.92 0 CA-C-N 112.274 -2.239 . . . . 0.0 109.23 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -58.97 -33.19 70.37 Favored 'General case' 0 C--N 1.383 2.047 0 CA-C-O 124.283 1.992 . . . . 0.0 109.167 -177.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -84.58 -22.61 29.98 Favored 'General case' 0 C--N 1.393 2.494 0 CA-C-N 112.062 -2.336 . . . . 0.0 110.064 -173.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -50.39 -32.27 17.08 Favored 'General case' 0 C--N 1.379 1.875 0 CA-C-O 122.932 1.349 . . . . 0.0 109.705 167.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -78.2 -34.23 49.54 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.137 -1.847 . . . . 0.0 107.879 -159.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 16.1 mttt -73.21 87.19 1.44 Allowed 'General case' 0 C--N 1.382 1.978 0 CA-C-N 113.653 -1.612 . . . . 0.0 108.809 -157.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . 0.459 ' C ' ' CG ' ' P' ' 173' ' ' TYR . . . 102.09 -94.47 1.2 Allowed Glycine 0 C--N 1.382 3.088 0 N-CA-C 108.333 -1.907 . . . . 0.0 108.333 -154.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . 0.459 ' CG ' ' C ' ' P' ' 172' ' ' GLY . 0.0 OUTLIER 172.26 141.27 0.03 OUTLIER 'General case' 0 C--N 1.381 1.96 0 CA-C-N 113.107 -1.546 . . . . 0.0 109.116 -177.655 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -167.38 174.37 8.06 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-N 113.314 -1.767 . . . . 0.0 107.343 154.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 109.55 38.49 1.75 Allowed Glycine 0 C--N 1.38 3.025 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 160.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -147.11 131.16 8.48 Favored Pre-proline 0 CA--C 1.58 2.127 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 167.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo . . . . . 0 CA--C 1.593 3.466 0 C-N-CA 121.457 1.438 . . . . 0.0 111.606 -170.838 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.779 0 O5'-C5'-C4' 114.381 2.986 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.543 ' N1 ' ' N3 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.317 1 P-O3'-C3' 127.247 6.289 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.531 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.568 3.965 0 P-O3'-C3' 122.582 2.402 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.531 ' C8 ' H2'' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.626 0 P-O3'-C3' 123.301 3.001 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.518 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.855 0 O4'-C4'-C3' 107.977 2.377 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.534 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.951 0 P-O3'-C3' 123.031 2.776 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.749 " H4'" ' HG2' ' P' ' 113' ' ' ARG . . . . . . . . 0 C4'--C3' 1.566 3.847 0 P-O3'-C3' 123.924 3.52 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.565 ' C6 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.582 0 P-O3'-C3' 123.893 3.494 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.636 ' N1 ' ' N3 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.562 3.361 0 P-O3'-C3' 123.802 3.419 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.606 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.935 0 P-O3'-C3' 123.937 3.531 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.523 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.398 0 P-O3'-C3' 122.816 2.597 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.388 0 O4'-C4'-C3' 108.176 2.576 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.529 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.734 1 P-O3'-C3' 125.739 5.033 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.529 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.706 0 P-O3'-C3' 122.441 2.284 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.76 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.543 4.005 1 O4'-C1'-N19 111.059 4.074 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.76 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.559 1 P-O3'-C3' 124.564 4.054 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . 0.442 " H1'" " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.542 3.866 0 O5'-C5'-C4' 115.023 3.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.442 " H5'" " H1'" ' B' ' 17' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.974 1 P-O3'-C3' 126.507 5.672 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.419 ' C8 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.427 0 O4'-C4'-C3' 108.005 2.405 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.431 " H1'" ' N3 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.3 0 O4'-C4'-C3' 108.203 2.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.513 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.572 4.406 0 N19-C1'-C2' 119.13 3.081 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.513 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.558 3.996 1 P-O3'-C3' 126.598 5.748 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.602 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.562 3.445 1 P-O3'-C3' 125.098 4.499 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.636 ' N3 ' ' N1 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.702 0 O4'-C4'-C3' 108.28 2.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.447 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.225 1 P-O3'-C3' 126.477 5.648 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.545 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.223 0 P-O3'-C3' 124.389 3.907 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.554 H2'' ' C8 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.675 0 P-O3'-C3' 124.104 3.67 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.554 ' C8 ' H2'' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.635 0 C4'-C3'-C2' 100.167 -3.033 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.427 ' O2 ' ' N2 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.568 4.028 0 P-O3'-C3' 123.506 3.172 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.586 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.31 0 O4'-C4'-C3' 107.874 2.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.586 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.587 0 O4'-C4'-C3' 108.285 2.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.927 0 O4'-C1'-N19 109.341 1.926 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.528 3.473 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 12.7 m 81.83 89.28 0.04 OUTLIER 'General case' 0 C--N 1.381 1.973 0 CA-C-N 113.639 -1.619 . . . . 0.0 108.647 164.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 1.2 p30 169.36 -26.08 0.0 OUTLIER 'General case' 0 C--N 1.391 2.371 0 CA-C-N 113.496 -1.684 . . . . 0.0 108.098 176.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -134.53 142.41 13.87 Favored Glycine 0 C--N 1.382 3.085 0 N-CA-C 108.914 -1.675 . . . . 0.0 108.914 171.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.559 HD23 ' HD2' ' P' ' 106' ' ' PRO . 0.2 OUTLIER -105.99 -176.18 0.41 Allowed Pre-proline 0 CA--C 1.582 2.175 0 CA-C-N 113.702 -1.249 . . . . 0.0 108.779 172.871 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.559 ' HD2' HD23 ' P' ' 105' ' ' LEU . 94.9 Cg_exo -54.0 91.52 0.04 OUTLIER 'Trans proline' 0 C--N 1.397 3.092 0 C-N-CA 122.823 2.348 . . . . 0.0 110.297 155.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -127.98 155.41 44.31 Favored 'General case' 0 C--N 1.381 1.967 0 CA-C-O 122.45 1.119 . . . . 0.0 109.202 167.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . 0.601 ' H ' ' HD2' ' P' ' 108' ' ' LYS . 0.0 OUTLIER -109.26 168.11 9.62 Favored 'General case' 0 C--N 1.382 2.013 0 CA-C-N 113.703 -1.59 . . . . 0.0 108.239 159.273 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.465 ' HG3' ' N ' ' P' ' 110' ' ' ARG . 0.1 OUTLIER -80.62 152.83 28.33 Favored 'General case' 0 C--N 1.381 1.935 0 CA-C-N 113.761 -1.563 . . . . 0.0 109.317 -176.065 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.538 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.6 OUTLIER -144.57 89.56 2.01 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 113.646 -1.615 . . . . 0.0 109.208 -155.447 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.473 ' HD3' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -27.68 92.45 0.01 OUTLIER 'General case' 0 C--N 1.381 1.966 0 CA-C-N 113.328 -1.76 . . . . 0.0 110.273 174.907 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 70.5 mtt85 -65.28 172.87 2.84 Favored 'General case' 0 C--N 1.39 2.342 0 CA-C-N 111.855 -2.429 . . . . 0.0 108.839 155.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.882 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.3 OUTLIER -93.28 117.49 30.14 Favored 'General case' 0 C--N 1.382 2.015 0 CA-C-N 113.902 -1.499 . . . . 0.0 107.163 167.645 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -108.32 64.76 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.162 0 CA-C-O 125.817 2.722 . . . . 0.0 107.911 -161.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.882 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.17 110.29 10.54 Favored 'General case' 0 C--N 1.391 2.407 0 CA-C-N 111.206 -2.724 . . . . 0.0 109.123 -158.069 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.668 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 1.1 m-85 -76.05 143.53 41.34 Favored 'General case' 0 C--N 1.389 2.321 0 CA-C-N 112.799 -2.0 . . . . 0.0 107.832 -167.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.41 148.03 52.42 Favored 'General case' 0 C--N 1.382 1.99 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -168.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' P' ' 122' ' ' TYR . 37.2 ttmt -42.15 -36.02 1.08 Allowed 'General case' 0 C--N 1.381 1.966 0 CA-C-N 114.037 -1.438 . . . . 0.0 109.29 -177.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.93 -67.72 0.24 Allowed 'General case' 0 C--N 1.382 1.982 0 CA-C-O 124.217 1.961 . . . . 0.0 109.104 173.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.541 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.7 mt-30 -48.56 -48.05 39.02 Favored 'General case' 0 C--N 1.382 2.008 0 CA-C-N 112.419 -2.173 . . . . 0.0 110.052 177.188 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.666 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.9 m -52.05 -56.37 14.78 Favored 'General case' 0 C--N 1.383 2.027 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 169.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.663 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.2 t80 -53.16 -46.68 68.99 Favored 'General case' 0 C--N 1.383 2.023 0 CA-C-O 122.325 1.059 . . . . 0.0 110.15 -170.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.648 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.1 OUTLIER -66.29 -39.17 89.19 Favored 'General case' 0 C--N 1.38 1.894 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.219 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.805 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -60.16 -49.74 76.42 Favored 'General case' 0 C--N 1.385 2.142 0 O-C-N 120.691 -1.255 . . . . 0.0 109.727 172.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.54 ' O ' ' N ' ' P' ' 129' ' ' ARG . 13.3 mt-10 -55.17 -53.3 57.78 Favored 'General case' 0 C--N 1.38 1.909 0 CA-C-O 122.509 1.147 . . . . 0.0 109.461 176.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.663 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.9 -69.23 0.14 Allowed 'General case' 0 C--N 1.378 1.825 0 CA-C-N 111.897 -2.41 . . . . 0.0 108.665 177.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.848 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.4 OUTLIER -57.49 -37.25 72.62 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 112.686 -2.052 . . . . 0.0 108.342 -173.334 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.827 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 24.7 t80 -70.0 -45.98 66.13 Favored 'General case' 0 C--N 1.38 1.927 0 CA-C-O 121.58 0.705 . . . . 0.0 110.752 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.54 ' N ' ' O ' ' P' ' 125' ' ' GLU . 7.6 mmm180 -62.54 -14.45 42.16 Favored 'General case' 0 C--N 1.381 1.941 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -169.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' P' ' 126' ' ' ARG . 39.4 mt-30 -107.67 -37.84 6.04 Favored 'General case' 0 C--N 1.38 1.91 0 C-N-CA 126.607 1.963 . . . . 0.0 107.687 -167.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.493 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -154.2 105.78 2.73 Favored 'General case' 0 C--N 1.388 2.273 0 CA-C-N 112.018 -2.355 . . . . 0.0 108.83 -153.552 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . 0.745 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 3.2 mtt85 -77.36 -18.31 57.48 Favored 'General case' 0 C--N 1.391 2.377 0 CA-C-N 111.841 -2.436 . . . . 0.0 110.474 -169.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.745 ' HD1' ' O ' ' P' ' 132' ' ' ARG . 4.1 m-30 -154.66 111.25 3.28 Favored 'General case' 0 C--N 1.38 1.921 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.3 -154.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.614 HD22 ' HG3' ' P' ' 138' ' ' GLU . 31.5 mt -126.13 136.66 53.15 Favored 'General case' 0 C--N 1.397 2.65 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -161.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.54 155.31 25.8 Favored 'General case' 0 C--N 1.382 1.989 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 166.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.509 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.59 -49.43 92.09 Favored Pre-proline 0 CA--C 1.583 2.228 0 C-N-CA 120.049 -0.661 . . . . 0.0 109.347 -161.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 82.9 Cg_exo -58.15 -28.64 84.62 Favored 'Trans proline' 0 C--N 1.401 3.31 0 C-N-CA 121.001 1.134 . . . . 0.0 114.969 -175.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.614 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -53.85 -71.06 0.08 Allowed 'General case' 0 C--N 1.38 1.933 0 CA-C-O 124.524 2.107 . . . . 0.0 106.44 160.201 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.91 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.33 -39.66 81.87 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 109.969 -3.287 . . . . 0.0 108.79 -154.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.653 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.5 mt-10 -53.28 -39.3 63.82 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-O 123.177 1.465 . . . . 0.0 108.42 177.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -63.67 -35.29 80.04 Favored 'General case' 0 C--N 1.379 1.885 0 CA-C-N 112.846 -1.979 . . . . 0.0 108.633 -171.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.848 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.4 tp -65.95 -42.7 89.65 Favored 'General case' 0 C--N 1.383 2.056 0 CA-C-O 123.333 1.54 . . . . 0.0 109.186 169.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.76 -34.33 67.47 Favored 'General case' 0 C--N 1.39 2.334 0 CA-C-N 112.287 -2.233 . . . . 0.0 108.378 174.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.578 ' N ' ' O ' ' P' ' 140' ' ' GLU . 2.6 t -73.35 -43.6 60.4 Favored 'General case' 0 C--N 1.387 2.237 0 CA-C-N 114.242 -1.344 . . . . 0.0 110.296 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.99 -47.72 73.59 Favored 'General case' 0 C--N 1.378 1.847 0 CA-C-O 124.895 2.283 . . . . 0.0 107.922 -163.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.985 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.66 -16.83 7.17 Favored 'Isoleucine or valine' 0 C--N 1.385 2.125 0 CA-C-N 110.482 -3.054 . . . . 0.0 107.761 -171.767 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 6.4 mmt180 81.31 37.36 0.08 Allowed 'General case' 0 C--N 1.384 2.095 0 CA-C-N 111.566 -2.561 . . . . 0.0 108.111 152.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.985 HD12 HD11 ' P' ' 146' ' ' ILE . 6.4 mt -95.27 167.99 11.01 Favored 'General case' 0 C--N 1.391 2.391 0 CA-C-N 112.179 -2.282 . . . . 0.0 109.46 168.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.647 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -88.51 144.07 33.15 Favored Pre-proline 0 CA--C 1.588 2.404 0 CA-C-O 122.95 1.357 . . . . 0.0 108.299 173.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.409 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 1.8 Cg_endo -60.28 -38.38 75.93 Favored 'Trans proline' 1 C--N 1.414 4.02 0 C-N-CA 122.736 2.291 . . . . 0.0 112.416 -155.436 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . 0.504 HG22 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -57.05 -29.37 63.35 Favored 'General case' 0 C--N 1.384 2.103 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.203 167.255 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.647 ' N ' ' O ' ' P' ' 149' ' ' THR . 43.9 mt-30 -74.08 -28.36 61.35 Favored 'General case' 0 C--N 1.388 2.28 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.628 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.1 t -64.29 -71.44 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.077 0 CA-C-N 122.074 2.215 . . . . 0.0 109.399 164.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.91 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.36 -59.35 0.45 Allowed 'General case' 0 C--N 1.386 2.154 0 CA-C-O 122.969 1.366 . . . . 0.0 110.853 -177.518 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.504 HG12 HG22 ' P' ' 151' ' ' THR . 0.5 OUTLIER -52.43 -47.19 47.49 Favored 'Isoleucine or valine' 0 C--N 1.389 2.309 0 CA-C-N 112.653 -2.067 . . . . 0.0 108.7 -176.121 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.805 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.2 t90 -66.58 -32.13 73.28 Favored 'General case' 0 C--N 1.382 2.013 0 O-C-N 121.432 -0.792 . . . . 0.0 109.144 177.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.827 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 63.7 m-85 -75.57 -40.04 57.26 Favored 'General case' 0 C--O 1.275 2.419 0 O-C-N 120.962 -1.086 . . . . 0.0 112.275 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -46.91 -66.62 0.38 Allowed 'General case' 0 C--N 1.376 1.737 0 O-C-N 119.44 -2.038 . . . . 0.0 107.171 165.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -56.01 -23.81 35.26 Favored 'General case' 0 C--N 1.391 2.403 0 CA-C-N 113.994 -1.457 . . . . 0.0 109.324 -161.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.557 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.8 OUTLIER -78.87 -40.11 33.38 Favored 'General case' 0 C--O 1.288 3.116 0 CA-C-N 121.249 1.84 . . . . 0.0 111.78 174.377 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.686 ' CD ' ' HE1' ' P' ' 133' ' ' TYR 0.278 40.0 mtm180 -68.49 -25.23 64.87 Favored 'General case' 0 C--O 1.271 2.213 0 CA-C-N 123.588 2.904 . . . . 0.0 110.531 -176.619 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . 0.44 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 5.1 t80 -68.3 -44.57 75.15 Favored 'General case' 0 C--N 1.379 1.866 0 CA-C-N 121.893 2.133 . . . . 0.0 109.055 170.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt -65.68 -39.08 90.93 Favored 'General case' 0 C--N 1.381 1.963 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 -167.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.578 ' O ' ' HB3' ' P' ' 167' ' ' ALA . 0.5 OUTLIER -54.41 -59.59 4.48 Favored 'General case' 0 C--N 1.378 1.82 0 CA-C-O 124.857 2.265 . . . . 0.0 106.64 -172.208 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.474 ' HG2' HG23 ' P' ' 164' ' ' THR . 0.3 OUTLIER -58.77 -42.22 88.42 Favored 'General case' 0 C--N 1.385 2.149 0 CA-C-N 108.558 -3.928 . . . . 0.0 108.573 -164.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -52.64 -48.71 66.23 Favored 'General case' 0 C--N 1.38 1.906 0 CA-C-N 113.313 -1.767 . . . . 0.0 110.252 176.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.578 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -45.12 -41.56 8.03 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.585 -2.098 . . . . 0.0 108.731 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -80.71 -27.06 37.06 Favored 'General case' 0 C--N 1.388 2.266 0 CA-C-N 111.886 -2.415 . . . . 0.0 110.723 -167.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -51.64 -30.23 20.76 Favored 'General case' 0 C--N 1.389 2.306 0 CA-C-N 113.509 -1.678 . . . . 0.0 109.462 169.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . 0.603 ' OE2' ' HE1' ' P' ' 173' ' ' TYR . 5.4 tm-20 -74.21 -34.79 63.81 Favored 'General case' 0 C--N 1.385 2.152 0 CA-C-N 113.376 -1.738 . . . . 0.0 108.142 -163.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -88.6 88.18 7.52 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-N 113.99 -1.459 . . . . 0.0 109.189 -158.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 123.52 -64.86 0.53 Allowed Glycine 0 C--N 1.383 3.139 0 N-CA-C 108.7 -1.76 . . . . 0.0 108.7 -163.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . 0.603 ' HE1' ' OE2' ' P' ' 170' ' ' GLU . 26.7 m-85 108.22 149.75 0.0 OUTLIER 'General case' 0 C--N 1.385 2.124 0 CA-C-N 112.753 -1.724 . . . . 0.0 109.07 169.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.44 72.15 5.18 Favored 'General case' 0 C--N 1.387 2.238 0 CA-C-N 111.796 -2.456 . . . . 0.0 109.331 167.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -48.93 115.6 2.77 Favored Glycine 0 C--N 1.379 2.954 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 170.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -70.69 147.64 94.59 Favored Pre-proline 0 CA--C 1.58 2.128 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 171.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo . . . . . 0 CA--C 1.594 3.524 0 C-N-CA 121.463 1.442 . . . . 0.0 111.59 163.704 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . 0.596 ' C4 ' ' C2 ' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.743 0 O5'-C5'-C4' 114.272 2.908 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.731 " C2'" ' H71' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.299 0 O4'-C4'-C3' 108.171 2.571 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.731 ' H71' " C2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.784 0 P-O3'-C3' 122.528 2.357 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.609 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.393 0 P-O3'-C3' 122.84 2.616 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.534 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.556 3.782 1 P-O3'-C3' 125.651 4.96 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.576 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.004 1 P-O3'-C3' 127.536 6.53 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.688 H5'' HD22 ' P' ' 115' ' ' LEU . . . . . . . . 0 C4'--C3' 1.564 3.633 1 O4'-C1'-N19 111.276 4.345 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.82 H2'' " C5'" ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.541 3.711 0 O5'-C5'-C4' 114.23 2.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.82 " C5'" H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.517 0 O5'-C5'-C4' 113.898 2.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.611 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.809 1 P-O3'-C3' 126.902 6.002 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.541 H2'' ' C8 ' ' A' ' 12' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.445 0 O4'-C4'-C3' 108.17 2.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . 0.541 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.4 0 P-O3'-C3' 122.501 2.334 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.504 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.633 0 O4'-C4'-C3' 108.418 2.818 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.852 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.71 0 C4'-C3'-C2' 100.964 -2.236 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.852 H5'' H2'' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.838 1 O4'-C1'-N19 111.207 4.259 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.556 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.563 0 P-O3'-C3' 122.195 2.079 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.65 0 O5'-C5'-C4' 115.075 3.482 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.55 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.622 0 O4'-C4'-C3' 108.215 2.615 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.55 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.424 0 P-O3'-C3' 124.28 3.817 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.473 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.412 0 O4'-C4'-C3' 108.09 2.49 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.65 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.57 4.232 0 N19-C1'-C2' 119.12 3.075 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.65 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.557 3.886 0 N19-C1'-C2' 118.692 2.808 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.549 ' N3 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.568 3.976 1 P-O3'-C3' 124.81 4.259 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.549 ' C2 ' ' N3 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.699 0 P-O3'-C3' 123.219 2.932 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.462 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.782 0 P-O3'-C3' 124.375 3.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.479 " C2'" ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.557 3.932 0 N19-C1'-C2' 119.2 3.125 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.603 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.725 0 P-O3'-C3' 122.852 2.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.624 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.338 0 P-O3'-C3' 122.612 2.427 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.624 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.623 0 O4'-C4'-C3' 108.284 2.684 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.599 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.319 0 O4'-C4'-C3' 107.906 2.306 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.599 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.69 0 O4'-C4'-C3' 108.566 2.966 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . 0.596 ' C2 ' ' C4 ' ' A' ' 1' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.543 4.022 1 P-O3'-C3' 125.052 4.46 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.475 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.58 128.5 56.06 Favored 'General case' 0 C--N 1.383 2.025 0 CA-C-N 113.669 -1.605 . . . . 0.0 108.632 173.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 170.28 -38.38 0.0 OUTLIER 'General case' 0 C--N 1.388 2.258 0 CA-C-N 113.565 -1.652 . . . . 0.0 107.996 -178.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . 0.586 ' O ' HD23 ' P' ' 105' ' ' LEU . . . -91.03 -35.34 7.16 Favored Glycine 0 C--N 1.381 3.065 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 -163.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.586 HD23 ' O ' ' P' ' 104' ' ' GLY . 0.2 OUTLIER -133.03 162.37 58.05 Favored Pre-proline 0 CA--C 1.582 2.193 0 CA-C-N 113.705 -1.248 . . . . 0.0 108.779 -178.551 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.424 ' HD2' ' HB3' ' P' ' 105' ' ' LEU . 0.2 OUTLIER -95.19 76.41 0.15 Allowed 'Trans proline' 0 C--N 1.394 2.946 0 C-N-CA 123.692 2.928 . . . . 0.0 110.273 -160.304 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 29.7 m-20 -65.38 158.39 26.74 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.745 -1.57 . . . . 0.0 109.174 -171.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.88 85.7 7.05 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.701 -1.591 . . . . 0.0 108.178 -172.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.621 ' HE3' ' H ' ' P' ' 110' ' ' ARG . 0.1 OUTLIER -68.04 168.92 11.02 Favored 'General case' 0 C--N 1.381 1.972 0 CA-C-N 113.668 -1.606 . . . . 0.0 109.054 177.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.621 ' H ' ' HE3' ' P' ' 109' ' ' LYS . 0.3 OUTLIER -124.73 79.06 1.74 Allowed 'General case' 0 C--N 1.382 2.008 0 CA-C-N 113.652 -1.613 . . . . 0.0 108.646 -156.306 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -25.64 89.63 0.0 OUTLIER 'General case' 0 C--N 1.381 1.964 0 C-N-CA 126.456 1.902 . . . . 0.0 110.501 177.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 3.7 mtp-105 -53.79 -173.13 0.0 OUTLIER 'General case' 0 C--N 1.383 2.024 0 CA-C-N 112.684 -2.053 . . . . 0.0 109.447 155.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.866 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.5 OUTLIER -99.53 120.7 40.07 Favored 'General case' 0 C--N 1.382 2.009 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 154.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.529 ' O ' HG13 ' P' ' 114' ' ' VAL . 14.4 p -111.06 59.61 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.1 0 CA-C-O 124.911 2.291 . . . . 0.0 107.769 -156.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.866 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.12 139.63 40.02 Favored 'General case' 0 C--N 1.39 2.349 0 CA-C-N 111.106 -2.77 . . . . 0.0 109.923 -155.072 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.518 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.5 OUTLIER -91.4 147.07 23.3 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-N 114.213 -1.358 . . . . 0.0 108.273 178.529 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.16 149.07 51.0 Favored 'General case' 0 C--N 1.383 2.06 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 -175.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.43 ' O ' ' N ' ' P' ' 122' ' ' TYR . 35.4 ttmt -44.85 -36.35 3.23 Favored 'General case' 0 C--N 1.382 1.981 0 CA-C-N 113.165 -1.834 . . . . 0.0 109.219 -178.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.0 -63.78 1.03 Allowed 'General case' 0 C--N 1.382 2.008 0 CA-C-O 124.266 1.984 . . . . 0.0 109.22 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.56 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.0 mt-30 -52.33 -43.17 64.42 Favored 'General case' 0 C--N 1.382 1.989 0 CA-C-N 112.407 -2.179 . . . . 0.0 109.734 177.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.592 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.9 m -54.39 -55.49 28.09 Favored 'General case' 0 C--N 1.381 1.965 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 169.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.672 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.6 OUTLIER -53.04 -47.57 68.28 Favored 'General case' 0 C--N 1.383 2.045 0 CA-C-O 122.622 1.201 . . . . 0.0 110.003 -169.805 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.715 ' HB2' HD11 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -66.52 -38.38 87.08 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 113.864 -1.516 . . . . 0.0 108.004 179.936 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.795 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.1 mt -61.05 -50.56 72.82 Favored 'General case' 0 C--N 1.385 2.12 0 O-C-N 120.169 -1.582 . . . . 0.0 109.544 171.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.546 ' O ' ' N ' ' P' ' 129' ' ' ARG . 13.4 mt-10 -55.14 -44.65 75.29 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 122.756 1.265 . . . . 0.0 109.4 178.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.672 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -49.23 -66.77 0.34 Allowed 'General case' 0 C--N 1.377 1.795 0 CA-C-N 112.08 -2.327 . . . . 0.0 108.405 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.673 ' HB3' HD11 ' P' ' 134' ' ' LEU . 4.0 mmt85 -58.47 -36.01 73.07 Favored 'General case' 0 C--N 1.381 1.97 0 CA-C-N 113.29 -1.777 . . . . 0.0 109.61 -177.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.688 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 11.5 t80 -67.44 -51.81 47.12 Favored 'General case' 0 C--N 1.385 2.141 0 CA-C-N 119.627 1.103 . . . . 0.0 110.266 174.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' P' ' 125' ' ' GLU . 0.2 OUTLIER -62.79 -14.82 49.71 Favored 'General case' 0 C--N 1.379 1.889 0 CA-C-N 112.815 -1.993 . . . . 0.0 108.203 -164.466 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -104.61 -40.09 6.14 Favored 'General case' 0 C--N 1.378 1.846 0 C-N-CA 126.327 1.851 . . . . 0.0 106.966 -171.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.519 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.5 OUTLIER -155.74 98.73 1.95 Allowed 'General case' 0 C--N 1.385 2.145 0 CA-C-N 111.952 -2.385 . . . . 0.0 110.003 -153.2 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . 0.5 ' HG2' ' CD2' ' P' ' 133' ' ' TYR . 0.1 OUTLIER -76.53 -6.72 53.06 Favored 'General case' 0 C--N 1.394 2.523 0 CA-C-N 112.133 -2.303 . . . . 0.0 110.985 -162.164 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.515 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 6.0 m-85 -162.68 108.51 1.19 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.0 -156.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.673 HD11 ' HB3' ' P' ' 127' ' ' ARG . 15.0 mt -122.44 135.65 54.72 Favored 'General case' 0 C--N 1.4 2.764 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -154.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.23 154.52 25.37 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 169.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.511 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.92 -49.23 94.5 Favored Pre-proline 0 CA--C 1.583 2.249 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.438 -161.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.511 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 81.9 Cg_exo -58.7 -29.61 90.0 Favored 'Trans proline' 0 C--N 1.401 3.341 0 N-CA-C 115.016 1.122 . . . . 0.0 115.016 -173.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.591 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -54.89 -70.48 0.1 Allowed 'General case' 0 C--N 1.382 2.006 0 CA-C-O 124.754 2.216 . . . . 0.0 106.31 161.905 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 1.004 ' NH2' ' HG3' ' P' ' 154' ' ' LYS . 2.0 ptt85 -66.85 -40.63 87.98 Favored 'General case' 0 C--N 1.393 2.476 0 CA-C-N 109.97 -3.287 . . . . 0.0 108.684 -155.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.627 ' O ' ' N ' ' P' ' 144' ' ' SER . 3.5 mt-10 -53.57 -41.01 66.09 Favored 'General case' 0 C--N 1.38 1.931 0 O-C-N 120.68 -1.262 . . . . 0.0 108.486 176.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -63.71 -37.89 89.05 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 112.933 -1.939 . . . . 0.0 109.15 -172.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.715 HD11 ' HB2' ' P' ' 123' ' ' GLU . 0.8 OUTLIER -58.1 -45.78 86.65 Favored 'General case' 0 C--N 1.386 2.172 0 CA-C-O 123.136 1.446 . . . . 0.0 109.056 167.278 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.597 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -62.87 -33.18 74.74 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 112.175 -2.284 . . . . 0.0 109.093 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.627 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.6 OUTLIER -73.66 -39.76 64.2 Favored 'General case' 0 C--N 1.384 2.101 0 CA-C-N 114.071 -1.422 . . . . 0.0 109.471 -177.52 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 40.1 mt -66.87 -47.41 71.97 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-O 124.57 2.128 . . . . 0.0 108.491 -166.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.999 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -98.41 -12.74 8.29 Favored 'Isoleucine or valine' 0 C--N 1.389 2.312 0 CA-C-N 110.87 -2.877 . . . . 0.0 107.954 -166.932 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 82.34 35.43 0.07 Allowed 'General case' 0 C--N 1.381 1.959 0 CA-C-O 125.774 2.702 . . . . 0.0 107.788 153.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.999 HD12 HD11 ' P' ' 146' ' ' ILE . 7.7 mt -96.17 170.28 9.37 Favored 'General case' 0 C--N 1.397 2.642 0 CA-C-N 111.54 -2.573 . . . . 0.0 109.42 168.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.618 ' O ' ' N ' ' P' ' 152' ' ' GLN . 19.2 p -92.93 144.65 28.79 Favored Pre-proline 0 CA--C 1.59 2.484 0 CA-C-O 123.168 1.461 . . . . 0.0 108.977 171.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.483 ' HB2' ' NH1' ' P' ' 139' ' ' ARG . 1.2 Cg_endo -58.76 -38.98 86.13 Favored 'Trans proline' 1 C--N 1.416 4.096 0 C-N-CA 122.616 2.211 . . . . 0.0 113.064 -156.093 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -34.89 62.75 Favored 'General case' 0 C--N 1.383 2.048 0 C-N-CA 119.945 -0.702 . . . . 0.0 109.755 167.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.618 ' N ' ' O ' ' P' ' 149' ' ' THR . 46.1 mt-30 -69.89 -27.92 65.2 Favored 'General case' 0 C--N 1.389 2.295 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 -176.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.602 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.4 t -64.39 -72.37 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.122 0 CA-C-N 121.273 1.852 . . . . 0.0 109.629 164.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 1.004 ' HG3' ' NH2' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.26 -55.3 0.51 Allowed 'General case' 0 C--N 1.383 2.065 0 C-N-CA 124.975 1.31 . . . . 0.0 110.536 -176.402 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 11.3 mm -61.49 -40.57 86.87 Favored 'Isoleucine or valine' 0 C--N 1.383 2.041 0 CA-C-N 113.999 -1.455 . . . . 0.0 109.481 -173.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.795 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.3 t90 -67.37 -31.53 71.83 Favored 'General case' 0 C--N 1.382 1.998 0 O-C-N 121.168 -0.957 . . . . 0.0 109.195 172.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.688 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 30.1 m-85 -75.42 -42.85 52.59 Favored 'General case' 0 C--O 1.274 2.383 0 O-C-N 121.132 -0.98 . . . . 0.0 111.871 175.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -49.27 -60.37 2.87 Favored 'General case' 0 C--N 1.378 1.807 0 O-C-N 119.51 -1.994 . . . . 0.0 107.117 169.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -56.01 -24.99 42.44 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-O 117.677 -1.154 . . . . 0.0 109.494 -166.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.552 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.5 OUTLIER -77.15 -45.45 26.74 Favored 'General case' 0 C--O 1.284 2.88 0 CA-C-N 121.374 1.897 . . . . 0.0 111.479 178.344 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.734 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -67.55 -39.89 84.95 Favored 'General case' 0 C--O 1.267 1.988 0 CA-C-N 122.586 2.448 . . . . 0.0 109.513 -164.007 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . 0.43 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 49.3 t80 -65.12 -35.19 80.35 Favored 'General case' 0 C--N 1.38 1.931 0 O-C-N 120.176 -1.578 . . . . 0.0 108.694 170.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.2 -28.93 69.13 Favored 'General case' 0 C--N 1.381 1.962 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -170.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.734 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -71.65 -56.42 5.87 Favored 'General case' 0 CA--C 1.573 1.844 0 CA-C-O 125.685 2.66 . . . . 0.0 105.844 -166.128 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.407 ' CD ' ' O ' ' P' ' 161' ' ' ARG . 9.5 mtpt -59.13 -45.05 91.94 Favored 'General case' 0 C--N 1.391 2.395 1 CA-C-N 107.772 -4.286 . . . . 0.0 109.157 -169.604 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 -62.1 -36.37 81.52 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-N 112.571 -2.104 . . . . 0.0 109.297 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -47.42 -40.98 19.24 Favored 'General case' 0 C--N 1.385 2.113 0 CA-C-O 123.541 1.639 . . . . 0.0 108.301 176.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -80.97 -24.0 38.37 Favored 'General case' 0 C--N 1.391 2.399 0 CA-C-N 111.609 -2.541 . . . . 0.0 109.96 -166.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -58.7 -28.02 65.39 Favored 'General case' 0 C--N 1.383 2.059 0 CA-C-N 113.591 -1.64 . . . . 0.0 109.494 170.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -73.56 -43.5 59.7 Favored 'General case' 0 C--N 1.386 2.156 0 CA-C-N 113.648 -1.615 . . . . 0.0 108.175 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.36 94.86 8.04 Favored 'General case' 0 C--N 1.38 1.924 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.273 -161.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 127.67 -62.22 0.63 Allowed Glycine 0 C--N 1.382 3.108 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 -164.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 117.61 165.65 0.0 OUTLIER 'General case' 0 C--N 1.381 1.959 0 CA-C-N 113.009 -1.596 . . . . 0.0 109.013 163.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -83.26 69.48 9.96 Favored 'General case' 0 C--N 1.381 1.978 0 CA-C-N 112.195 -2.275 . . . . 0.0 108.821 174.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -126.48 106.4 0.84 Allowed Glycine 0 C--N 1.383 3.185 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 161.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -158.96 124.01 2.26 Favored Pre-proline 0 CA--C 1.58 2.125 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 175.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo . . . . . 0 CA--C 1.594 3.5 0 C-N-CA 121.482 1.454 . . . . 0.0 111.61 173.443 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.844 0 O5'-C5'-C4' 114.357 2.969 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.634 ' O6 ' ' N4 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.369 1 P-O3'-C3' 127.127 6.189 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.519 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.886 0 P-O3'-C3' 123.115 2.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.626 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 P-O3'-C3' 123.565 3.221 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.551 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.905 1 P-O3'-C3' 125.592 4.91 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.551 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.567 3.894 1 P-O3'-C3' 126.348 5.54 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 1.047 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 C3'-C2'-C1' 106.731 2.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 1.047 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.566 0 O5'-C5'-C4' 113.785 2.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.56 ' C5 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.537 0 O5'-C5'-C4' 113.906 2.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.56 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.781 0 P-O3'-C3' 124.017 3.597 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.521 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.561 3.348 0 P-O3'-C3' 122.718 2.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.411 0 P-O3'-C3' 123.742 3.368 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.502 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.583 0 O4'-C4'-C3' 108.4 2.8 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.502 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.595 0 C4'-C3'-C2' 100.817 -2.383 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.828 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.861 1 O4'-C1'-N19 111.327 4.409 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.828 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.544 0 P-O3'-C3' 122.173 2.061 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.764 0 O5'-C5'-C4' 115.069 3.478 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.589 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.658 1 P-O3'-C3' 125.459 4.799 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.589 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.607 0 P-O3'-C3' 122.685 2.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.31 0 O4'-C4'-C3' 108.063 2.463 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.528 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.571 4.336 0 N19-C1'-C2' 119.243 3.152 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.528 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.561 4.319 1 P-O3'-C3' 126.688 5.823 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.628 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.437 1 P-O3'-C3' 127.137 6.197 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.628 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.449 0 O4'-C4'-C3' 108.559 2.959 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.593 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.237 0 C2'-C3'-O3' 117.057 2.392 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.576 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.242 0 P-O3'-C3' 124.08 3.65 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.606 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.645 0 P-O3'-C3' 124.295 3.829 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.61 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.595 0 C4'-C3'-C2' 100.539 -2.661 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.626 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.653 1 P-O3'-C3' 124.578 4.065 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.588 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.361 0 O4'-C4'-C3' 108.161 2.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.634 ' N4 ' ' O6 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.68 0 P-O3'-C3' 123.549 3.208 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.968 0 O4'-C1'-N19 109.321 1.901 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.528 3.463 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 4.6 m -161.54 164.36 29.58 Favored 'General case' 0 C--N 1.382 1.986 0 CA-C-N 113.677 -1.601 . . . . 0.0 108.617 -170.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 170.38 -38.33 0.0 OUTLIER 'General case' 0 C--N 1.389 2.288 0 CA-C-N 113.498 -1.683 . . . . 0.0 107.949 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -176.96 127.58 1.23 Allowed Glycine 0 C--N 1.381 3.067 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 -163.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.506 HD23 ' HD2' ' P' ' 106' ' ' PRO . 0.2 OUTLIER -139.72 170.8 9.06 Favored Pre-proline 0 CA--C 1.582 2.19 0 CA-C-N 113.751 -1.224 . . . . 0.0 108.804 -171.98 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.506 ' HD2' HD23 ' P' ' 105' ' ' LEU . 0.2 OUTLIER -94.73 75.76 0.19 Allowed 'Trans proline' 0 C--N 1.395 2.974 0 C-N-CA 123.871 3.047 . . . . 0.0 110.239 -166.099 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 56.34 -164.17 0.15 Allowed 'General case' 0 C--N 1.382 1.982 0 CA-C-N 113.713 -1.585 . . . . 0.0 109.141 -170.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . 0.642 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -133.08 -68.37 0.59 Allowed 'General case' 0 C--N 1.382 1.986 0 CA-C-N 113.696 -1.593 . . . . 0.0 108.107 176.056 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.701 ' HE3' ' CA ' ' P' ' 109' ' ' LYS . 0.0 OUTLIER -72.9 162.46 29.46 Favored 'General case' 0 C--N 1.382 1.984 0 CA-C-N 113.576 -1.647 . . . . 0.0 109.269 175.627 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.642 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 2.1 mmt-85 -125.08 83.26 2.14 Favored 'General case' 0 C--N 1.383 2.052 0 CA-C-N 113.645 -1.616 . . . . 0.0 108.912 -157.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.513 ' HD3' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -27.68 92.43 0.01 OUTLIER 'General case' 0 C--N 1.381 1.942 0 CA-C-N 113.15 -1.841 . . . . 0.0 109.975 172.949 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 23.7 mtt-85 -61.25 -173.11 0.03 OUTLIER 'General case' 0 C--N 1.388 2.264 0 CA-C-N 112.0 -2.364 . . . . 0.0 108.889 155.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.884 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.5 OUTLIER -93.94 120.38 34.11 Favored 'General case' 0 C--N 1.383 2.058 0 CA-C-N 113.986 -1.461 . . . . 0.0 107.217 156.21 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.443 HG13 ' OP1' ' A' ' 8' ' ' ' DA' . 8.4 p -113.3 61.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.111 0 CA-C-O 124.937 2.303 . . . . 0.0 107.668 -157.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.884 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.06 142.18 39.95 Favored 'General case' 0 C--N 1.388 2.281 0 CA-C-N 111.129 -2.759 . . . . 0.0 110.056 -154.452 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.585 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.7 OUTLIER -93.19 146.21 23.85 Favored 'General case' 0 C--N 1.381 1.967 0 CA-C-N 113.404 -1.725 . . . . 0.0 108.447 178.214 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.84 148.58 50.99 Favored 'General case' 0 C--N 1.384 2.105 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 -174.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.405 ' O ' ' N ' ' P' ' 122' ' ' TYR . 22.9 ttmt -44.9 -36.72 3.47 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-N 113.134 -1.848 . . . . 0.0 109.17 -177.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' P' ' 122' ' ' TYR . . . -53.35 -62.06 1.89 Allowed 'General case' 0 C--N 1.383 2.046 0 CA-C-O 124.242 1.973 . . . . 0.0 109.242 174.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 82.0 mt-30 -54.48 -45.55 73.24 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 112.538 -2.119 . . . . 0.0 109.872 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.58 ' HA ' HD12 ' P' ' 124' ' ' LEU . 10.7 m -49.74 -56.68 9.35 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 168.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.722 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.4 OUTLIER -52.94 -48.27 67.47 Favored 'General case' 0 C--N 1.382 2.01 0 CA-C-O 122.609 1.195 . . . . 0.0 110.052 -168.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.705 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.75 -37.1 83.96 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.113 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.755 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.9 mt -60.52 -51.86 67.66 Favored 'General case' 0 C--N 1.384 2.086 0 O-C-N 120.281 -1.512 . . . . 0.0 109.493 170.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' P' ' 129' ' ' ARG . 10.2 mt-10 -55.35 -48.97 73.44 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-O 122.686 1.231 . . . . 0.0 109.598 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.722 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.92 -67.52 0.25 Allowed 'General case' 0 C--N 1.378 1.814 0 CA-C-N 112.191 -2.277 . . . . 0.0 109.14 174.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.575 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.5 OUTLIER -60.33 -37.87 81.98 Favored 'General case' 0 C--N 1.39 2.37 0 CA-C-N 112.388 -2.187 . . . . 0.0 108.191 -171.345 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.807 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 15.7 t80 -69.94 -47.59 61.74 Favored 'General case' 0 C--N 1.381 1.976 0 O-C-N 121.409 -0.807 . . . . 0.0 110.183 177.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.552 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 4.6 mmm180 -62.35 -20.04 63.98 Favored 'General case' 0 C--N 1.38 1.927 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -168.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -91.58 -42.55 10.16 Favored 'General case' 0 C--N 1.379 1.85 0 CA-C-O 124.126 1.917 . . . . 0.0 106.935 -174.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.438 ' HG2' ' CD2' ' P' ' 134' ' ' LEU . 2.6 tp-100 -152.81 123.87 7.5 Favored 'General case' 0 C--N 1.386 2.169 0 CA-C-N 111.422 -2.626 . . . . 0.0 110.313 -155.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . 0.526 ' HG2' ' CG ' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -79.29 -23.83 43.31 Favored 'General case' 0 C--N 1.386 2.166 0 CA-C-N 112.784 -2.007 . . . . 0.0 110.8 -173.172 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.657 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 1.0 OUTLIER -155.22 112.21 3.28 Favored 'General case' 0 C--N 1.377 1.798 0 CA-C-O 123.472 1.606 . . . . 0.0 108.986 -152.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.613 HD22 ' HG3' ' P' ' 138' ' ' GLU . 27.3 mt -123.22 134.79 54.1 Favored 'General case' 0 C--N 1.405 3.011 0 CA-C-N 112.598 -2.092 . . . . 0.0 108.042 -160.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.08 155.24 26.39 Favored 'General case' 0 C--N 1.382 1.988 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 167.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.537 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.46 -49.42 92.44 Favored Pre-proline 0 CA--C 1.583 2.244 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.233 -160.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.537 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 76.7 Cg_exo -58.63 -29.23 88.6 Favored 'Trans proline' 0 C--N 1.401 3.332 0 C-N-CA 121.057 1.171 . . . . 0.0 115.041 -175.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.613 ' HG3' HD22 ' P' ' 134' ' ' LEU . 2.4 mm-40 -54.02 -70.43 0.1 Allowed 'General case' 0 C--N 1.38 1.896 0 CA-C-O 124.624 2.154 . . . . 0.0 106.456 160.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.875 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.18 -39.15 82.6 Favored 'General case' 0 C--N 1.39 2.368 0 CA-C-N 109.907 -3.315 . . . . 0.0 108.75 -154.592 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.62 ' O ' ' N ' ' P' ' 144' ' ' SER . 5.1 mt-10 -53.36 -39.02 63.83 Favored 'General case' 0 C--N 1.38 1.91 0 CA-C-O 122.61 1.195 . . . . 0.0 108.505 177.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -63.54 -37.13 86.13 Favored 'General case' 0 C--N 1.379 1.879 0 CA-C-N 113.016 -1.902 . . . . 0.0 109.322 -173.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.635 ' CD1' HD13 ' P' ' 146' ' ' ILE . 0.7 OUTLIER -58.7 -46.12 87.98 Favored 'General case' 0 C--N 1.387 2.201 0 CA-C-O 122.974 1.368 . . . . 0.0 108.87 166.287 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.38 -31.71 72.93 Favored 'General case' 0 C--N 1.385 2.139 0 CA-C-N 112.339 -2.21 . . . . 0.0 109.217 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.62 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.9 OUTLIER -74.25 -41.56 61.08 Favored 'General case' 0 C--N 1.384 2.08 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.666 179.552 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . 0.561 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 43.5 mt -65.13 -48.44 73.57 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-O 124.906 2.289 . . . . 0.0 108.039 -165.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.991 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.51 -16.94 7.02 Favored 'Isoleucine or valine' 0 C--N 1.386 2.153 0 CA-C-N 110.316 -3.129 . . . . 0.0 107.739 -170.828 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . 0.599 ' HG3' ' O ' ' P' ' 144' ' ' SER . 0.1 OUTLIER 81.21 37.71 0.08 Allowed 'General case' 0 C--N 1.386 2.188 0 CA-C-N 111.375 -2.648 . . . . 0.0 108.055 153.008 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.991 HD12 HD11 ' P' ' 146' ' ' ILE . 5.7 mt -95.03 168.5 10.74 Favored 'General case' 0 C--N 1.39 2.354 0 CA-C-N 112.224 -2.262 . . . . 0.0 109.294 168.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.65 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.9 p -88.6 143.03 31.44 Favored Pre-proline 0 CA--C 1.588 2.415 0 CA-C-O 122.854 1.311 . . . . 0.0 108.01 173.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -60.19 -37.41 83.47 Favored 'Trans proline' 0 C--N 1.413 3.953 0 C-N-CA 122.652 2.235 . . . . 0.0 112.054 -155.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.35 -29.06 65.67 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.67 167.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.65 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.9 mt-30 -73.52 -28.33 61.83 Favored 'General case' 0 C--N 1.39 2.333 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.613 HG13 ' CD2' ' P' ' 157' ' ' PHE . 1.2 t -64.48 -71.14 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.077 0 CA-C-N 121.901 2.137 . . . . 0.0 109.597 165.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.875 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.95 -57.98 0.45 Allowed 'General case' 0 C--N 1.385 2.139 0 C-N-CA 124.762 1.225 . . . . 0.0 110.531 -176.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.58 HD12 ' OE1' ' P' ' 158' ' ' GLN . 0.2 OUTLIER -58.59 -42.39 84.63 Favored 'Isoleucine or valine' 0 C--N 1.383 2.057 0 CA-C-N 113.389 -1.732 . . . . 0.0 108.994 -172.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.755 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.4 t90 -66.68 -32.23 73.42 Favored 'General case' 0 C--N 1.385 2.11 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.807 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 49.0 m-85 -74.35 -40.56 62.06 Favored 'General case' 0 C--O 1.272 2.261 0 O-C-N 121.072 -1.018 . . . . 0.0 111.998 173.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.58 ' OE1' HD12 ' P' ' 155' ' ' ILE . 73.2 mt-30 -50.97 -59.32 4.27 Favored 'General case' 0 C--N 1.378 1.813 0 O-C-N 119.664 -1.898 . . . . 0.0 106.77 169.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -56.04 -25.01 43.02 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-O 117.539 -1.22 . . . . 0.0 109.923 -166.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.559 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.4 OUTLIER -77.39 -47.58 19.47 Favored 'General case' 0 C--O 1.281 2.736 0 CA-C-N 121.714 2.052 . . . . 0.0 111.327 175.354 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.657 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -67.89 -34.14 76.07 Favored 'General case' 0 C--O 1.266 1.957 0 CA-C-N 122.985 2.63 . . . . 0.0 110.762 -160.694 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . 0.508 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 14.2 t80 -69.0 -35.9 77.21 Favored 'General case' 0 C--N 1.38 1.928 0 O-C-N 119.967 -1.708 . . . . 0.0 109.51 171.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 4.0 mmmt -65.16 -42.87 93.3 Favored 'General case' 0 C--N 1.382 2.0 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -169.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.599 ' O ' ' HB3' ' P' ' 167' ' ' ALA . 0.5 OUTLIER -54.2 -60.59 3.14 Favored 'General case' 0 CA--C 1.573 1.831 0 CA-C-O 124.733 2.206 . . . . 0.0 106.472 -170.633 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.489 ' HG2' HG23 ' P' ' 164' ' ' THR . 8.6 mmmt -59.33 -45.0 92.56 Favored 'General case' 0 C--N 1.386 2.156 1 CA-C-N 108.221 -4.081 . . . . 0.0 108.81 -163.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . 0.465 ' NH1' ' HA ' ' P' ' 167' ' ' ALA . 0.0 OUTLIER -61.29 -37.19 82.29 Favored 'General case' 0 C--N 1.383 2.022 0 CA-C-N 112.289 -2.232 . . . . 0.0 108.596 -175.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -50.81 -41.19 57.08 Favored 'General case' 0 C--N 1.386 2.196 0 CA-C-N 113.581 -1.645 . . . . 0.0 108.862 177.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -81.82 -21.53 37.6 Favored 'General case' 0 C--N 1.388 2.278 0 CA-C-N 111.715 -2.493 . . . . 0.0 110.297 -168.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.94 -31.19 66.6 Favored 'General case' 0 C--N 1.386 2.169 0 CA-C-N 113.931 -1.486 . . . . 0.0 109.533 169.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -68.52 -33.53 74.29 Favored 'General case' 0 C--N 1.387 2.225 0 CA-C-N 112.874 -1.966 . . . . 0.0 108.235 -167.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 49.1 mttp -91.92 88.03 6.45 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-N 113.992 -1.458 . . . . 0.0 109.257 -155.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 132.29 -61.76 0.65 Allowed Glycine 0 C--N 1.383 3.145 0 N-CA-C 108.785 -1.726 . . . . 0.0 108.785 -157.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 20.8 m-30 120.64 166.97 0.0 OUTLIER 'General case' 0 C--N 1.382 1.982 0 CA-C-N 113.092 -1.554 . . . . 0.0 108.883 160.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.03 54.32 2.89 Favored 'General case' 0 C--N 1.387 2.197 0 CA-C-N 112.162 -2.29 . . . . 0.0 109.472 175.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -64.44 100.45 0.42 Allowed Glycine 0 C--N 1.38 2.996 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 -160.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -173.54 138.65 0.77 Allowed Pre-proline 0 CA--C 1.581 2.155 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 -171.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo . . . . . 0 CA--C 1.593 3.443 0 C-N-CA 121.507 1.471 . . . . 0.0 111.631 176.924 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.77 0 O5'-C5'-C4' 114.35 2.965 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.65 ' N1 ' ' N3 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.322 1 P-O3'-C3' 126.845 5.955 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.528 ' H71' H2'' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.858 0 P-O3'-C3' 123.008 2.757 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.615 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.387 0 P-O3'-C3' 123.716 3.347 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.545 ' C2 ' ' C2 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.746 0 P-O3'-C3' 122.981 2.734 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.555 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.998 0 N19-C1'-C2' 119.406 3.254 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.665 H5'' HD22 ' P' ' 115' ' ' LEU . . . . . . . . 0 C4'--C3' 1.562 3.391 0 O4'-C1'-N19 110.631 3.539 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.816 H2'' H5'' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.398 0 C4'-C3'-C2' 100.272 -2.928 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.816 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.561 3.337 0 P-O3'-C3' 122.962 2.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.601 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.822 0 P-O3'-C3' 123.016 2.763 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.504 H2'' ' C8 ' ' A' ' 12' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.456 0 P-O3'-C3' 122.877 2.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . 0.504 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.561 3.308 0 P-O3'-C3' 122.513 2.344 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.5 " H2'" ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.596 0 P-O3'-C3' 122.693 2.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.93 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.61 0 P-O3'-C3' 123.49 3.158 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.93 H5'' H2'' ' A' ' 14' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.544 4.073 0 O4'-C1'-N19 110.985 3.981 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.861 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.6 0 P-O3'-C3' 124.209 3.757 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.782 0 O5'-C5'-C4' 115.056 3.468 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.6 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.565 1 P-O3'-C3' 125.941 5.201 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.6 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.314 0 P-O3'-C3' 124.094 3.662 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.42 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.296 0 O4'-C4'-C3' 108.116 2.516 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.547 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.571 4.341 0 N19-C1'-C2' 119.245 3.153 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.547 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.558 4.016 1 P-O3'-C3' 124.52 4.017 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.546 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.747 0 O4'-C1'-N19 110.053 2.817 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.546 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.721 0 P-O3'-C3' 123.767 3.389 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.518 " H5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.805 0 O4'-C4'-C3' 107.897 2.297 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.534 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.559 4.052 0 N19-C1'-C2' 118.689 2.805 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.606 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.553 3.508 1 P-O3'-C3' 127.373 6.394 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.609 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.553 0 C4'-C3'-C2' 100.354 -2.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.615 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.568 1 P-O3'-C3' 124.52 4.017 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.59 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.401 0 O4'-C4'-C3' 107.984 2.384 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.65 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.586 0 O4'-C4'-C3' 108.367 2.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.886 0 O4'-C1'-N19 109.371 1.964 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.481 0 N-CA-C 107.807 -1.182 . . . . 0.0 107.807 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.42 162.26 13.38 Favored 'General case' 0 C--N 1.382 1.989 0 CA-C-N 113.709 -1.587 . . . . 0.0 108.67 -164.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 170.19 -38.39 0.0 OUTLIER 'General case' 0 C--N 1.388 2.282 0 CA-C-N 113.538 -1.665 . . . . 0.0 108.02 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -129.18 -71.69 0.13 Allowed Glycine 0 C--N 1.382 3.093 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 -167.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.44 ' HB3' ' HD2' ' P' ' 106' ' ' PRO . 1.2 mp -149.13 178.14 1.57 Allowed Pre-proline 0 CA--C 1.583 2.233 0 CA-C-N 113.699 -1.25 . . . . 0.0 108.871 155.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.44 ' HD2' ' HB3' ' P' ' 105' ' ' LEU . 0.8 OUTLIER -50.48 93.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.396 3.032 0 C-N-CA 123.92 3.08 . . . . 0.0 110.552 162.732 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -98.6 139.1 34.82 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-O 122.368 1.08 . . . . 0.0 109.138 155.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . 0.47 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.3 OUTLIER -136.06 35.99 2.81 Favored 'General case' 0 C--N 1.382 1.979 0 CA-C-N 113.781 -1.554 . . . . 0.0 108.221 173.307 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.708 ' HE3' ' H ' ' P' ' 112' ' ' ARG . 0.0 OUTLIER -59.4 153.74 18.45 Favored 'General case' 0 C--N 1.38 1.926 0 CA-C-N 113.75 -1.568 . . . . 0.0 109.567 171.615 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.583 ' HD3' ' O ' ' P' ' 109' ' ' LYS . 2.1 mmt85 -143.32 54.46 1.35 Allowed 'General case' 0 C--N 1.384 2.104 0 CA-C-N 113.605 -1.634 . . . . 0.0 109.519 -170.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.696 ' HD2' " O3'" ' A' ' 8' ' ' ' DA' . 1.6 ttpp 47.99 91.04 0.02 OUTLIER 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.712 -1.586 . . . . 0.0 109.002 -174.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . 0.708 ' H ' ' HE3' ' P' ' 109' ' ' LYS . 2.0 mtp-105 -59.63 -169.61 0.01 OUTLIER 'General case' 0 C--N 1.382 2.012 0 CA-C-N 113.388 -1.733 . . . . 0.0 108.744 155.107 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.875 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.3 OUTLIER -98.38 119.08 36.46 Favored 'General case' 0 C--N 1.382 2.019 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 154.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.465 ' O ' HG13 ' P' ' 114' ' ' VAL . 12.9 p -111.63 59.71 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.13 0 CA-C-O 124.991 2.329 . . . . 0.0 107.651 -156.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.875 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -77.25 139.99 39.98 Favored 'General case' 0 C--N 1.39 2.344 0 CA-C-N 110.962 -2.835 . . . . 0.0 109.832 -155.043 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.618 ' CD1' HD22 ' P' ' 148' ' ' LEU . 0.4 OUTLIER -91.11 148.11 22.6 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.268 178.087 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.45 149.48 50.17 Favored 'General case' 0 C--N 1.383 2.064 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -175.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.417 ' O ' ' N ' ' P' ' 122' ' ' TYR . 31.8 ttmt -44.94 -36.06 3.18 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.538 -1.665 . . . . 0.0 109.252 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -52.88 -62.73 1.46 Allowed 'General case' 0 C--N 1.383 2.033 0 CA-C-O 124.305 2.003 . . . . 0.0 109.128 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.554 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.4 mt-30 -54.85 -43.99 73.57 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-N 112.42 -2.173 . . . . 0.0 109.709 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.554 ' HA ' HD12 ' P' ' 124' ' ' LEU . 9.8 m -51.18 -57.68 8.12 Favored 'General case' 0 C--N 1.385 2.129 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 166.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.717 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.7 OUTLIER -53.04 -48.15 67.86 Favored 'General case' 0 C--N 1.382 2.021 0 CA-C-O 122.487 1.136 . . . . 0.0 110.051 -168.5 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.749 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.5 OUTLIER -66.33 -37.85 86.31 Favored 'General case' 0 C--N 1.378 1.834 0 CA-C-N 114.562 -1.199 . . . . 0.0 107.878 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.792 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.6 mt -60.46 -50.82 72.07 Favored 'General case' 0 C--N 1.384 2.084 0 O-C-N 120.536 -1.352 . . . . 0.0 109.615 171.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' P' ' 129' ' ' ARG . 20.0 mt-10 -54.39 -52.76 60.66 Favored 'General case' 0 C--N 1.381 1.946 0 CA-C-O 122.384 1.088 . . . . 0.0 109.21 177.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.717 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.98 -67.78 0.22 Allowed 'General case' 0 C--N 1.378 1.818 0 CA-C-N 111.872 -2.422 . . . . 0.0 108.754 177.378 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.413 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.3 OUTLIER -59.21 -36.81 76.05 Favored 'General case' 0 C--N 1.397 2.634 0 CA-C-N 112.032 -2.349 . . . . 0.0 108.373 -172.478 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.85 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 12.6 t80 -69.21 -48.85 60.91 Favored 'General case' 0 C--N 1.38 1.932 0 CA-C-N 119.1 0.864 . . . . 0.0 109.679 178.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' P' ' 125' ' ' GLU . 27.3 mtm180 -62.96 -15.96 57.71 Favored 'General case' 0 C--N 1.38 1.931 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -166.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -101.66 -39.86 7.26 Favored 'General case' 0 C--N 1.379 1.862 0 C-N-CA 126.669 1.988 . . . . 0.0 107.374 -170.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.492 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.1 OUTLIER -153.2 104.49 2.8 Favored 'General case' 0 C--N 1.389 2.286 0 CA-C-N 111.723 -2.489 . . . . 0.0 108.64 -153.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . 0.492 ' HB3' ' CD2' ' P' ' 133' ' ' TYR . 3.2 mtt85 -74.48 -15.79 60.87 Favored 'General case' 0 C--N 1.391 2.41 0 CA-C-N 112.197 -2.274 . . . . 0.0 110.721 -166.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.492 ' CD2' ' HB3' ' P' ' 132' ' ' ARG . 66.8 m-85 -160.16 112.14 2.0 Favored 'General case' 0 C--N 1.378 1.835 0 CA-C-N 113.842 -1.526 . . . . 0.0 108.289 -153.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.559 HD22 ' HB3' ' P' ' 138' ' ' GLU . 19.1 mt -129.45 133.33 47.25 Favored 'General case' 0 C--N 1.396 2.595 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.028 -155.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . 0.338 1.3 t -92.6 166.57 12.43 Favored 'General case' 0 C--N 1.394 2.533 0 CA-C-N 122.103 2.229 . . . . 0.0 107.372 174.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.536 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.75 -46.47 98.45 Favored Pre-proline 0 CA--C 1.582 2.188 0 CA-C-N 113.573 -1.648 . . . . 0.0 108.684 -155.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 0.1 OUTLIER -53.64 -46.49 33.34 Favored 'Trans proline' 0 C--N 1.395 2.982 0 N-CA-C 116.73 1.781 . . . . 0.0 116.73 177.413 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.559 ' HB3' HD22 ' P' ' 134' ' ' LEU . 1.6 mm-40 -51.86 -65.68 0.52 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 123.726 1.727 . . . . 0.0 106.813 170.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.946 ' NH2' ' HG3' ' P' ' 154' ' ' LYS . 1.7 ptt180 -69.62 -32.18 70.74 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 109.942 -3.299 . . . . 0.0 108.718 -160.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.628 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 2.4 mt-10 -52.81 -47.02 67.93 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 122.987 1.375 . . . . 0.0 108.131 170.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -64.78 -37.85 89.01 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-N 112.416 -2.175 . . . . 0.0 109.608 -166.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.493 HD13 HD13 ' P' ' 146' ' ' ILE . 1.3 tm? -59.29 -44.5 92.51 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-O 123.169 1.461 . . . . 0.0 108.913 169.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.628 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.89 -34.27 77.58 Favored 'General case' 0 C--N 1.386 2.184 0 CA-C-N 112.037 -2.347 . . . . 0.0 109.095 177.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.581 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -72.5 -37.69 68.33 Favored 'General case' 0 C--N 1.388 2.243 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.451 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 45.7 mt -67.25 -52.48 40.35 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 124.777 2.227 . . . . 0.0 108.337 -167.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.973 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -91.61 -16.6 7.94 Favored 'Isoleucine or valine' 0 C--N 1.386 2.194 0 CA-C-N 110.498 -3.046 . . . . 0.0 107.959 -172.831 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . 0.516 ' HD3' ' O ' ' P' ' 144' ' ' SER . 3.2 mmt-85 81.3 38.54 0.07 Allowed 'General case' 0 C--N 1.385 2.144 0 CA-C-N 111.464 -2.607 . . . . 0.0 107.822 153.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.973 HD12 HD11 ' P' ' 146' ' ' ILE . 5.8 mt -94.19 171.79 8.62 Favored 'General case' 0 C--N 1.39 2.335 0 CA-C-N 112.023 -2.353 . . . . 0.0 109.055 166.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.64 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.4 p -89.99 139.86 27.49 Favored Pre-proline 0 CA--C 1.588 2.432 0 CA-C-O 123.148 1.451 . . . . 0.0 108.061 171.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.43 ' HB3' HH11 ' P' ' 139' ' ' ARG . 0.6 OUTLIER -46.34 -48.6 13.05 Favored 'Trans proline' 0 C--N 1.406 3.566 0 C-N-CA 124.935 3.757 . . . . 0.0 115.286 -165.436 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.41 -29.61 35.88 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 118.347 -0.835 . . . . 0.0 110.06 169.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.64 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -74.85 -27.67 60.36 Favored 'General case' 0 C--N 1.39 2.347 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.802 HG13 ' CD2' ' P' ' 157' ' ' PHE . 1.5 t -64.69 -72.86 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.382 2.007 0 CA-C-N 122.069 2.213 . . . . 0.0 109.883 162.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.946 ' HG3' ' NH2' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.47 -54.93 0.54 Allowed 'General case' 0 C--N 1.386 2.154 0 C-N-CA 124.896 1.278 . . . . 0.0 110.409 -175.504 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 16.5 mm -60.98 -41.7 90.12 Favored 'Isoleucine or valine' 0 C--N 1.387 2.199 0 CA-C-N 114.072 -1.422 . . . . 0.0 109.498 -174.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.792 ' HB3' HD22 ' P' ' 124' ' ' LEU . 7.7 t90 -66.81 -32.08 73.12 Favored 'General case' 0 C--N 1.382 2.0 0 O-C-N 121.228 -0.92 . . . . 0.0 109.076 172.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.85 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 52.2 m-85 -74.9 -42.2 58.24 Favored 'General case' 0 C--O 1.276 2.463 0 O-C-N 121.376 -0.827 . . . . 0.0 111.815 176.073 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.436 ' N ' ' O ' ' P' ' 154' ' ' LYS . 60.5 mt-30 -50.57 -60.25 3.22 Favored 'General case' 0 C--N 1.377 1.778 0 O-C-N 119.571 -1.956 . . . . 0.0 107.28 169.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -56.25 -23.42 36.0 Favored 'General case' 0 C--N 1.391 2.374 0 CA-C-O 117.358 -1.306 . . . . 0.0 109.629 -166.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.564 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 2.2 t60 -75.28 -50.64 15.43 Favored 'General case' 0 C--O 1.281 2.744 0 CA-C-N 121.307 1.867 . . . . 0.0 110.128 175.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.629 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -66.67 -35.84 81.13 Favored 'General case' 0 C--O 1.267 2.018 0 CA-C-N 122.538 2.427 . . . . 0.0 110.732 -158.373 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . 0.438 ' CZ ' ' HG3' ' P' ' 166' ' ' ARG . 9.3 t80 -69.03 -38.37 79.13 Favored 'General case' 0 C--N 1.38 1.92 0 O-C-N 119.973 -1.704 . . . . 0.0 109.252 172.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.41 -38.23 90.31 Favored 'General case' 0 C--N 1.382 1.996 0 O-C-N 121.345 -0.847 . . . . 0.0 109.136 -168.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.629 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.6 OUTLIER -52.81 -60.32 3.41 Favored 'General case' 0 C--N 1.38 1.897 0 CA-C-O 125.47 2.557 . . . . 0.0 106.504 -174.208 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.419 ' HA ' ' HE3' ' P' ' 165' ' ' LYS . 0.3 OUTLIER -58.32 -43.07 88.05 Favored 'General case' 0 C--N 1.388 2.246 1 CA-C-N 108.33 -4.032 . . . . 0.0 108.065 -163.591 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . 0.438 ' HG3' ' CZ ' ' P' ' 162' ' ' TYR . 1.2 ttt180 -54.05 -45.91 71.8 Favored 'General case' 0 C--N 1.379 1.882 0 CA-C-N 113.051 -1.886 . . . . 0.0 110.146 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.67 -34.08 72.39 Favored 'General case' 0 C--N 1.385 2.126 0 CA-C-N 112.727 -2.033 . . . . 0.0 108.662 -175.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.04 -23.35 41.49 Favored 'General case' 0 C--N 1.388 2.263 0 CA-C-N 111.847 -2.433 . . . . 0.0 109.498 -174.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -56.35 -32.44 64.71 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-O 122.796 1.284 . . . . 0.0 109.749 168.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -66.96 -34.96 78.91 Favored 'General case' 0 C--N 1.386 2.179 0 CA-C-N 113.031 -1.895 . . . . 0.0 108.057 -166.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.02 86.81 5.95 Favored 'General case' 0 C--N 1.38 1.93 0 CA-C-N 113.824 -1.535 . . . . 0.0 109.32 -159.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 132.65 -60.45 0.67 Allowed Glycine 0 C--N 1.382 3.088 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 -157.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 102.2 147.62 0.01 OUTLIER 'General case' 0 C--N 1.388 2.272 0 CA-C-N 112.553 -1.824 . . . . 0.0 108.499 173.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -162.76 174.14 12.89 Favored 'General case' 0 C--N 1.393 2.486 0 CA-C-N 112.983 -1.917 . . . . 0.0 107.438 156.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 171.41 174.29 38.99 Favored Glycine 0 C--N 1.379 2.95 0 CA-C-O 122.971 1.317 . . . . 0.0 110.049 166.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 6.3 p-80 -146.82 129.32 7.79 Favored Pre-proline 0 CA--C 1.58 2.125 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 155.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo . . . . . 0 CA--C 1.594 3.49 0 C-N-CA 121.58 1.52 . . . . 0.0 111.62 -161.958 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.831 0 O5'-C5'-C4' 114.346 2.961 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.803 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.562 3.387 0 O4'-C4'-C3' 108.176 2.576 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.803 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.843 0 P-O3'-C3' 122.684 2.487 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.624 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.578 0 C4'-C3'-C2' 100.437 -2.763 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.552 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.568 3.957 1 P-O3'-C3' 125.391 4.742 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.536 ' C6 ' H2'' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.824 1 P-O3'-C3' 124.732 4.193 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.869 H2'' " H5'" ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.56 0 C3'-C2'-C1' 106.788 2.92 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.869 " H5'" H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.542 3.916 0 O5'-C5'-C4' 115.32 3.657 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.834 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.502 1 P-O3'-C3' 128.17 7.058 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.605 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.827 1 P-O3'-C3' 127.927 6.856 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.574 ' C6 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.407 0 O4'-C4'-C3' 108.15 2.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . 0.459 H2'' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.434 0 P-O3'-C3' 122.709 2.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.545 " H2'" ' H71' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.558 0 O4'-C4'-C3' 108.448 2.848 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.69 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.529 0 O4'-C4'-C3' 108.24 2.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.734 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.541 3.728 1 O4'-C1'-N19 111.304 4.379 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.734 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.588 0 P-O3'-C3' 122.248 2.123 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . 0.414 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.661 0 O5'-C5'-C4' 115.06 3.472 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.501 ' C4 ' ' N6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.603 0 C3'-C2'-C1' 106.802 2.93 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.501 ' N6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.473 1 P-O3'-C3' 127.441 6.45 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.556 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.302 1 P-O3'-C3' 124.84 4.284 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.556 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.571 4.321 0 N19-C1'-C2' 119.372 3.233 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.56 H2'' ' C8 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.525 1 P-O3'-C3' 127.534 6.529 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.627 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.472 0 O4'-C4'-C3' 108.247 2.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.627 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.512 0 O4'-C4'-C3' 108.606 3.006 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.456 " C5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.636 0 P-O3'-C3' 123.75 3.375 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.551 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.208 0 N19-C1'-C2' 119.309 3.193 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.604 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.739 0 P-O3'-C3' 123.664 3.304 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.604 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.643 0 C4'-C3'-C2' 100.404 -2.796 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.624 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.615 1 P-O3'-C3' 125.023 4.436 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.512 ' C8 ' H2'' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.301 0 O4'-C4'-C3' 107.966 2.366 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.533 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.609 0 O4'-C4'-C3' 108.385 2.785 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.911 0 O4'-C1'-N19 109.284 1.856 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.505 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.59 -40.5 6.29 Favored 'General case' 0 C--N 1.382 2.006 0 CA-C-N 113.663 -1.608 . . . . 0.0 108.706 -177.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 170.51 -38.41 0.0 OUTLIER 'General case' 0 C--N 1.389 2.3 0 CA-C-N 113.54 -1.664 . . . . 0.0 107.98 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -149.0 -144.87 4.03 Favored Glycine 0 C--N 1.381 3.065 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -160.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.796 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.0 OUTLIER -115.78 170.03 6.21 Favored Pre-proline 0 CA--C 1.581 2.136 0 CA-C-N 113.672 -1.264 . . . . 0.0 108.6 170.619 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.796 ' HD2' HD13 ' P' ' 105' ' ' LEU . 48.3 Cg_exo -46.59 93.09 0.02 OUTLIER 'Trans proline' 0 C--N 1.399 3.195 0 C-N-CA 123.029 2.486 . . . . 0.0 110.361 155.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -112.18 89.66 3.13 Favored 'General case' 0 C--N 1.381 1.97 0 CA-C-O 122.358 1.075 . . . . 0.0 109.101 156.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . 0.495 ' C ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -102.78 -71.74 0.71 Allowed 'General case' 0 C--N 1.382 1.995 0 CA-C-N 113.779 -1.555 . . . . 0.0 108.071 -166.385 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.9 ' HE2' ' N ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -83.48 146.05 28.6 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 113.846 -1.524 . . . . 0.0 109.359 -176.725 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.9 ' N ' ' HE2' ' P' ' 109' ' ' LYS . 0.4 OUTLIER -147.51 71.68 1.21 Allowed 'General case' 0 C--N 1.383 2.06 0 CA-C-N 113.734 -1.576 . . . . 0.0 109.29 -155.423 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.768 ' HD2' " O4'" ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -26.71 89.54 0.0 OUTLIER 'General case' 0 C--N 1.38 1.934 0 C-N-CA 126.348 1.859 . . . . 0.0 110.448 -170.619 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . 0.555 ' HD3' ' OP1' ' B' ' 29' ' ' ' DC' . 71.1 mtt85 -76.08 178.04 6.65 Favored 'General case' 0 C--N 1.388 2.245 0 CA-C-N 112.282 -2.235 . . . . 0.0 109.001 155.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.926 ' CD ' HD21 ' P' ' 115' ' ' LEU . 1.3 ttm180 -89.08 119.09 29.28 Favored 'General case' 0 C--N 1.383 2.062 0 CA-C-N 113.415 -1.721 . . . . 0.0 107.152 164.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.23 67.16 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.159 0 CA-C-O 125.411 2.529 . . . . 0.0 108.058 -162.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.926 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.46 107.74 8.94 Favored 'General case' 0 C--N 1.391 2.376 0 CA-C-N 111.62 -2.536 . . . . 0.0 109.374 -157.892 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.546 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.6 m-85 -76.42 142.47 41.05 Favored 'General case' 0 C--N 1.389 2.285 0 CA-C-N 112.5 -2.136 . . . . 0.0 108.112 -170.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.19 147.82 52.75 Favored 'General case' 0 C--N 1.381 1.976 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -168.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.424 ' O ' ' N ' ' P' ' 122' ' ' TYR . 37.5 ttmt -42.82 -36.22 1.41 Allowed 'General case' 0 C--N 1.381 1.963 0 CA-C-N 113.716 -1.584 . . . . 0.0 109.381 -177.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.77 -67.39 0.26 Allowed 'General case' 0 C--N 1.383 2.025 0 CA-C-O 123.981 1.848 . . . . 0.0 109.088 173.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.1 mt-30 -48.32 -48.8 35.84 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 112.435 -2.166 . . . . 0.0 110.038 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.649 ' HA ' HD12 ' P' ' 124' ' ' LEU . 9.1 m -50.39 -58.38 5.84 Favored 'General case' 0 C--N 1.384 2.071 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.538 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 0.6 OUTLIER -52.94 -46.99 68.39 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.985 -170.246 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.688 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -67.06 -35.94 80.94 Favored 'General case' 0 C--O 1.265 1.898 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.137 177.416 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.75 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.7 mt -59.98 -53.97 51.51 Favored 'General case' 0 C--N 1.381 1.956 0 O-C-N 119.593 -1.942 . . . . 0.0 109.619 168.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.576 ' O ' ' N ' ' P' ' 129' ' ' ARG . 11.6 mt-10 -55.36 -42.37 73.81 Favored 'General case' 0 C--N 1.381 1.962 0 CA-C-O 122.564 1.173 . . . . 0.0 109.679 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.538 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -47.41 -71.6 0.07 Allowed 'General case' 0 C--N 1.38 1.912 0 CA-C-N 111.235 -2.712 . . . . 0.0 108.132 177.085 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.681 ' HD2' HD21 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -60.82 -33.3 72.81 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-N 113.933 -1.485 . . . . 0.0 108.405 -172.397 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.842 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 30.6 t80 -69.89 -48.9 56.9 Favored 'General case' 0 C--N 1.38 1.929 0 CA-C-N 119.623 1.102 . . . . 0.0 109.998 176.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.576 ' N ' ' O ' ' P' ' 125' ' ' GLU . 71.3 mtt180 -62.19 -19.08 62.75 Favored 'General case' 0 C--N 1.38 1.93 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -167.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -99.92 -40.02 7.88 Favored 'General case' 0 C--N 1.379 1.85 0 C-N-CA 126.279 1.832 . . . . 0.0 107.097 -169.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.482 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.8 OUTLIER -154.58 102.86 2.43 Favored 'General case' 0 C--N 1.384 2.102 0 CA-C-N 111.953 -2.385 . . . . 0.0 109.329 -152.61 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . 0.86 ' NH2' HG21 ' P' ' 164' ' ' THR . 0.6 OUTLIER -74.45 -13.89 60.76 Favored 'General case' 0 C--N 1.394 2.533 0 CA-C-N 112.244 -2.253 . . . . 0.0 111.212 -161.354 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.453 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 12.8 m-85 -159.23 111.09 2.12 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-N 113.36 -1.745 . . . . 0.0 108.089 -154.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.681 HD21 ' HD2' ' P' ' 127' ' ' ARG . 29.2 mt -123.4 132.36 53.93 Favored 'General case' 0 C--N 1.398 2.703 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -155.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.0 155.46 23.94 Favored 'General case' 0 C--N 1.38 1.934 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 171.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.533 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.17 -49.32 93.6 Favored Pre-proline 0 CA--C 1.584 2.276 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -160.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.533 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 75.5 Cg_exo -59.84 -28.8 88.02 Favored 'Trans proline' 0 C--N 1.401 3.312 0 N-CA-C 115.402 1.27 . . . . 0.0 115.402 -176.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.45 ' HB3' HD22 ' P' ' 134' ' ' LEU . 2.9 mm-40 -53.33 -72.4 0.06 Allowed 'General case' 0 C--N 1.379 1.872 0 CA-C-O 124.822 2.249 . . . . 0.0 106.795 158.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.906 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -66.45 -39.44 88.88 Favored 'General case' 0 C--N 1.392 2.45 0 CA-C-N 110.267 -3.152 . . . . 0.0 108.407 -154.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.635 ' O ' ' N ' ' P' ' 144' ' ' SER . 1.7 mt-10 -53.81 -43.2 69.15 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.576 1.179 . . . . 0.0 108.319 177.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -63.55 -36.81 85.03 Favored 'General case' 0 C--N 1.381 1.936 0 CA-C-N 112.693 -2.048 . . . . 0.0 109.277 -174.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.613 ' O ' HG23 ' P' ' 146' ' ' ILE . 0.8 OUTLIER -60.02 -45.65 92.07 Favored 'General case' 0 C--N 1.386 2.172 0 CA-C-O 122.79 1.281 . . . . 0.0 108.857 165.675 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.75 -30.53 71.62 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 112.606 -2.088 . . . . 0.0 109.368 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.635 ' N ' ' O ' ' P' ' 140' ' ' GLU . 8.0 t -74.81 -43.46 54.56 Favored 'General case' 0 C--N 1.383 2.04 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.327 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . 0.533 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 39.4 mt -62.51 -44.06 97.28 Favored 'General case' 0 C--N 1.38 1.914 0 CA-C-O 124.727 2.203 . . . . 0.0 107.794 -164.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.976 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -102.87 -17.24 7.13 Favored 'Isoleucine or valine' 0 C--N 1.385 2.135 0 CA-C-N 110.283 -3.144 . . . . 0.0 107.792 -168.766 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.0 OUTLIER 81.22 37.55 0.08 Allowed 'General case' 0 C--N 1.388 2.249 0 CA-C-N 111.249 -2.705 . . . . 0.0 108.292 153.496 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.976 HD12 HD11 ' P' ' 146' ' ' ILE . 5.7 mt -95.25 168.04 10.98 Favored 'General case' 0 C--N 1.39 2.332 0 CA-C-N 112.353 -2.203 . . . . 0.0 109.416 167.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.638 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -88.77 143.38 31.64 Favored Pre-proline 0 CA--C 1.587 2.378 0 CA-C-O 122.948 1.356 . . . . 0.0 108.25 173.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -60.74 -37.32 79.56 Favored 'Trans proline' 1 C--N 1.415 4.062 0 C-N-CA 122.621 2.214 . . . . 0.0 112.885 -155.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.79 -34.9 63.26 Favored 'General case' 0 C--N 1.384 2.092 0 C-N-CA 119.593 -0.843 . . . . 0.0 109.774 165.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.638 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.7 mt-30 -70.91 -27.67 63.96 Favored 'General case' 0 C--N 1.388 2.272 0 N-CA-C 105.639 -1.986 . . . . 0.0 105.639 -177.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.79 HG11 ' HB2' ' P' ' 139' ' ' ARG . 1.3 t -64.55 -71.99 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.096 0 CA-C-N 121.537 1.971 . . . . 0.0 109.567 164.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.906 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.75 -58.93 0.42 Allowed 'General case' 0 C--N 1.385 2.144 0 C-N-CA 124.807 1.243 . . . . 0.0 110.784 -177.8 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.444 HD13 ' OE1' ' P' ' 158' ' ' GLN . 22.7 mm -58.81 -40.86 81.03 Favored 'Isoleucine or valine' 0 C--N 1.381 1.969 0 CA-C-N 113.089 -1.869 . . . . 0.0 108.847 -172.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.75 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.9 t90 -67.71 -31.89 72.14 Favored 'General case' 0 C--N 1.382 2.011 0 O-C-N 121.419 -0.801 . . . . 0.0 109.311 173.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.842 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 72.5 m-85 -75.18 -38.76 60.69 Favored 'General case' 0 C--O 1.274 2.345 0 O-C-N 121.274 -0.891 . . . . 0.0 112.302 173.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.482 ' N ' ' O ' ' P' ' 154' ' ' LYS . 81.1 mt-30 -53.22 -62.93 1.33 Allowed 'General case' 0 C--N 1.376 1.754 0 O-C-N 119.879 -1.763 . . . . 0.0 106.465 167.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -56.53 -24.49 47.11 Favored 'General case' 0 C--N 1.39 2.331 0 CA-C-O 117.672 -1.156 . . . . 0.0 109.648 -166.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.543 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 5.4 t60 -79.26 -38.03 36.48 Favored 'General case' 0 C--O 1.282 2.787 0 CA-C-N 121.491 1.95 . . . . 0.0 111.895 178.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.502 ' NH2' ' HB3' ' P' ' 157' ' ' PHE . 0.0 OUTLIER -68.08 -32.51 72.88 Favored 'General case' 0 C--O 1.266 1.96 0 CA-C-N 122.997 2.635 . . . . 0.0 111.225 179.748 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . 0.751 ' HE2' ' CZ ' ' P' ' 166' ' ' ARG . 53.9 t80 -67.46 -43.66 80.52 Favored 'General case' 0 C--N 1.381 1.953 0 CA-C-N 120.825 1.648 . . . . 0.0 108.792 172.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -65.72 -39.96 91.71 Favored 'General case' 0 C--N 1.382 1.984 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -167.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.86 HG21 ' NH2' ' P' ' 132' ' ' ARG . 0.5 OUTLIER -51.69 -59.65 4.05 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-O 125.022 2.344 . . . . 0.0 106.958 -172.892 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.519 ' HG2' HG23 ' P' ' 164' ' ' THR . 6.4 mmmt -59.35 -46.89 87.37 Favored 'General case' 0 C--N 1.387 2.203 1 CA-C-N 108.128 -4.124 . . . . 0.0 108.21 -161.568 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . 0.751 ' CZ ' ' HE2' ' P' ' 162' ' ' TYR . 1.6 mtt180 -46.05 -51.96 12.79 Favored 'General case' 0 C--N 1.381 1.937 0 CA-C-N 112.852 -1.976 . . . . 0.0 111.072 173.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -55.85 -33.26 64.35 Favored 'General case' 0 C--N 1.383 2.049 0 CA-C-N 112.568 -2.105 . . . . 0.0 108.9 -173.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.63 -27.91 28.82 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 111.929 -2.396 . . . . 0.0 110.238 -173.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -52.63 -31.92 39.26 Favored 'General case' 0 C--N 1.378 1.815 0 CA-C-O 123.187 1.47 . . . . 0.0 110.43 170.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -68.97 -32.96 72.92 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 112.822 -1.99 . . . . 0.0 108.343 -166.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 48.4 mttt -83.61 80.81 9.0 Favored 'General case' 0 C--N 1.382 1.999 0 CA-C-N 113.5 -1.682 . . . . 0.0 109.095 -155.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 123.66 -49.26 0.91 Allowed Glycine 0 C--N 1.382 3.11 0 N-CA-C 108.914 -1.674 . . . . 0.0 108.914 -169.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 96.32 150.65 0.02 OUTLIER 'General case' 0 C--N 1.393 2.491 0 CA-C-N 112.373 -1.914 . . . . 0.0 108.396 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -164.39 158.43 18.54 Favored 'General case' 0 C--N 1.388 2.262 0 CA-C-N 113.448 -1.705 . . . . 0.0 107.424 156.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -150.22 25.58 1.12 Allowed Glycine 0 C--N 1.379 2.968 0 O-C-N 120.562 -1.336 . . . . 0.0 110.156 -162.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 46.6 t60 179.83 140.89 0.31 Allowed Pre-proline 0 CA--C 1.58 2.115 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo . . . . . 0 CA--C 1.594 3.482 0 C-N-CA 121.55 1.5 . . . . 0.0 111.63 169.571 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.824 0 O5'-C5'-C4' 114.344 2.96 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.794 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.561 3.312 0 O4'-C4'-C3' 108.186 2.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.794 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.863 0 P-O3'-C3' 122.76 2.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.613 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.483 0 P-O3'-C3' 123.439 3.116 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.539 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.742 0 O4'-C4'-C3' 108.046 2.446 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.565 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.57 4.231 0 N19-C1'-C2' 119.473 3.296 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.813 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.872 2 P-O3'-C3' 125.575 4.895 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.813 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.423 0 O5'-C5'-C4' 114.913 3.367 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.75 " H5'" ' HD3' ' P' ' 111' ' ' LYS . . . . . . . . 0 C5'--C4' 1.539 3.523 0 O4'-C4'-C3' 108.542 2.942 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.436 ' C2 ' ' C2 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.898 1 P-O3'-C3' 125.045 4.454 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.519 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.552 1 P-O3'-C3' 127.893 6.827 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.301 0 P-O3'-C3' 123.174 2.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.505 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.523 0 O4'-C4'-C3' 108.194 2.594 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.505 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.591 0 P-O3'-C3' 124.272 3.81 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.849 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.88 1 O4'-C1'-N19 111.169 4.212 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.849 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.565 0 P-O3'-C3' 122.208 2.09 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.759 0 O5'-C5'-C4' 115.042 3.459 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.491 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.655 1 P-O3'-C3' 125.072 4.477 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.491 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.535 0 O4'-C4'-C3' 108.109 2.509 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.562 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.334 0 O4'-C4'-C3' 108.101 2.501 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.562 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.572 4.356 0 N19-C1'-C2' 119.204 3.127 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.507 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.498 1 P-O3'-C3' 126.997 6.081 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.612 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.411 0 O4'-C4'-C3' 108.529 2.929 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.612 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.499 0 O4'-C4'-C3' 108.564 2.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.578 " H2'" ' H71' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.705 0 O4'-C4'-C3' 108.294 2.694 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.578 ' H71' " H2'" ' B' ' 25' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.558 4.018 0 N19-C1'-C2' 118.868 2.918 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.618 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.6 0 C4'-C3'-C2' 100.685 -2.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.62 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.526 0 C3'-C2'-C1' 106.383 2.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.62 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.713 1 P-O3'-C3' 125.296 4.664 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.406 0 O4'-C4'-C3' 108.104 2.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.597 0 P-O3'-C3' 123.45 3.125 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.842 0 O4'-C1'-N19 109.365 1.956 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.486 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 74.88 150.11 0.11 Allowed 'General case' 0 C--N 1.381 1.968 0 CA-C-N 113.734 -1.575 . . . . 0.0 108.643 -172.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 170.94 -38.45 0.0 OUTLIER 'General case' 0 C--N 1.388 2.281 0 CA-C-N 113.527 -1.67 . . . . 0.0 107.962 -173.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . 0.484 ' O ' HD23 ' P' ' 105' ' ' LEU . . . -120.15 106.15 1.16 Allowed Glycine 0 C--N 1.381 3.044 0 N-CA-C 108.899 -1.68 . . . . 0.0 108.899 -161.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.513 HD22 ' HA ' ' P' ' 105' ' ' LEU . 0.0 OUTLIER -138.37 168.91 14.15 Favored Pre-proline 0 CA--C 1.583 2.227 0 CA-C-N 113.683 -1.258 . . . . 0.0 108.775 179.421 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.46 ' HD2' ' HB3' ' P' ' 105' ' ' LEU . 0.3 OUTLIER -94.25 83.0 0.15 Allowed 'Trans proline' 0 C--N 1.394 2.972 0 C-N-CA 123.857 3.038 . . . . 0.0 110.226 -164.228 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -96.72 105.19 17.26 Favored 'General case' 0 C--N 1.383 2.032 0 CA-C-N 113.645 -1.616 . . . . 0.0 109.185 174.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . 0.731 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -93.0 -42.4 9.46 Favored 'General case' 0 C--N 1.382 2.01 0 CA-C-N 113.73 -1.577 . . . . 0.0 108.15 -175.789 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.58 ' HG3' ' N ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -71.3 160.58 32.55 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 113.761 -1.563 . . . . 0.0 109.102 172.099 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.731 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.7 OUTLIER -137.91 -155.09 0.57 Allowed 'General case' 0 C--N 1.378 1.832 0 CA-C-O 123.226 1.488 . . . . 0.0 107.452 -154.715 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.808 ' HD2' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -96.29 90.73 5.56 Favored 'General case' 0 C--N 1.385 2.141 0 CA-C-N 111.905 -2.407 . . . . 0.0 108.297 -167.558 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 69.0 mtt85 -53.59 166.29 0.32 Allowed 'General case' 0 C--N 1.392 2.416 0 CA-C-N 111.671 -2.513 . . . . 0.0 108.71 155.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.85 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.6 OUTLIER -88.8 118.82 28.77 Favored 'General case' 0 C--N 1.384 2.085 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 155.161 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.751 HG21 ' OP1' ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -111.11 62.84 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.175 0 CA-C-O 125.839 2.733 . . . . 0.0 107.878 -157.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.85 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.1 108.15 8.82 Favored 'General case' 0 C--N 1.392 2.439 0 CA-C-N 110.94 -2.845 . . . . 0.0 109.2 -155.353 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.499 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.1 m-85 -75.24 142.21 43.4 Favored 'General case' 0 C--N 1.389 2.3 0 CA-C-N 112.531 -2.122 . . . . 0.0 108.057 -167.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.29 148.13 52.3 Favored 'General case' 0 C--N 1.381 1.965 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -169.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.433 ' O ' ' N ' ' P' ' 122' ' ' TYR . 31.8 ttmt -43.43 -36.15 1.86 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-N 113.384 -1.734 . . . . 0.0 109.226 -177.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.67 -66.86 0.32 Allowed 'General case' 0 C--N 1.382 2.019 0 CA-C-O 124.109 1.909 . . . . 0.0 109.138 173.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.546 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.7 mt-30 -48.71 -45.92 39.95 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-N 112.476 -2.147 . . . . 0.0 109.663 177.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.71 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.0 m -54.73 -54.75 37.83 Favored 'General case' 0 C--N 1.382 1.993 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.614 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.6 t80 -53.18 -46.13 68.81 Favored 'General case' 0 C--N 1.382 2.014 0 CA-C-O 122.381 1.086 . . . . 0.0 110.161 -171.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.696 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.3 OUTLIER -66.35 -40.15 89.64 Favored 'General case' 0 C--N 1.38 1.893 0 CA-C-N 114.245 -1.343 . . . . 0.0 107.803 179.417 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.736 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.7 mt -60.98 -48.94 79.5 Favored 'General case' 0 C--N 1.386 2.174 0 O-C-N 120.528 -1.357 . . . . 0.0 109.607 173.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.6 mt-10 -55.18 -52.63 62.72 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 122.755 1.264 . . . . 0.0 109.398 176.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.614 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -42.28 -58.67 2.09 Favored 'General case' 0 C--N 1.379 1.848 0 CA-C-N 112.209 -2.269 . . . . 0.0 109.075 177.073 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.679 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -69.83 -32.72 71.3 Favored 'General case' 0 C--N 1.396 2.596 0 CA-C-N 112.481 -2.145 . . . . 0.0 108.467 -168.083 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.715 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.0 t80 -68.95 -52.09 32.87 Favored 'General case' 0 C--N 1.384 2.098 0 CA-C-O 121.81 0.814 . . . . 0.0 109.638 171.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.668 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 3.2 mmm180 -62.58 -14.07 38.4 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-N 113.545 -1.661 . . . . 0.0 108.302 -164.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . 0.436 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 41.4 mt-30 -95.91 -47.33 6.17 Favored 'General case' 0 C--N 1.379 1.87 0 CA-C-O 123.93 1.824 . . . . 0.0 106.539 -176.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.614 ' OE1' HD23 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -159.36 123.1 3.78 Favored 'General case' 0 C--N 1.394 2.527 0 CA-C-N 111.919 -2.401 . . . . 0.0 110.256 -166.043 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . 0.5 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 1.1 ptt-85 -80.45 -7.65 59.23 Favored 'General case' 0 C--N 1.387 2.223 0 CA-C-N 112.36 -2.2 . . . . 0.0 111.243 -162.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.578 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 0.4 OUTLIER -152.84 90.6 1.48 Allowed 'General case' 0 C--N 1.378 1.837 0 CA-C-O 126.846 3.212 . . . . 0.0 109.183 -154.268 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.614 HD23 ' OE1' ' P' ' 131' ' ' GLN . 65.0 mt -97.3 137.88 35.62 Favored 'General case' 0 C--N 1.415 3.413 0 CA-C-N 111.863 -2.426 . . . . 0.0 108.528 -166.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.31 156.68 25.4 Favored 'General case' 0 C--N 1.381 1.971 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 161.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.521 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.11 -50.01 90.05 Favored Pre-proline 0 CA--C 1.583 2.221 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.458 -163.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.521 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 69.9 Cg_exo -57.05 -28.86 80.72 Favored 'Trans proline' 0 C--N 1.4 3.269 0 N-CA-C 115.011 1.12 . . . . 0.0 115.011 -172.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.564 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.1 OUTLIER -55.53 -70.88 0.1 Allowed 'General case' 0 C--N 1.384 2.093 0 CA-C-O 125.039 2.352 . . . . 0.0 105.734 164.421 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 1.015 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.59 -40.51 80.46 Favored 'General case' 0 C--N 1.391 2.388 0 CA-C-N 109.514 -3.494 . . . . 0.0 108.739 -156.047 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.647 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.8 mt-10 -53.17 -41.28 65.04 Favored 'General case' 0 C--N 1.38 1.901 0 CA-C-O 123.482 1.611 . . . . 0.0 108.368 178.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -64.03 -35.13 79.7 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.99 -172.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.679 HD13 ' CG ' ' P' ' 127' ' ' ARG . 2.5 tp -65.33 -43.04 92.21 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-O 123.282 1.515 . . . . 0.0 108.957 168.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.2 -34.98 66.77 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-N 112.32 -2.218 . . . . 0.0 108.37 174.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.572 ' N ' ' O ' ' P' ' 140' ' ' GLU . 3.1 t -73.49 -44.27 58.28 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.248 -179.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 81.2 mt -66.19 -47.01 75.31 Favored 'General case' 0 C--N 1.379 1.88 0 CA-C-O 124.897 2.284 . . . . 0.0 107.933 -163.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 1.045 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.66 -17.07 7.1 Favored 'Isoleucine or valine' 0 C--N 1.385 2.124 0 CA-C-N 110.539 -3.028 . . . . 0.0 107.688 -171.565 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 81.26 37.11 0.08 Allowed 'General case' 0 C--N 1.385 2.148 0 CA-C-N 111.44 -2.618 . . . . 0.0 108.181 152.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 1.045 HD12 HD11 ' P' ' 146' ' ' ILE . 6.0 mt -95.32 168.25 10.84 Favored 'General case' 0 C--N 1.39 2.359 0 CA-C-N 112.084 -2.325 . . . . 0.0 109.395 168.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.65 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.9 p -89.28 143.8 31.45 Favored Pre-proline 0 CA--C 1.588 2.407 0 CA-C-O 122.794 1.283 . . . . 0.0 108.26 172.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -60.66 -37.82 76.52 Favored 'Trans proline' 0 C--N 1.414 3.993 0 C-N-CA 122.531 2.154 . . . . 0.0 112.409 -155.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.27 -32.65 62.55 Favored 'General case' 0 C--N 1.385 2.121 0 C-N-CA 119.512 -0.875 . . . . 0.0 109.806 166.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.65 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.8 mt-30 -72.4 -29.44 63.74 Favored 'General case' 0 C--N 1.389 2.283 0 N-CA-C 105.848 -1.908 . . . . 0.0 105.848 -178.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.83 HG11 ' HB2' ' P' ' 139' ' ' ARG . 1.2 t -64.71 -69.75 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.098 0 CA-C-N 121.9 2.137 . . . . 0.0 109.562 166.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 1.015 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.68 -59.18 0.41 Allowed 'General case' 0 C--N 1.387 2.234 0 C-N-CA 124.986 1.315 . . . . 0.0 110.801 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.743 HG21 " H5'" ' A' ' 8' ' ' ' DA' . 3.4 mm -55.22 -43.15 69.49 Favored 'Isoleucine or valine' 0 C--N 1.384 2.082 0 CA-C-N 112.825 -1.989 . . . . 0.0 110.089 -176.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.736 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.0 t90 -66.83 -30.56 70.77 Favored 'General case' 0 C--N 1.382 1.981 0 O-C-N 120.912 -1.118 . . . . 0.0 108.998 174.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.715 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 45.2 m-85 -76.11 -44.39 38.8 Favored 'General case' 0 C--O 1.276 2.493 0 O-C-N 121.235 -0.916 . . . . 0.0 111.939 174.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' P' ' 154' ' ' LYS . 23.5 mt-30 -42.71 -66.3 0.38 Allowed 'General case' 0 C--N 1.378 1.807 0 O-C-N 119.078 -2.264 . . . . 0.0 107.713 167.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -56.66 -21.93 30.97 Favored 'General case' 0 C--N 1.396 2.628 0 CA-C-N 112.759 -2.019 . . . . 0.0 109.695 -165.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.509 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.8 OUTLIER -76.12 -49.84 16.29 Favored 'General case' 0 C--O 1.284 2.876 0 CA-C-N 120.9 1.682 . . . . 0.0 110.809 172.253 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.734 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -69.2 -41.31 77.29 Favored 'General case' 0 C--O 1.269 2.083 0 CA-C-N 122.505 2.411 . . . . 0.0 109.578 -160.062 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -66.04 -31.72 72.76 Favored 'General case' 0 C--N 1.38 1.931 0 O-C-N 119.951 -1.718 . . . . 0.0 109.359 171.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -32.67 74.26 Favored 'General case' 0 C--N 1.381 1.96 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -171.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.734 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.4 OUTLIER -69.02 -56.25 8.34 Favored 'General case' 0 C--N 1.378 1.828 0 CA-C-O 125.035 2.35 . . . . 0.0 105.556 -165.321 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . . . . . . . . . 7.9 mtpt -58.26 -51.65 68.86 Favored 'General case' 0 C--N 1.388 2.269 0 CA-C-N 108.437 -3.983 . . . . 0.0 109.016 -170.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -30.27 66.79 Favored 'General case' 0 C--N 1.382 1.996 0 CA-C-N 112.293 -2.231 . . . . 0.0 108.079 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.652 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -68.36 -32.25 72.2 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-O 124.237 1.97 . . . . 0.0 109.529 -174.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.21 -20.72 31.85 Favored 'General case' 0 C--N 1.392 2.425 0 CA-C-N 112.695 -2.048 . . . . 0.0 109.913 -175.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -53.42 -32.57 50.34 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-O 123.901 1.81 . . . . 0.0 109.812 167.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.19 -33.67 43.67 Favored 'General case' 0 C--N 1.38 1.923 0 CA-C-N 112.183 -2.281 . . . . 0.0 107.466 -154.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 11.0 mttt -72.5 87.59 1.2 Allowed 'General case' 0 C--N 1.381 1.965 0 CA-C-N 113.51 -1.677 . . . . 0.0 109.02 -158.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . 0.448 ' C ' ' CD1' ' P' ' 173' ' ' TYR . . . 111.95 -93.46 0.7 Allowed Glycine 0 C--N 1.382 3.131 0 N-CA-C 108.545 -1.822 . . . . 0.0 108.545 -155.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . 0.486 ' HD1' ' N ' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 140.31 158.4 0.0 OUTLIER 'General case' 0 C--N 1.382 1.999 0 CA-C-N 113.051 -1.575 . . . . 0.0 109.604 -175.482 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.15 70.51 10.57 Favored 'General case' 0 C--N 1.391 2.394 0 CA-C-N 111.779 -2.464 . . . . 0.0 109.11 168.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -86.21 52.46 4.52 Favored Glycine 0 C--N 1.38 2.975 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 171.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -171.94 133.36 0.79 Allowed Pre-proline 0 CA--C 1.579 2.092 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 156.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo . . . . . 0 CA--C 1.594 3.482 0 C-N-CA 121.443 1.429 . . . . 0.0 111.552 167.703 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.838 0 O5'-C5'-C4' 114.345 2.961 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.672 ' N1 ' ' N3 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.438 1 P-O3'-C3' 126.812 5.927 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.53 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.84 0 P-O3'-C3' 123.268 2.973 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.646 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.52 0 P-O3'-C3' 123.852 3.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.506 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.863 0 P-O3'-C3' 122.854 2.629 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.549 ' C5 ' ' N6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.569 4.05 0 O4'-C4'-C3' 108.152 2.552 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.765 H2'' " H5'" ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.483 0 P-O3'-C3' 123.973 3.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.765 " H5'" H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.793 0 O4'-C1'-N19 110.419 3.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.468 ' C8 ' ' C7 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.524 0 O4'-C4'-C3' 108.201 2.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.477 H2'' ' C8 ' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.925 0 N19-C1'-C2' 117.745 2.216 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.509 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.606 0 O4'-C4'-C3' 108.59 2.99 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.561 3.335 1 P-O3'-C3' 127.369 6.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.729 " H2'" ' H71' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.532 0 O4'-C4'-C3' 108.428 2.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.729 ' H71' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.525 0 O4'-C4'-C3' 108.211 2.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.682 ' N9 ' ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.898 1 O4'-C1'-N19 111.371 4.463 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.682 ' H71' ' N9 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.602 0 P-O3'-C3' 122.21 2.092 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . 0.458 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.611 0 O5'-C5'-C4' 115.061 3.472 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.592 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.601 0 O4'-C4'-C3' 108.494 2.894 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.592 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.335 0 O4'-C4'-C3' 108.09 2.49 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.487 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.386 0 O4'-C4'-C3' 107.966 2.366 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.633 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.572 4.366 0 N19-C1'-C2' 118.963 2.977 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.633 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.532 0 P-O3'-C3' 122.877 2.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.627 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.439 0 C3'-C2'-C1' 106.986 3.061 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.627 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.703 0 P-O3'-C3' 123.305 3.005 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.632 ' C2 ' ' C4 ' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.568 3.981 0 P-O3'-C3' 124.018 3.598 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.632 ' C4 ' ' C2 ' ' B' ' 25' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.56 4.198 0 P-O3'-C3' 124.124 3.686 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.603 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.617 0 C4'-C3'-C2' 100.616 -2.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.608 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.489 0 P-O3'-C3' 122.628 2.44 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.646 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.567 0 O4'-C4'-C3' 108.402 2.802 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.662 " H5'" HH12 ' P' ' 113' ' ' ARG . . . . . . . . 0 C5'--C4' 1.538 3.427 0 O4'-C4'-C3' 107.915 2.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.672 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.563 0 O4'-C4'-C3' 108.217 2.617 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.791 0 O4'-C1'-N19 109.349 1.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.485 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -101.97 163.81 12.05 Favored 'General case' 0 C--N 1.382 2.011 0 CA-C-N 113.638 -1.619 . . . . 0.0 108.647 -172.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 170.3 -38.34 0.0 OUTLIER 'General case' 0 C--N 1.389 2.292 0 CA-C-N 113.546 -1.661 . . . . 0.0 108.011 -174.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -114.35 -129.01 4.71 Favored Glycine 0 C--N 1.382 3.1 0 N-CA-C 108.879 -1.688 . . . . 0.0 108.879 -161.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.877 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.1 OUTLIER -172.12 154.78 3.44 Favored Pre-proline 0 CA--C 1.581 2.16 0 CA-C-N 113.662 -1.269 . . . . 0.0 108.632 167.357 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.877 ' HD2' HD13 ' P' ' 105' ' ' LEU . 65.9 Cg_exo -49.01 92.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.398 3.157 0 C-N-CA 122.871 2.381 . . . . 0.0 110.372 155.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' P' ' 108' ' ' LYS . 8.4 m-20 -107.0 148.02 29.19 Favored 'General case' 0 C--N 1.381 1.971 0 CA-C-O 122.429 1.109 . . . . 0.0 109.149 158.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . 0.606 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.1 OUTLIER -162.55 33.81 0.11 Allowed 'General case' 0 C--N 1.381 1.978 0 CA-C-N 113.683 -1.599 . . . . 0.0 108.151 -172.311 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.436 ' HE2' ' H ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -48.22 162.32 0.09 Allowed 'General case' 0 C--N 1.381 1.951 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.083 166.487 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.606 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.6 OUTLIER -123.72 86.42 2.57 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-N 113.669 -1.605 . . . . 0.0 108.909 -155.553 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.607 ' HG3' " H4'" ' A' ' 8' ' ' ' DA' . 0.4 OUTLIER -25.01 91.97 0.01 OUTLIER 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.187 -1.824 . . . . 0.0 110.313 169.089 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 36.1 mtt85 -70.4 -175.77 1.09 Allowed 'General case' 0 C--N 1.388 2.266 0 CA-C-N 112.112 -2.313 . . . . 0.0 108.926 155.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.892 ' CD ' HD21 ' P' ' 115' ' ' LEU . 1.0 OUTLIER -95.8 118.37 32.32 Favored 'General case' 0 C--N 1.384 2.071 0 CA-C-N 113.579 -1.646 . . . . 0.0 107.164 160.125 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.434 HG23 " O3'" ' A' ' 7' ' ' ' DA' . 0.1 OUTLIER -105.65 68.08 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.388 2.249 0 CA-C-O 125.265 2.46 . . . . 0.0 108.011 -163.48 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.892 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.89 108.75 10.15 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 111.52 -2.582 . . . . 0.0 109.335 -159.669 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.581 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 0.9 OUTLIER -77.49 143.63 38.34 Favored 'General case' 0 C--N 1.391 2.411 0 CA-C-N 112.725 -2.034 . . . . 0.0 107.705 -170.579 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.68 148.17 52.28 Favored 'General case' 0 C--N 1.382 1.984 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 -171.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -43.78 -36.51 2.32 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-N 113.279 -1.782 . . . . 0.0 109.157 -177.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.51 -65.16 0.61 Allowed 'General case' 0 C--N 1.382 2.007 0 CA-C-O 124.203 1.954 . . . . 0.0 109.237 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.561 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.2 mt-30 -49.32 -47.61 46.99 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 127.081 2.152 . . . . 0.0 109.722 176.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.649 ' HA ' HD12 ' P' ' 124' ' ' LEU . 16.5 m -51.16 -56.18 14.08 Favored 'General case' 0 C--N 1.384 2.072 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 169.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.546 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 2.6 t80 -52.96 -48.62 67.24 Favored 'General case' 0 C--N 1.381 1.975 0 CA-C-O 122.593 1.187 . . . . 0.0 110.048 -169.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.934 ' CD ' HG22 ' P' ' 146' ' ' ILE . 6.9 mt-10 -66.23 -36.97 84.42 Favored 'General case' 0 C--N 1.377 1.798 0 CA-C-N 114.253 -1.34 . . . . 0.0 107.826 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.827 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.3 mt -59.98 -51.85 67.92 Favored 'General case' 0 C--N 1.384 2.079 0 O-C-N 120.76 -1.212 . . . . 0.0 109.871 170.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' P' ' 129' ' ' ARG . 24.2 mt-10 -54.59 -51.47 65.22 Favored 'General case' 0 C--N 1.379 1.872 0 CA-C-O 122.629 1.205 . . . . 0.0 109.294 178.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.608 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -41.46 -70.06 0.12 Allowed 'General case' 0 C--N 1.379 1.873 0 CA-C-N 111.683 -2.508 . . . . 0.0 108.681 177.076 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.62 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.7 OUTLIER -56.67 -38.73 72.63 Favored 'General case' 0 C--N 1.387 2.238 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.259 -173.181 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.862 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 27.5 t80 -69.47 -46.44 66.66 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-O 121.541 0.686 . . . . 0.0 110.144 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' P' ' 125' ' ' GLU . 13.2 mtp85 -62.63 -13.96 37.74 Favored 'General case' 0 C--N 1.381 1.936 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 -168.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -107.44 -37.19 6.28 Favored 'General case' 0 C--N 1.379 1.887 0 C-N-CA 126.938 2.095 . . . . 0.0 107.96 -168.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.496 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -153.43 108.37 3.17 Favored 'General case' 0 C--N 1.39 2.328 0 CA-C-N 111.971 -2.377 . . . . 0.0 108.615 -153.45 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -76.15 -19.37 58.53 Favored 'General case' 0 C--N 1.39 2.36 0 CA-C-N 112.021 -2.354 . . . . 0.0 110.508 -168.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.435 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 36.5 m-85 -162.27 112.54 1.53 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 113.875 -1.511 . . . . 0.0 108.313 -153.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.603 HD22 ' HG3' ' P' ' 138' ' ' GLU . 29.6 mt -120.84 142.69 49.4 Favored 'General case' 0 C--N 1.398 2.706 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -163.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.83 152.24 29.82 Favored 'General case' 0 C--N 1.382 2.02 0 O-C-N 121.14 -0.975 . . . . 0.0 108.408 158.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.44 ' HA ' ' CG ' ' P' ' 139' ' ' ARG . . . -58.58 -43.78 98.34 Favored Pre-proline 0 CA--C 1.583 2.216 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -161.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -49.82 -43.35 41.11 Favored 'Trans proline' 0 C--N 1.393 2.914 0 N-CA-C 116.954 1.867 . . . . 0.0 116.954 -179.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.603 ' HG3' HD22 ' P' ' 134' ' ' LEU . 7.6 mm-40 -52.79 -62.61 1.54 Allowed 'General case' 0 C--N 1.39 2.353 0 CA-C-O 124.13 1.919 . . . . 0.0 105.984 169.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 1.042 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -68.01 -46.79 70.28 Favored 'General case' 0 C--N 1.388 2.273 0 CA-C-N 109.492 -3.504 . . . . 0.0 108.331 -158.506 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.66 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 3.3 mt-10 -53.87 -35.71 61.85 Favored 'General case' 0 C--N 1.38 1.893 0 CA-C-O 122.744 1.259 . . . . 0.0 108.003 -177.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -65.96 -36.4 83.24 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-N 113.563 -1.653 . . . . 0.0 108.859 -173.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.635 HD21 ' C ' ' P' ' 123' ' ' GLU . 1.0 OUTLIER -65.72 -42.28 91.24 Favored 'General case' 0 C--N 1.382 1.992 0 CA-C-O 123.172 1.463 . . . . 0.0 109.072 168.163 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.66 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.18 -32.66 64.54 Favored 'General case' 0 C--N 1.389 2.308 0 CA-C-N 112.62 -2.082 . . . . 0.0 108.346 172.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.627 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.4 t -73.15 -43.63 61.26 Favored 'General case' 0 C--N 1.389 2.302 0 CA-C-N 113.468 -1.696 . . . . 0.0 109.571 -177.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 86.4 mt -69.2 -45.68 69.32 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-O 124.812 2.244 . . . . 0.0 108.262 -164.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.969 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -97.14 -13.28 8.14 Favored 'Isoleucine or valine' 0 C--N 1.39 2.36 0 CA-C-N 110.934 -2.848 . . . . 0.0 108.11 -169.245 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 83.05 34.87 0.06 Allowed 'General case' 0 C--N 1.382 1.995 0 CA-C-O 125.67 2.652 . . . . 0.0 108.249 152.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.969 HD12 HD11 ' P' ' 146' ' ' ILE . 9.2 mt -96.89 171.41 8.52 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 111.65 -2.523 . . . . 0.0 109.736 169.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.569 ' O ' ' N ' ' P' ' 152' ' ' GLN . 20.7 p -95.2 143.19 25.68 Favored Pre-proline 0 CA--C 1.588 2.442 0 CA-C-O 122.361 1.077 . . . . 0.0 108.773 168.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.475 ' HG3' ' HA ' ' P' ' 140' ' ' GLU . 77.5 Cg_exo -55.37 -36.45 93.85 Favored 'Trans proline' 0 C--N 1.41 3.787 0 C-N-CA 122.059 1.84 . . . . 0.0 114.475 -165.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.73 -9.26 13.35 Favored 'General case' 0 C--N 1.38 1.93 0 CA-C-N 119.992 1.269 . . . . 0.0 111.687 167.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.569 ' N ' ' O ' ' P' ' 149' ' ' THR . 42.5 mt-30 -88.56 -34.22 17.43 Favored 'General case' 0 C--O 1.285 2.952 0 CA-C-O 117.169 -1.396 . . . . 0.0 108.471 168.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.971 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.0 OUTLIER -65.0 -70.5 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.941 0 CA-C-N 124.65 3.386 . . . . 0.0 109.731 165.806 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 1.042 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.4 -54.2 0.52 Allowed 'General case' 0 C--N 1.386 2.17 0 C-N-CA 125.796 1.638 . . . . 0.0 108.865 -178.315 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.579 HD13 ' OE1' ' P' ' 158' ' ' GLN . 7.4 mm -56.89 -61.74 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.956 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.827 ' HB3' HD22 ' P' ' 124' ' ' LEU . 3.4 t90 -49.82 -30.19 9.33 Favored 'General case' 0 C--N 1.382 2.019 0 O-C-N 120.2 -1.562 . . . . 0.0 109.187 -178.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.971 ' CE2' HG13 ' P' ' 153' ' ' VAL . 74.1 m-85 -75.51 -43.88 46.65 Favored 'General case' 0 C--O 1.282 2.779 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 170.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.579 ' OE1' HD13 ' P' ' 155' ' ' ILE . 13.6 mt-30 -41.95 -70.94 0.09 Allowed 'General case' 0 C--N 1.378 1.808 0 O-C-N 118.517 -2.614 . . . . 0.0 106.533 161.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -18.92 22.82 Favored 'General case' 0 C--N 1.385 2.15 0 CA-C-O 117.684 -1.151 . . . . 0.0 111.187 -165.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.558 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.1 t60 -74.95 -48.87 22.21 Favored 'General case' 0 C--O 1.281 2.72 0 CA-C-N 120.964 1.711 . . . . 0.0 110.186 177.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.805 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -68.63 -38.66 80.68 Favored 'General case' 0 C--O 1.269 2.079 0 CA-C-N 122.443 2.383 . . . . 0.0 110.59 -159.035 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -69.02 -30.95 69.44 Favored 'General case' 0 C--N 1.38 1.908 0 O-C-N 119.836 -1.79 . . . . 0.0 109.63 171.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -64.99 -37.52 87.91 Favored 'General case' 0 C--N 1.381 1.948 0 O-C-N 121.58 -0.7 . . . . 0.0 109.411 -173.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.805 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -59.0 -57.69 11.94 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-O 124.675 2.179 . . . . 0.0 106.092 -170.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.402 ' H ' ' HG3' ' P' ' 165' ' ' LYS . 17.0 mtpt -58.78 -45.37 89.99 Favored 'General case' 0 C--N 1.386 2.167 0 CA-C-N 108.564 -3.926 . . . . 0.0 109.123 -167.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -42.55 -51.18 5.19 Favored 'General case' 0 C--N 1.383 2.065 0 CA-C-N 113.339 -1.755 . . . . 0.0 111.278 170.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.64 -33.82 74.61 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-N 111.647 -2.524 . . . . 0.0 108.504 -171.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -80.15 -23.19 41.28 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 111.862 -2.426 . . . . 0.0 109.479 -174.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -54.78 -30.23 56.26 Favored 'General case' 0 C--N 1.384 2.101 0 CA-C-O 122.791 1.281 . . . . 0.0 109.337 169.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -74.33 -35.18 63.6 Favored 'General case' 0 C--N 1.387 2.198 0 CA-C-N 113.044 -1.889 . . . . 0.0 108.211 -164.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 12.0 mttt -85.2 89.62 7.69 Favored 'General case' 0 C--N 1.381 1.957 0 CA-C-N 113.821 -1.536 . . . . 0.0 109.14 -155.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 116.8 -87.51 0.44 Allowed Glycine 0 C--N 1.382 3.139 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 -155.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . 0.532 ' HD1' ' N ' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 155.62 151.08 0.01 OUTLIER 'General case' 0 C--N 1.381 1.953 0 CA-C-N 113.335 -1.433 . . . . 0.0 108.887 171.144 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -165.65 158.14 15.19 Favored 'General case' 0 C--N 1.39 2.333 0 CA-C-N 112.645 -2.07 . . . . 0.0 107.357 156.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 53.75 27.55 36.06 Favored Glycine 0 C--N 1.38 3.008 0 O-C-N 120.479 -1.388 . . . . 0.0 110.305 -160.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -130.1 134.33 25.99 Favored Pre-proline 0 CA--C 1.58 2.116 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 174.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo . . . . . 0 CA--C 1.593 3.465 0 C-N-CA 121.474 1.449 . . . . 0.0 111.604 172.63 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.769 0 O5'-C5'-C4' 114.385 2.989 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.701 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.561 3.314 0 O4'-C4'-C3' 108.144 2.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.701 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.94 0 P-O3'-C3' 122.728 2.524 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.627 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.408 0 P-O3'-C3' 123.295 2.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.555 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.843 0 O4'-C4'-C3' 108.1 2.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.536 H2'' ' C8 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.018 0 N19-C1'-C2' 118.941 2.963 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.768 " C5'" ' HG2' ' P' ' 113' ' ' ARG . . . . . . . . 0 C4'--C3' 1.562 3.434 1 O4'-C1'-N19 111.569 4.711 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.595 ' C6 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.412 0 C3'-C2'-C1' 106.284 2.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.595 ' C5 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.563 0 O4'-C4'-C3' 108.483 2.883 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.595 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.798 0 P-O3'-C3' 123.997 3.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.464 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.595 0 O4'-C4'-C3' 108.546 2.946 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.489 1 P-O3'-C3' 125.653 4.96 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.504 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 O4'-C4'-C3' 108.426 2.826 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.504 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.696 0 C2'-C3'-O3' 116.659 2.244 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.619 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.878 1 O4'-C1'-N19 111.32 4.399 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.619 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.553 0 P-O3'-C3' 122.227 2.106 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . 0.443 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.671 0 O5'-C5'-C4' 115.038 3.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.601 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.531 0 O4'-C4'-C3' 108.336 2.736 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.601 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.347 0 P-O3'-C3' 123.121 2.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.526 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.355 0 O4'-C4'-C3' 108.077 2.477 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.609 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.571 4.311 0 N19-C1'-C2' 118.917 2.948 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.609 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.559 0 P-O3'-C3' 123.257 2.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.443 0 C3'-C2'-C1' 107.11 3.15 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.595 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.865 0 O4'-C4'-C3' 108.209 2.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.593 " C5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.572 4.374 1 P-O3'-C3' 124.981 4.401 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.515 " C2'" ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.212 0 P-O3'-C3' 124.293 3.828 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.543 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.588 0 P-O3'-C3' 123.744 3.37 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.629 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.483 0 C4'-C3'-C2' 100.667 -2.533 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.629 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.58 0 P-O3'-C3' 123.294 2.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.639 " C5'" HH12 ' P' ' 113' ' ' ARG . . . . . . . . 0 C5'--C4' 1.538 3.37 0 O4'-C4'-C3' 107.843 2.243 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.466 H2'' ' C8 ' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.595 0 O4'-C4'-C3' 108.186 2.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . 0.466 ' C8 ' H2'' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.542 3.899 0 O4'-C1'-N19 109.404 2.004 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.502 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.9 t -80.53 -59.49 2.67 Favored 'General case' 0 C--N 1.382 1.983 0 CA-C-N 113.669 -1.605 . . . . 0.0 108.635 175.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 169.65 37.74 0.0 OUTLIER 'General case' 0 C--N 1.396 2.602 0 CA-C-N 113.383 -1.735 . . . . 0.0 109.483 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . 95.28 151.88 28.74 Favored Glycine 0 C--N 1.381 3.063 0 N-CA-C 108.738 -1.745 . . . . 0.0 108.738 161.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.7 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.1 OUTLIER -157.27 145.59 14.36 Favored Pre-proline 0 CA--C 1.58 2.122 0 CA-C-N 113.679 -1.26 . . . . 0.0 108.775 -165.801 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.7 ' HD2' HD13 ' P' ' 105' ' ' LEU . 0.1 OUTLIER -82.15 45.88 2.06 Favored 'Trans proline' 0 C--N 1.394 2.957 0 C-N-CA 123.142 2.561 . . . . 0.0 110.524 163.863 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -52.69 153.44 3.18 Favored 'General case' 0 C--N 1.382 1.981 0 CA-C-N 113.928 -1.487 . . . . 0.0 109.171 -174.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.6 -165.75 1.1 Allowed 'General case' 0 C--N 1.382 1.998 0 CA-C-N 113.715 -1.584 . . . . 0.0 108.132 -173.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.709 ' HE2' ' O ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -69.75 135.21 49.49 Favored 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.705 -1.589 . . . . 0.0 109.093 179.445 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.709 ' O ' ' HE2' ' P' ' 109' ' ' LYS . 1.1 mmt85 -96.03 -145.28 0.28 Allowed 'General case' 0 C--N 1.377 1.793 0 CA-C-O 123.915 1.816 . . . . 0.0 108.151 -169.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' P' ' 111' ' ' LYS . 0.1 OUTLIER -146.77 115.86 6.94 Favored 'General case' 0 C--N 1.39 2.365 0 CA-C-N 111.68 -2.509 . . . . 0.0 107.979 158.706 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' P' ' 111' ' ' LYS . 70.2 mtt85 -62.92 170.96 2.38 Favored 'General case' 0 C--N 1.382 1.979 0 CA-C-N 114.145 -1.389 . . . . 0.0 108.799 160.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.867 ' CD ' HD21 ' P' ' 115' ' ' LEU . 1.2 ttm180 -87.13 117.27 25.75 Favored 'General case' 0 C--N 1.384 2.081 0 CA-C-N 113.569 -1.65 . . . . 0.0 106.917 163.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.501 HG23 " O3'" ' A' ' 7' ' ' ' DA' . 0.1 OUTLIER -105.63 69.2 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.387 2.217 0 CA-C-O 125.107 2.384 . . . . 0.0 108.004 -163.486 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.867 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.62 108.12 9.4 Favored 'General case' 0 C--N 1.388 2.26 0 CA-C-N 111.697 -2.501 . . . . 0.0 109.469 -156.369 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.413 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 1.5 m-85 -76.81 141.42 40.72 Favored 'General case' 0 C--N 1.389 2.287 0 CA-C-N 112.97 -1.923 . . . . 0.0 108.026 -170.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.1 p -67.37 148.08 52.09 Favored 'General case' 0 C--N 1.381 1.967 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -171.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.43 ' O ' ' N ' ' P' ' 122' ' ' TYR . 35.0 ttmt -43.17 -36.17 1.63 Allowed 'General case' 0 C--N 1.382 2.012 0 CA-C-N 113.271 -1.786 . . . . 0.0 109.258 -178.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.56 -66.67 0.35 Allowed 'General case' 0 C--N 1.383 2.032 0 CA-C-O 124.172 1.939 . . . . 0.0 109.078 173.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.9 mt-30 -49.12 -48.24 44.71 Favored 'General case' 0 C--N 1.382 2.005 0 CA-C-N 112.421 -2.172 . . . . 0.0 109.491 177.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.707 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.9 m -52.38 -55.07 24.15 Favored 'General case' 0 C--N 1.385 2.143 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 170.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.509 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 2.3 t80 -53.05 -45.69 68.19 Favored 'General case' 0 C--N 1.383 2.057 0 CA-C-O 122.237 1.018 . . . . 0.0 109.985 -171.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.715 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.8 -39.64 87.84 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-N 114.321 -1.309 . . . . 0.0 107.834 179.664 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.745 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.3 mt -60.55 -49.49 77.33 Favored 'General case' 0 C--N 1.385 2.111 0 O-C-N 120.532 -1.355 . . . . 0.0 109.599 172.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' P' ' 129' ' ' ARG . 22.5 mt-10 -55.68 -51.79 66.06 Favored 'General case' 0 C--N 1.381 1.956 0 CA-C-O 122.575 1.179 . . . . 0.0 109.639 177.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.594 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -40.65 -70.24 0.11 Allowed 'General case' 0 C--N 1.378 1.822 0 CA-C-N 111.851 -2.431 . . . . 0.0 109.022 177.245 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.735 ' HD2' HD21 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -62.82 -31.44 72.43 Favored 'General case' 0 C--N 1.379 1.866 0 CA-C-N 113.702 -1.59 . . . . 0.0 108.244 -171.185 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.813 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 19.9 t80 -70.13 -49.02 54.93 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-N 119.786 1.176 . . . . 0.0 109.971 175.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.5 mmm180 -62.65 -16.12 55.41 Favored 'General case' 0 C--N 1.38 1.909 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -166.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -105.29 -41.29 5.57 Favored 'General case' 0 C--N 1.378 1.84 0 CA-C-O 124.07 1.891 . . . . 0.0 107.217 -168.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.459 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.7 OUTLIER -152.94 96.67 2.12 Favored 'General case' 0 C--N 1.386 2.175 0 CA-C-N 111.752 -2.477 . . . . 0.0 109.54 -152.012 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . 0.487 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -77.48 -5.85 51.44 Favored 'General case' 0 C--N 1.394 2.52 0 CA-C-N 111.59 -2.55 . . . . 0.0 110.779 -158.406 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.726 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 2.5 m-30 -163.85 113.04 1.23 Allowed 'General case' 0 C--N 1.38 1.923 0 CA-C-N 114.516 -1.22 . . . . 0.0 108.356 -154.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.735 HD21 ' HD2' ' P' ' 127' ' ' ARG . 43.3 mt -120.67 139.6 52.79 Favored 'General case' 0 C--N 1.397 2.664 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -161.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.85 157.63 25.63 Favored 'General case' 0 C--N 1.382 2.022 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 160.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.522 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.22 -49.81 90.9 Favored Pre-proline 0 CA--C 1.583 2.222 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.465 -164.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 50.9 Cg_exo -55.99 -29.73 75.03 Favored 'Trans proline' 0 C--N 1.399 3.187 0 C-N-CA 121.002 1.135 . . . . 0.0 114.649 -173.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.445 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.0 OUTLIER -55.87 -69.45 0.14 Allowed 'General case' 0 C--N 1.385 2.121 0 CA-C-O 124.176 1.941 . . . . 0.0 106.09 165.535 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.632 ' CZ ' ' HG3' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.67 -35.79 75.44 Favored 'General case' 0 C--N 1.391 2.408 0 CA-C-N 109.858 -3.337 . . . . 0.0 108.85 -156.275 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.668 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 4.0 mt-10 -52.25 -44.8 65.08 Favored 'General case' 0 C--N 1.381 1.944 0 CA-C-O 123.628 1.68 . . . . 0.0 107.786 174.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -67.12 -36.3 81.6 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 112.396 -2.184 . . . . 0.0 109.121 -166.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.573 ' O ' HG23 ' P' ' 146' ' ' ILE . 1.0 OUTLIER -65.95 -42.1 90.42 Favored 'General case' 0 C--N 1.382 1.995 0 CA-C-O 123.158 1.456 . . . . 0.0 109.049 169.401 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.3 -35.69 67.81 Favored 'General case' 0 C--N 1.389 2.317 0 CA-C-N 112.54 -2.118 . . . . 0.0 108.094 172.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.596 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.5 t -70.9 -43.14 68.92 Favored 'General case' 0 C--N 1.389 2.305 0 CA-C-N 113.231 -1.804 . . . . 0.0 110.592 -178.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.73 -46.96 67.55 Favored 'General case' 0 C--N 1.38 1.903 0 CA-C-O 124.863 2.268 . . . . 0.0 108.09 -164.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.992 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -96.37 -13.16 8.23 Favored 'Isoleucine or valine' 0 C--N 1.39 2.351 0 CA-C-N 110.815 -2.902 . . . . 0.0 108.042 -168.291 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . 0.568 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 7.4 tpt180 82.32 35.28 0.07 Allowed 'General case' 0 C--N 1.382 1.998 0 CA-C-O 125.635 2.636 . . . . 0.0 107.837 153.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.992 HD12 HD11 ' P' ' 146' ' ' ILE . 9.8 mt -95.89 172.32 8.09 Favored 'General case' 0 C--N 1.396 2.611 0 CA-C-N 111.473 -2.603 . . . . 0.0 109.145 168.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.477 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.3 p -88.98 146.43 36.54 Favored Pre-proline 0 CA--C 1.587 2.371 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 165.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.554 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 85.0 Cg_exo -50.45 -49.39 16.68 Favored 'Trans proline' 0 C--N 1.408 3.71 0 C-N-CA 123.78 2.986 . . . . 0.0 114.127 -167.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . 0.427 HG22 HG12 ' P' ' 155' ' ' ILE . 0.2 OUTLIER -58.26 -20.66 44.04 Favored 'General case' 0 C--N 1.386 2.194 0 CA-C-N 112.759 -2.019 . . . . 0.0 110.79 173.847 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.4 mt-30 -78.07 -32.48 50.8 Favored 'General case' 0 C--O 1.277 2.522 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 171.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.762 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.7 t -64.27 -75.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.381 1.972 0 CA-C-N 122.967 2.621 . . . . 0.0 109.718 162.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.632 ' HG3' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -40.65 -42.84 1.8 Allowed 'General case' 0 C--N 1.387 2.212 0 C-N-CA 124.881 1.273 . . . . 0.0 109.971 -171.108 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.427 HG12 HG22 ' P' ' 151' ' ' THR . 0.7 OUTLIER -60.3 -63.05 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.956 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 -179.381 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.745 ' HB3' HD22 ' P' ' 124' ' ' LEU . 2.7 t90 -49.5 -29.03 6.08 Favored 'General case' 0 C--N 1.384 2.078 0 O-C-N 121.415 -0.803 . . . . 0.0 109.311 -177.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.813 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 52.1 m-85 -75.19 -43.06 54.17 Favored 'General case' 0 C--O 1.275 2.437 0 O-C-N 121.629 -0.669 . . . . 0.0 112.37 173.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -46.58 -65.32 0.58 Allowed 'General case' 0 C--N 1.376 1.759 0 O-C-N 119.131 -2.231 . . . . 0.0 107.028 165.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -56.0 -19.77 13.93 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-O 117.868 -1.063 . . . . 0.0 111.073 -164.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.559 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.6 OUTLIER -79.19 -46.59 17.59 Favored 'General case' 0 C--O 1.286 3.019 0 CA-C-N 121.055 1.752 . . . . 0.0 111.752 173.499 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.726 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -65.97 -37.48 86.09 Favored 'General case' 0 C--O 1.266 1.939 0 CA-C-N 123.603 2.91 . . . . 0.0 110.192 -163.854 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . 0.451 ' CZ ' ' HB2' ' P' ' 166' ' ' ARG . 86.7 t80 -68.93 -35.2 76.52 Favored 'General case' 0 C--N 1.38 1.934 0 O-C-N 120.035 -1.666 . . . . 0.0 109.621 170.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.47 -37.46 87.61 Favored 'General case' 0 C--N 1.382 2.0 0 O-C-N 121.598 -0.689 . . . . 0.0 109.394 -169.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.612 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.6 OUTLIER -56.69 -61.31 2.51 Favored 'General case' 0 C--N 1.378 1.845 0 CA-C-O 124.828 2.252 . . . . 0.0 106.297 -173.473 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.451 ' HG2' HG23 ' P' ' 164' ' ' THR . 7.5 mmmt -59.19 -48.15 82.67 Favored 'General case' 0 C--N 1.387 2.197 1 CA-C-N 108.184 -4.098 . . . . 0.0 108.121 -160.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . 0.451 ' HB2' ' CZ ' ' P' ' 162' ' ' TYR . 23.8 ttt180 -54.63 -42.42 71.19 Favored 'General case' 0 C--N 1.381 1.97 0 CA-C-N 112.268 -2.242 . . . . 0.0 109.196 -179.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -60.07 -34.53 73.56 Favored 'General case' 0 C--N 1.384 2.07 0 CA-C-N 113.392 -1.731 . . . . 0.0 108.983 -175.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -80.94 -22.58 39.52 Favored 'General case' 0 C--N 1.389 2.296 0 CA-C-N 112.079 -2.328 . . . . 0.0 109.235 -173.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -56.73 -29.87 62.95 Favored 'General case' 0 C--N 1.379 1.874 0 CA-C-O 122.689 1.233 . . . . 0.0 109.981 168.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . 0.44 ' OE2' ' HE1' ' P' ' 173' ' ' TYR . 0.7 OUTLIER -71.18 -34.96 71.4 Favored 'General case' 0 C--N 1.385 2.151 0 CA-C-N 113.565 -1.652 . . . . 0.0 108.085 -167.936 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -89.34 85.13 6.51 Favored 'General case' 0 C--N 1.381 1.948 0 CA-C-N 113.922 -1.49 . . . . 0.0 109.231 -157.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 128.2 -64.02 0.6 Allowed Glycine 0 C--N 1.383 3.143 0 N-CA-C 108.829 -1.708 . . . . 0.0 108.829 -166.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . 0.44 ' HE1' ' OE2' ' P' ' 170' ' ' GLU . 18.6 m-85 122.72 160.51 0.0 OUTLIER 'General case' 0 C--N 1.381 1.936 0 CA-C-N 113.18 -1.51 . . . . 0.0 108.964 160.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -82.06 51.4 1.76 Allowed 'General case' 0 C--N 1.379 1.888 0 CA-C-N 112.211 -2.268 . . . . 0.0 110.363 174.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 146.75 -153.48 25.38 Favored Glycine 0 C--N 1.382 3.125 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -163.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . 0.417 ' CD2' ' HD2' ' P' ' 177' ' ' PRO . 19.3 t-80 -150.45 128.7 5.91 Favored Pre-proline 0 CA--C 1.58 2.124 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -174.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . 0.417 ' HD2' ' CD2' ' P' ' 176' ' ' HIS . 88.3 Cg_endo . . . . . 0 CA--C 1.593 3.47 0 C-N-CA 121.533 1.489 . . . . 0.0 111.589 -168.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . 0.483 ' H71' ' N6 ' ' B' ' 32' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.566 3.813 0 O5'-C5'-C4' 114.362 2.973 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.503 H2'' ' H71' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.331 1 P-O3'-C3' 126.833 5.944 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.503 ' H71' H2'' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.902 0 C2'-C3'-O3' 117.07 2.396 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.654 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.525 0 P-O3'-C3' 123.369 3.058 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.52 ' C2 ' ' C2 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.739 0 O4'-C4'-C3' 108.13 2.53 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.596 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.569 4.111 0 N19-C1'-C2' 119.679 3.424 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.804 H5'' HD22 ' P' ' 115' ' ' LEU . . . . . . . . 0 C4'--C3' 1.565 3.655 2 P-O3'-C3' 124.903 4.336 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.843 " O4'" ' HE3' ' P' ' 111' ' ' LYS . . . . . . . . 0 C5'--C4' 1.538 3.415 0 P-O5'-C5' 116.541 -2.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.592 ' C5 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.564 0 O4'-C4'-C3' 108.496 2.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.592 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.871 1 P-O3'-C3' 125.402 4.751 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.49 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.453 0 P-O3'-C3' 122.827 2.606 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . 0.508 H2'' ' C5 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.306 0 P-O3'-C3' 122.597 2.414 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.515 " H2'" ' H71' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.59 0 O4'-C4'-C3' 108.174 2.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.515 ' H71' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.634 0 P-O3'-C3' 123.646 3.289 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.653 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.927 1 O4'-C1'-N19 111.613 4.767 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.653 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.517 0 P-O3'-C3' 122.18 2.066 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . 0.413 H2'' H5'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.749 0 O5'-C5'-C4' 115.067 3.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.475 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.649 1 P-O3'-C3' 126.406 5.589 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.475 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.326 0 O4'-C4'-C3' 108.175 2.575 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.571 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.321 0 O4'-C4'-C3' 107.845 2.245 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.571 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.571 4.337 0 O4'-C1'-N19 105.249 -3.188 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.535 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.559 4.149 1 P-O3'-C3' 126.539 5.699 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.568 3.983 1 P-O3'-C3' 126.22 5.433 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.566 3.811 0 P-O3'-C3' 124.285 3.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.5 " C5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.891 0 P-O3'-C3' 123.675 3.312 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.561 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C3'--C2' 1.559 4.096 0 N19-C1'-C2' 119.12 3.075 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.632 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.696 0 P-O3'-C3' 123.69 3.325 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.632 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.561 3.343 0 P-O3'-C3' 122.523 2.352 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.654 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.666 0 O4'-C4'-C3' 108.275 2.675 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.503 ' C8 ' H2'' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.378 0 O4'-C4'-C3' 107.867 2.267 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.572 0 O4'-C4'-C3' 108.207 2.607 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . 0.483 ' N6 ' ' H71' ' A' ' 1' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.935 0 O4'-C1'-N19 109.392 1.99 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.512 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.5 m -162.5 -45.7 0.04 OUTLIER 'General case' 0 C--N 1.382 2.013 0 CA-C-N 113.664 -1.607 . . . . 0.0 108.612 168.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 169.97 23.29 0.0 OUTLIER 'General case' 0 C--N 1.396 2.595 0 CA-C-N 113.319 -1.764 . . . . 0.0 109.413 173.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . 0.759 ' O ' HD22 ' P' ' 105' ' ' LEU . . . 108.6 -80.73 0.27 Allowed Glycine 0 C--N 1.38 2.974 0 N-CA-C 108.806 -1.718 . . . . 0.0 108.806 -164.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.759 HD22 ' O ' ' P' ' 104' ' ' GLY . 0.2 OUTLIER -177.45 153.14 0.98 Allowed Pre-proline 0 CA--C 1.582 2.182 0 CA-C-N 113.735 -1.232 . . . . 0.0 108.637 -161.697 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.8 92.77 0.02 OUTLIER 'Trans proline' 0 C--N 1.398 3.151 0 C-N-CA 122.883 2.389 . . . . 0.0 110.373 155.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -100.96 -175.22 2.82 Favored 'General case' 0 C--N 1.382 1.998 0 CA-C-O 122.441 1.115 . . . . 0.0 109.159 165.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . 0.79 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.2 OUTLIER -153.58 127.14 8.69 Favored 'General case' 0 C--N 1.382 1.982 0 CA-C-N 113.688 -1.596 . . . . 0.0 108.195 -175.242 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.652 ' HE3' ' H ' ' P' ' 110' ' ' ARG . 0.1 OUTLIER -66.03 162.59 19.11 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-N 113.747 -1.57 . . . . 0.0 109.132 -164.777 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.79 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.8 OUTLIER -126.19 92.74 3.64 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 113.826 -1.533 . . . . 0.0 109.267 -155.277 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.843 ' HE3' " O4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -123.59 108.37 12.53 Favored 'General case' 0 C--N 1.381 1.941 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.666 154.85 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . 0.575 ' O ' HG22 ' P' ' 114' ' ' VAL . 1.9 mtp85 -103.35 -176.45 3.09 Favored 'General case' 0 C--N 1.381 1.961 0 CA-C-N 113.595 -1.639 . . . . 0.0 108.915 166.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 1.064 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.0 OUTLIER -69.57 88.99 0.51 Allowed 'General case' 0 C--N 1.394 2.54 0 N-CA-C 105.112 -2.181 . . . . 0.0 105.112 155.439 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.575 ' N ' HD23 ' P' ' 115' ' ' LEU . 0.1 OUTLIER -98.13 54.46 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.39 2.328 0 CA-C-O 126.0 2.809 . . . . 0.0 107.834 -167.343 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 1.064 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.1 OUTLIER -77.51 107.55 10.04 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 110.453 -3.067 . . . . 0.0 109.524 -155.249 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.55 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.2 m-85 -76.07 140.96 42.14 Favored 'General case' 0 C--N 1.392 2.441 0 CA-C-N 112.315 -2.221 . . . . 0.0 107.905 -163.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.3 p -65.55 147.41 53.46 Favored 'General case' 0 C--N 1.381 1.964 0 N-CA-C 107.543 -1.281 . . . . 0.0 107.543 -166.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' P' ' 122' ' ' TYR . 33.7 ttmt -41.72 -36.24 0.95 Allowed 'General case' 0 C--N 1.381 1.957 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.283 -176.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.1 -68.75 0.16 Allowed 'General case' 0 C--N 1.382 2.013 0 CA-C-O 124.329 2.014 . . . . 0.0 109.14 173.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.552 ' CG ' HG13 ' P' ' 146' ' ' ILE . 78.8 mt-30 -46.79 -50.11 18.81 Favored 'General case' 0 C--N 1.383 2.056 0 CA-C-N 112.356 -2.202 . . . . 0.0 109.855 176.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.628 ' HA ' HD12 ' P' ' 124' ' ' LEU . 18.7 m -51.18 -55.92 15.44 Favored 'General case' 0 C--N 1.383 2.05 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 170.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.616 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 1.8 t80 -52.99 -46.38 68.29 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-O 122.34 1.067 . . . . 0.0 110.194 -171.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.691 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.3 OUTLIER -66.42 -39.5 88.99 Favored 'General case' 0 C--N 1.379 1.88 0 CA-C-N 114.455 -1.248 . . . . 0.0 107.759 179.494 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.856 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.7 mt -60.84 -49.11 78.8 Favored 'General case' 0 C--N 1.385 2.136 0 O-C-N 120.592 -1.317 . . . . 0.0 109.953 173.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' P' ' 129' ' ' ARG . 17.8 mt-10 -53.74 -55.37 26.87 Favored 'General case' 0 C--N 1.38 1.895 0 CA-C-O 122.354 1.073 . . . . 0.0 108.841 175.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.616 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -39.82 -66.56 0.29 Allowed 'General case' 0 C--N 1.38 1.904 0 CA-C-N 111.918 -2.401 . . . . 0.0 108.677 178.785 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.555 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.7 OUTLIER -61.09 -33.31 73.14 Favored 'General case' 0 C--N 1.394 2.503 0 CA-C-N 112.427 -2.17 . . . . 0.0 108.384 -173.416 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.727 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 13.8 t80 -67.5 -50.99 56.34 Favored 'General case' 0 C--N 1.387 2.23 0 O-C-N 121.195 -0.941 . . . . 0.0 110.29 174.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.493 ' HA ' ' NE ' ' P' ' 129' ' ' ARG . 0.1 OUTLIER -62.58 -12.56 23.59 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-N 112.916 -1.947 . . . . 0.0 108.158 -165.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . 0.423 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 38.7 mt-30 -108.62 -39.67 5.32 Favored 'General case' 0 C--N 1.38 1.909 0 C-N-CA 126.383 1.873 . . . . 0.0 108.251 -170.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.481 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -151.79 110.24 3.77 Favored 'General case' 0 C--N 1.389 2.297 0 CA-C-N 112.051 -2.34 . . . . 0.0 108.861 -153.237 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -76.78 -20.28 56.63 Favored 'General case' 0 C--N 1.392 2.441 0 CA-C-N 112.23 -2.259 . . . . 0.0 110.738 -168.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.411 ' CE1' ' CD ' ' P' ' 161' ' ' ARG . 33.0 m-85 -161.02 114.18 1.97 Allowed 'General case' 0 C--N 1.379 1.887 0 CA-C-N 113.812 -1.54 . . . . 0.0 108.298 -153.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.627 HD22 ' HG3' ' P' ' 138' ' ' GLU . 26.4 mt -124.91 137.04 54.29 Favored 'General case' 0 C--N 1.399 2.753 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -159.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.35 154.84 26.27 Favored 'General case' 0 C--N 1.381 1.95 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 166.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.513 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.68 -49.36 92.28 Favored Pre-proline 0 CA--C 1.583 2.242 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.248 -161.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.513 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 82.7 Cg_exo -58.05 -28.89 85.09 Favored 'Trans proline' 0 C--N 1.4 3.286 0 C-N-CA 121.183 1.255 . . . . 0.0 114.956 -174.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.627 ' HG3' HD22 ' P' ' 134' ' ' LEU . 1.4 mm-40 -54.04 -70.78 0.09 Allowed 'General case' 0 C--N 1.379 1.883 0 CA-C-O 124.786 2.231 . . . . 0.0 106.308 160.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.903 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -68.25 -40.47 81.93 Favored 'General case' 0 C--N 1.39 2.328 0 CA-C-N 109.88 -3.327 . . . . 0.0 108.794 -155.14 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.649 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 5.0 mt-10 -53.24 -38.24 62.8 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-O 123.125 1.441 . . . . 0.0 108.294 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -65.18 -35.6 81.6 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 112.955 -1.93 . . . . 0.0 108.728 -172.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.583 ' O ' HG23 ' P' ' 146' ' ' ILE . 2.9 tp -64.37 -43.14 95.44 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-O 123.277 1.513 . . . . 0.0 108.976 167.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.649 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.86 -34.61 67.99 Favored 'General case' 0 C--N 1.39 2.351 0 CA-C-N 112.29 -2.232 . . . . 0.0 108.613 176.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.59 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.9 OUTLIER -73.83 -44.04 56.89 Favored 'General case' 0 C--N 1.387 2.218 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.142 -179.587 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 74.7 mt -65.54 -46.75 78.33 Favored 'General case' 0 C--N 1.379 1.859 0 CA-C-O 124.866 2.27 . . . . 0.0 107.88 -163.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 1.029 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.99 -17.65 6.85 Favored 'Isoleucine or valine' 0 C--N 1.384 2.108 0 CA-C-N 110.435 -3.075 . . . . 0.0 107.664 -171.101 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 80.93 37.44 0.09 Allowed 'General case' 0 C--N 1.385 2.141 0 CA-C-N 111.397 -2.638 . . . . 0.0 108.158 152.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 1.029 HD12 HD11 ' P' ' 146' ' ' ILE . 6.0 mt -95.05 168.71 10.6 Favored 'General case' 0 C--N 1.39 2.336 0 CA-C-N 112.121 -2.308 . . . . 0.0 109.308 168.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.648 ' O ' ' N ' ' P' ' 152' ' ' GLN . 17.4 p -88.29 143.48 32.69 Favored Pre-proline 0 CA--C 1.587 2.375 0 CA-C-O 122.862 1.315 . . . . 0.0 108.137 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -59.84 -37.35 86.91 Favored 'Trans proline' 1 C--N 1.414 4.001 0 C-N-CA 122.634 2.223 . . . . 0.0 111.926 -155.743 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . 0.422 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.2 OUTLIER -56.69 -33.1 66.09 Favored 'General case' 0 C--N 1.386 2.174 0 C-N-CA 119.657 -0.817 . . . . 0.0 110.059 167.644 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.648 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.8 mt-30 -72.8 -26.97 61.7 Favored 'General case' 0 C--N 1.388 2.269 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.619 HG12 ' N ' ' P' ' 154' ' ' LYS . 0.9 OUTLIER -64.29 -69.78 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.384 2.084 0 CA-C-N 121.789 2.086 . . . . 0.0 109.229 164.39 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.903 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -35.55 -60.13 0.52 Allowed 'General case' 0 C--N 1.386 2.153 0 C-N-CA 125.194 1.398 . . . . 0.0 110.462 -176.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.667 HG21 " H5'" ' A' ' 8' ' ' ' DA' . 4.3 mm -58.95 -37.38 66.99 Favored 'Isoleucine or valine' 0 C--N 1.384 2.106 0 CA-C-N 112.889 -1.96 . . . . 0.0 110.841 -174.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.856 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.5 t90 -67.38 -32.17 72.91 Favored 'General case' 0 C--N 1.381 1.959 0 O-C-N 120.369 -1.457 . . . . 0.0 109.21 169.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.727 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 44.0 m-85 -75.51 -43.79 47.18 Favored 'General case' 0 C--O 1.276 2.497 0 O-C-N 120.713 -1.242 . . . . 0.0 111.823 175.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' P' ' 154' ' ' LYS . 46.3 mt-30 -50.68 -58.25 6.33 Favored 'General case' 0 C--N 1.377 1.784 0 O-C-N 118.994 -2.316 . . . . 0.0 107.292 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -54.93 -29.92 57.38 Favored 'General case' 0 C--N 1.39 2.345 0 CA-C-O 117.957 -1.02 . . . . 0.0 108.917 -169.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.552 ' HB3' ' CE1' ' P' ' 128' ' ' PHE . 3.4 t60 -77.58 -41.12 39.91 Favored 'General case' 0 C--O 1.285 2.972 0 CA-C-N 121.562 1.983 . . . . 0.0 111.667 -174.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.783 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -65.99 -42.38 89.85 Favored 'General case' 0 C--O 1.266 1.963 0 CA-C-N 122.995 2.634 . . . . 0.0 108.482 -170.715 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . 0.429 ' CE1' " H5'" ' B' ' 23' ' ' ' DA' . 40.6 t80 -66.47 -28.02 68.25 Favored 'General case' 0 C--N 1.381 1.962 0 O-C-N 119.957 -1.715 . . . . 0.0 110.109 171.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -65.63 -34.54 78.45 Favored 'General case' 0 C--N 1.382 1.986 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 -174.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.783 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.4 OUTLIER -70.38 -57.48 4.78 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 125.808 2.718 . . . . 0.0 105.576 -165.917 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.414 ' CD ' ' O ' ' P' ' 161' ' ' ARG . 8.8 mtpt -57.58 -45.42 85.25 Favored 'General case' 0 C--N 1.389 2.312 1 CA-C-N 108.368 -4.015 . . . . 0.0 108.903 -171.14 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . 0.408 ' HG2' HH11 ' P' ' 166' ' ' ARG . 0.0 OUTLIER -56.52 -40.59 75.31 Favored 'General case' 0 C--N 1.38 1.892 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.817 -178.351 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -61.69 -33.47 74.06 Favored 'General case' 0 C--N 1.384 2.072 0 CA-C-O 124.157 1.932 . . . . 0.0 109.319 -177.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -85.31 -18.33 34.2 Favored 'General case' 0 C--N 1.39 2.357 0 CA-C-N 112.119 -2.31 . . . . 0.0 109.744 -174.297 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -51.51 -32.06 26.25 Favored 'General case' 0 C--N 1.381 1.943 0 CA-C-O 122.98 1.372 . . . . 0.0 109.372 166.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -80.04 -31.65 39.51 Favored 'General case' 0 C--N 1.379 1.885 0 CA-C-N 112.719 -2.037 . . . . 0.0 107.946 -161.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 3.6 mttm -101.38 14.69 31.2 Favored 'General case' 0 C--N 1.38 1.924 0 CA-C-O 125.045 2.355 . . . . 0.0 110.691 -176.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . -151.55 65.39 0.36 Allowed Glycine 0 C--N 1.39 3.542 0 CA-C-N 110.254 -3.157 . . . . 0.0 108.734 152.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -47.34 143.77 3.24 Favored 'General case' 0 C--N 1.384 2.077 0 CA-C-O 124.259 1.981 . . . . 0.0 108.12 -176.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -148.9 97.08 2.66 Favored 'General case' 0 C--N 1.403 2.905 0 CA-C-N 111.188 -2.733 . . . . 0.0 107.586 -158.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -168.77 -99.29 0.13 Allowed Glycine 0 C--N 1.377 2.859 0 CA-C-N 122.833 2.56 . . . . 0.0 109.961 155.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 17.7 t60 -55.78 116.9 13.34 Favored Pre-proline 0 C--N 1.386 2.194 0 CA-C-N 113.12 -1.54 . . . . 0.0 107.252 -156.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo . . . . . 0 CA--C 1.593 3.459 0 C-N-CA 121.736 1.624 . . . . 0.0 111.627 179.746 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.564 3.638 0 O5'-C5'-C4' 114.322 2.944 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.772 " H2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.54 3.635 0 O4'-C4'-C3' 108.159 2.559 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.772 ' H72' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.569 4.12 1 P-O3'-C3' 130.652 9.127 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.561 ' C8 ' H2'' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.562 3.363 1 P-O3'-C3' 134.433 12.277 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.515 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.806 0 P-O3'-C3' 123.712 3.344 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.566 H2'' ' C8 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.918 0 N19-C1'-C2' 118.893 2.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 1.058 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.659 0 O4'-C4'-C3' 108.484 2.884 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 1.058 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.442 0 C4'-C3'-C2' 99.719 -3.481 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.714 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.669 0 C4'-C3'-C2' 99.849 -3.351 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.631 ' H71' " H2'" ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.842 1 P-O3'-C3' 125.255 4.629 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.533 H2'' ' C8 ' ' A' ' 12' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.345 0 P-O3'-C3' 122.863 2.636 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . 0.533 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.538 3.332 0 P-O3'-C3' 122.786 2.572 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.504 H2'' " H5'" ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.525 0 O4'-C4'-C3' 108.293 2.693 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.806 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.597 0 O4'-C4'-C3' 108.369 2.769 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.809 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.92 0 O4'-C1'-N19 110.969 3.962 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.809 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.547 0 P-O3'-C3' 124.452 3.96 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . 0.434 " H1'" " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.676 0 O5'-C5'-C4' 115.031 3.451 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.442 H2'' H5'' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.884 1 P-O3'-C3' 126.486 5.655 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.442 H5'' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.562 3.419 0 P-O3'-C3' 122.738 2.531 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.48 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.365 0 O4'-C4'-C3' 107.972 2.372 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.889 H2'' H5'' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.572 4.416 0 O4'-C1'-N19 105.093 -3.384 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.889 H5'' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C3'--C2' 1.561 4.28 1 P-O3'-C3' 127.538 6.531 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.568 ' OP2' ' HD1' ' P' ' 162' ' ' TYR . . . . . . . . 0 C5'--C4' 1.538 3.361 0 P-O3'-C3' 123.654 3.295 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.503 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.602 0 O4'-C4'-C3' 108.569 2.969 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.493 ' H73' ' C5 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.569 4.116 0 P-O3'-C3' 123.499 3.166 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.553 H2'' ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 2 C3'--C2' 1.56 4.22 0 N19-C1'-C2' 119.354 3.221 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.553 ' C8 ' H2'' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.554 3.649 0 P-O3'-C3' 123.506 3.172 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.545 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.452 0 C4'-C3'-C2' 100.716 -2.484 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.402 ' O2 ' ' N2 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.568 4.009 0 P-O3'-C3' 123.232 2.943 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.601 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.318 0 O4'-C4'-C3' 107.921 2.321 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.601 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.478 0 O4'-C4'-C3' 108.611 3.011 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.852 0 O4'-C1'-N19 109.364 1.955 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.487 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 2.9 p -132.68 162.06 32.36 Favored 'General case' 0 C--N 1.382 2.018 0 CA-C-N 113.675 -1.602 . . . . 0.0 108.653 -174.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 170.27 -38.37 0.0 OUTLIER 'General case' 0 C--N 1.388 2.272 0 CA-C-N 113.542 -1.663 . . . . 0.0 107.976 -171.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -174.09 -143.07 4.2 Favored Glycine 0 C--N 1.381 3.04 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -162.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.794 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.0 OUTLIER -131.5 174.8 4.27 Favored Pre-proline 0 CA--C 1.582 2.203 0 CA-C-N 113.69 -1.255 . . . . 0.0 108.738 175.328 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.794 ' HD2' HD13 ' P' ' 105' ' ' LEU . 59.1 Cg_exo -48.04 92.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.126 0 C-N-CA 122.986 2.457 . . . . 0.0 110.322 155.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.53 167.52 12.3 Favored 'General case' 0 C--N 1.382 1.981 0 CA-C-O 122.424 1.107 . . . . 0.0 109.13 158.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . 0.569 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -154.6 -48.12 0.09 Allowed 'General case' 0 C--N 1.383 2.031 0 CA-C-N 113.78 -1.554 . . . . 0.0 108.164 -166.666 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.55 ' C ' ' HD3' ' P' ' 110' ' ' ARG . 2.2 tptt -86.68 161.32 18.51 Favored 'General case' 0 C--N 1.379 1.891 0 CA-C-N 113.76 -1.564 . . . . 0.0 109.434 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.569 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.0 OUTLIER -143.43 108.04 4.85 Favored 'General case' 0 C--N 1.382 2.008 0 CA-C-N 113.72 -1.582 . . . . 0.0 108.656 -163.246 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.626 ' HG2' ' O ' ' P' ' 111' ' ' LYS . 0.1 OUTLIER -103.45 97.86 7.84 Favored 'General case' 0 C--N 1.381 1.957 0 CA-C-N 113.651 -1.613 . . . . 0.0 107.771 166.276 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 68.0 mtt85 -52.93 162.78 0.57 Allowed 'General case' 0 C--N 1.384 2.107 0 CA-C-N 113.25 -1.795 . . . . 0.0 108.664 155.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.949 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.6 OUTLIER -84.96 116.47 23.39 Favored 'General case' 0 C--N 1.384 2.104 0 CA-C-N 113.779 -1.555 . . . . 0.0 107.014 161.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.4 67.39 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.171 0 CA-C-O 125.555 2.597 . . . . 0.0 107.975 -161.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.949 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.08 108.44 8.99 Favored 'General case' 0 C--N 1.391 2.387 0 CA-C-N 111.534 -2.575 . . . . 0.0 109.378 -158.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.664 ' HD1' ' CD2' ' P' ' 148' ' ' LEU . 0.6 OUTLIER -76.57 144.98 39.29 Favored 'General case' 0 C--N 1.391 2.384 0 CA-C-N 112.593 -2.094 . . . . 0.0 107.8 -171.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.93 148.97 50.53 Favored 'General case' 0 C--N 1.383 2.024 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 -171.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' P' ' 122' ' ' TYR . 19.8 ttmt -33.21 -50.07 0.28 Allowed 'General case' 0 C--N 1.383 2.063 0 O-C-N 126.883 2.614 . . . . 0.0 108.268 174.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -49.66 -58.11 5.92 Favored 'General case' 0 C--N 1.385 2.109 0 CA-C-N 111.424 -2.625 . . . . 0.0 109.165 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.542 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.7 mt-30 -59.83 -46.57 88.83 Favored 'General case' 0 C--N 1.381 1.969 0 CA-C-N 112.434 -2.166 . . . . 0.0 109.464 -178.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.575 ' HA ' HD12 ' P' ' 124' ' ' LEU . 3.3 m -47.64 -57.6 5.29 Favored 'General case' 0 C--N 1.386 2.155 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 166.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.667 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.8 OUTLIER -53.34 -48.52 68.44 Favored 'General case' 0 C--N 1.382 1.997 0 CA-C-O 122.587 1.184 . . . . 0.0 109.904 -167.573 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.703 ' CG ' HG22 ' P' ' 146' ' ' ILE . 0.6 OUTLIER -66.2 -37.95 86.79 Favored 'General case' 0 C--N 1.378 1.83 0 CA-C-N 114.032 -1.44 . . . . 0.0 107.856 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.81 HD22 ' HB3' ' P' ' 156' ' ' TRP . 2.0 mt -60.7 -50.88 71.69 Favored 'General case' 0 C--N 1.384 2.105 0 O-C-N 120.52 -1.362 . . . . 0.0 109.604 171.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' P' ' 129' ' ' ARG . 9.3 mt-10 -55.47 -50.18 70.57 Favored 'General case' 0 C--N 1.381 1.968 0 CA-C-O 122.418 1.104 . . . . 0.0 109.48 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.667 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.65 -69.79 0.12 Allowed 'General case' 0 C--N 1.378 1.845 0 CA-C-N 111.872 -2.422 . . . . 0.0 108.719 176.211 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.724 ' CD ' HD11 ' P' ' 134' ' ' LEU . 0.5 OUTLIER -59.31 -36.0 74.83 Favored 'General case' 0 C--N 1.391 2.373 0 CA-C-N 112.778 -2.01 . . . . 0.0 108.343 -171.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.813 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 25.7 t80 -70.31 -46.92 63.27 Favored 'General case' 0 C--N 1.381 1.966 0 CA-C-N 119.148 0.886 . . . . 0.0 110.338 178.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' P' ' 125' ' ' GLU . 4.5 mmp_? -62.51 -15.95 53.15 Favored 'General case' 0 C--N 1.381 1.937 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -168.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -104.51 -39.44 6.41 Favored 'General case' 0 C--N 1.379 1.878 0 C-N-CA 126.592 1.957 . . . . 0.0 107.383 -169.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.503 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -156.21 98.71 1.88 Allowed 'General case' 0 C--N 1.388 2.24 0 CA-C-N 111.759 -2.473 . . . . 0.0 109.223 -153.5 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . 0.519 ' NH1' ' CE2' ' P' ' 133' ' ' TYR . 0.4 OUTLIER -77.32 -11.79 59.88 Favored 'General case' 0 C--N 1.388 2.257 0 CA-C-N 111.784 -2.462 . . . . 0.0 110.466 -164.845 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.677 ' HE1' ' CD ' ' P' ' 161' ' ' ARG . 3.4 m-30 -154.12 110.81 3.34 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.362 -162.161 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.724 HD11 ' CD ' ' P' ' 127' ' ' ARG . 19.5 mt -121.33 140.01 52.66 Favored 'General case' 0 C--N 1.396 2.63 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -162.413 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.46 160.56 23.95 Favored 'General case' 0 C--N 1.382 1.983 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 164.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.558 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.35 -51.63 80.42 Favored Pre-proline 0 CA--C 1.585 2.312 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -166.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 71.4 Cg_exo -58.16 -29.99 89.1 Favored 'Trans proline' 0 C--N 1.399 3.229 0 N-CA-C 115.387 1.264 . . . . 0.0 115.387 -172.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.629 ' CB ' HD22 ' P' ' 134' ' ' LEU . 15.7 mp0 -58.72 -66.18 0.54 Allowed 'General case' 0 C--N 1.381 1.942 0 CA-C-O 124.866 2.27 . . . . 0.0 105.468 163.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.765 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -67.64 -41.66 83.53 Favored 'General case' 0 C--N 1.391 2.382 0 CA-C-N 109.659 -3.428 . . . . 0.0 108.71 -153.797 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.611 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 0.7 OUTLIER -53.19 -38.05 62.49 Favored 'General case' 0 C--N 1.381 1.94 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.915 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -65.39 -39.08 91.78 Favored 'General case' 0 C--N 1.38 1.916 0 CA-C-N 113.226 -1.807 . . . . 0.0 109.051 -172.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.63 ' O ' HG23 ' P' ' 146' ' ' ILE . 0.5 OUTLIER -55.57 -46.21 77.23 Favored 'General case' 0 C--N 1.387 2.212 0 CA-C-O 123.256 1.503 . . . . 0.0 108.515 167.447 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.611 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -63.44 -35.69 81.27 Favored 'General case' 0 C--N 1.387 2.23 0 CA-C-N 111.738 -2.483 . . . . 0.0 108.967 -178.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.579 ' N ' ' O ' ' P' ' 140' ' ' GLU . 4.0 m -73.37 -37.6 65.98 Favored 'General case' 0 C--N 1.387 2.217 0 CA-C-N 114.087 -1.415 . . . . 0.0 109.651 -176.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 37.7 mt -67.3 -49.05 65.77 Favored 'General case' 0 C--N 1.382 1.995 0 CA-C-O 124.492 2.092 . . . . 0.0 108.694 -167.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.974 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -95.43 -13.54 8.21 Favored 'Isoleucine or valine' 0 C--N 1.389 2.308 0 CA-C-N 110.943 -2.844 . . . . 0.0 108.031 -167.649 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' P' ' 147' ' ' ARG . 0.0 OUTLIER 82.41 35.62 0.07 Allowed 'General case' 0 C--N 1.382 2.019 0 CA-C-O 125.853 2.74 . . . . 0.0 107.668 153.549 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.974 HD12 HD11 ' P' ' 146' ' ' ILE . 7.6 mt -95.95 172.44 8.01 Favored 'General case' 0 C--N 1.396 2.63 0 CA-C-N 111.472 -2.604 . . . . 0.0 109.352 166.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.565 ' O ' ' N ' ' P' ' 152' ' ' GLN . 18.9 p -89.09 143.59 31.4 Favored Pre-proline 0 CA--C 1.586 2.333 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 167.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.594 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 72.4 Cg_exo -51.4 -46.05 33.76 Favored 'Trans proline' 0 C--N 1.408 3.689 0 C-N-CA 124.252 3.301 . . . . 0.0 114.673 -165.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.71 -33.69 48.92 Favored 'General case' 0 C--N 1.389 2.324 0 CA-C-N 112.163 -2.29 . . . . 0.0 109.507 170.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.565 ' N ' ' O ' ' P' ' 149' ' ' THR . 48.1 mt-30 -72.5 -28.27 62.77 Favored 'General case' 0 C--N 1.392 2.43 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.73 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.2 t -64.61 -71.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.383 2.026 0 CA-C-N 121.798 2.09 . . . . 0.0 109.814 163.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.765 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -33.23 -57.78 0.4 Allowed 'General case' 0 C--N 1.388 2.254 0 C-N-CA 124.466 1.106 . . . . 0.0 110.364 -177.581 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.532 HG21 " H5'" ' A' ' 8' ' ' ' DA' . 9.9 mm -59.89 -40.22 82.21 Favored 'Isoleucine or valine' 0 C--N 1.382 1.995 0 CA-C-N 113.311 -1.768 . . . . 0.0 109.47 -173.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.81 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.3 t90 -67.45 -31.33 71.43 Favored 'General case' 0 C--N 1.381 1.965 0 O-C-N 121.182 -0.949 . . . . 0.0 109.231 172.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.813 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 66.3 m-85 -74.65 -40.19 61.61 Favored 'General case' 0 C--O 1.273 2.34 0 O-C-N 121.526 -0.734 . . . . 0.0 111.956 173.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.451 ' N ' ' O ' ' P' ' 154' ' ' LYS . 23.8 mt-30 -49.86 -63.62 1.06 Allowed 'General case' 0 C--N 1.378 1.823 0 O-C-N 119.47 -2.018 . . . . 0.0 106.821 167.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -56.7 -19.29 15.84 Favored 'General case' 0 C--N 1.388 2.28 0 CA-C-O 117.907 -1.044 . . . . 0.0 110.446 -164.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.528 ' ND1' ' CZ ' ' P' ' 128' ' ' PHE . 14.7 t-80 -76.48 -52.51 9.67 Favored 'General case' 0 C--O 1.279 2.639 0 CA-C-N 120.743 1.61 . . . . 0.0 111.084 171.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.677 ' CD ' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -66.52 -36.31 82.39 Favored 'General case' 0 C--O 1.266 1.921 0 CA-C-N 122.535 2.425 . . . . 0.0 111.06 -158.726 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . 0.568 ' HD1' ' OP2' ' B' ' 23' ' ' ' DA' . 21.9 t80 -68.51 -36.15 78.49 Favored 'General case' 0 C--N 1.38 1.934 0 O-C-N 120.022 -1.674 . . . . 0.0 109.381 174.161 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -65.75 -42.92 90.35 Favored 'General case' 0 C--N 1.381 1.957 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -170.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.593 ' O ' ' HB3' ' P' ' 167' ' ' ALA . 0.5 OUTLIER -57.09 -60.34 3.75 Favored 'General case' 0 C--N 1.379 1.87 0 CA-C-O 124.534 2.112 . . . . 0.0 106.7 -170.142 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.417 ' HG2' HG23 ' P' ' 164' ' ' THR . 9.1 mmmt -59.45 -49.61 77.12 Favored 'General case' 0 C--N 1.385 2.121 0 CA-C-N 108.499 -3.955 . . . . 0.0 109.256 -165.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . 0.456 ' HB2' ' CE1' ' P' ' 162' ' ' TYR . 0.0 OUTLIER -58.77 -29.26 66.65 Favored 'General case' 0 C--N 1.382 2.007 0 CA-C-N 112.221 -2.263 . . . . 0.0 108.152 -178.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.593 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -67.6 -35.88 79.8 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.079 -176.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.68 -19.86 44.25 Favored 'General case' 0 C--N 1.387 2.224 0 CA-C-N 112.208 -2.269 . . . . 0.0 109.204 -173.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.1 -32.78 71.3 Favored 'General case' 0 C--N 1.382 1.98 0 CA-C-O 122.717 1.246 . . . . 0.0 108.799 169.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -64.09 -35.85 82.1 Favored 'General case' 0 C--N 1.385 2.142 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.88 -169.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -96.19 93.16 6.76 Favored 'General case' 0 C--N 1.381 1.961 0 CA-C-N 113.638 -1.619 . . . . 0.0 109.388 -162.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 121.05 -49.15 0.9 Allowed Glycine 0 C--N 1.382 3.119 0 N-CA-C 108.737 -1.745 . . . . 0.0 108.737 -161.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 119.04 172.77 0.0 OUTLIER 'General case' 0 C--N 1.382 2.004 0 CA-C-N 113.011 -1.594 . . . . 0.0 108.834 161.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -82.84 67.76 9.04 Favored 'General case' 0 C--N 1.38 1.929 0 CA-C-N 112.343 -2.208 . . . . 0.0 109.015 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 80.08 135.46 1.4 Allowed Glycine 0 C--N 1.384 3.223 0 O-C-N 120.065 -1.647 . . . . 0.0 109.954 155.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 44.4 p-80 -128.55 141.93 43.14 Favored Pre-proline 0 C--N 1.385 2.133 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 -165.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo . . . . . 0 CA--C 1.594 3.496 0 C-N-CA 121.518 1.479 . . . . 0.0 111.535 174.582 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.566 3.794 0 O5'-C5'-C4' 114.374 2.982 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.721 ' N1 ' ' N3 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.334 0 O4'-C4'-C3' 108.378 2.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.556 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.861 0 P-O3'-C3' 123.038 2.781 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.617 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.305 0 P-O3'-C3' 123.245 2.954 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.589 ' H73' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.838 0 N19-C1'-C2' 118.359 2.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.533 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.039 0 N19-C1'-C2' 118.729 2.831 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.916 H2'' H5'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.552 1 P-O3'-C3' 124.861 4.301 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.916 H5'' H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.448 0 C4'-C3'-C2' 100.233 -2.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.8 " C5'" H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.405 0 P-O3'-C3' 123.379 3.065 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.591 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.927 1 P-O3'-C3' 127.172 6.226 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.486 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.356 0 P-O3'-C3' 123.204 2.92 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . 0.473 H2'' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.354 0 P-O3'-C3' 122.704 2.503 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.861 " H2'" ' H71' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.561 0 O4'-C4'-C3' 108.418 2.818 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.861 ' H71' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.564 3.565 0 O4'-C4'-C3' 108.209 2.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.942 " C2'" ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.926 1 O4'-C1'-N19 111.301 4.376 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.942 ' H71' " C2'" ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.516 0 P-O3'-C3' 122.217 2.098 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.764 0 O5'-C5'-C4' 115.045 3.461 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.534 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.595 1 P-O3'-C3' 125.11 4.509 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.534 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.417 0 O4'-C4'-C3' 108.211 2.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.552 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.409 0 O4'-C4'-C3' 108.042 2.442 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.552 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.571 4.336 0 N19-C1'-C2' 119.289 3.181 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.468 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.555 3.714 1 P-O3'-C3' 126.925 6.021 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.486 ' C2 ' ' C2 ' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.528 1 P-O3'-C3' 128.413 7.261 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.51 " C2'" " H5'" ' B' ' 25' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.563 3.477 0 O4'-C4'-C3' 108.228 2.628 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.631 ' C2 ' ' C4 ' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.802 0 O4'-C4'-C3' 107.992 2.392 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.631 ' C4 ' ' C2 ' ' B' ' 25' ' ' ' DT' . . . . . . . . 1 C3'--C2' 1.558 4.029 0 P-O3'-C3' 124.126 3.689 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.633 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.58 1 P-O3'-C3' 127.689 6.658 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.633 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.562 3.43 0 C4'-C3'-C2' 100.593 -2.607 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.617 ' C2 ' ' C2 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.922 0 O4'-C4'-C3' 108.602 3.002 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.598 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.366 1 P-O3'-C3' 127.822 6.768 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.721 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.587 0 O4'-C4'-C3' 108.218 2.618 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.933 0 O4'-C1'-N19 109.333 1.916 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.528 3.449 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 11.3 p -151.94 138.53 18.71 Favored 'General case' 0 C--N 1.382 1.994 0 CA-C-N 113.647 -1.615 . . . . 0.0 108.605 -170.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 170.64 -38.34 0.0 OUTLIER 'General case' 0 C--N 1.388 2.267 0 CA-C-N 113.531 -1.668 . . . . 0.0 108.037 172.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -121.48 66.77 0.45 Allowed Glycine 0 C--N 1.381 3.073 0 N-CA-C 108.914 -1.674 . . . . 0.0 108.914 -162.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 1.115 HD22 ' HD3' ' P' ' 106' ' ' PRO . 0.3 OUTLIER -173.84 172.29 1.43 Allowed Pre-proline 0 CA--C 1.583 2.231 0 CA-C-N 113.71 -1.245 . . . . 0.0 108.861 170.078 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 1.115 ' HD3' HD22 ' P' ' 105' ' ' LEU . 2.4 Cg_endo -83.49 73.06 5.31 Favored 'Trans proline' 0 C--N 1.395 3.008 0 C-N-CA 124.817 3.678 . . . . 0.0 111.2 -153.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 70.51 155.19 0.14 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-N 114.678 -1.147 . . . . 0.0 109.191 -170.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.88 68.04 0.76 Allowed 'General case' 0 C--N 1.382 2.01 0 CA-C-N 113.692 -1.594 . . . . 0.0 108.135 175.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.616 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 11.4 tttt -65.93 150.51 48.51 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-N 113.685 -1.598 . . . . 0.0 109.92 -171.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.616 ' HD3' ' O ' ' P' ' 109' ' ' LYS . 2.0 mmt85 -144.57 67.88 1.25 Allowed 'General case' 0 C--N 1.384 2.099 0 CA-C-N 113.666 -1.606 . . . . 0.0 109.555 -170.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.876 ' HD2' " H1'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -80.5 87.86 5.68 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-O 123.587 1.66 . . . . 0.0 108.073 163.365 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -81.32 -175.93 5.73 Favored 'General case' 0 C--N 1.39 2.361 0 CA-C-N 111.789 -2.46 . . . . 0.0 108.814 159.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 1.144 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.0 OUTLIER -76.07 108.01 8.67 Favored 'General case' 0 C--N 1.389 2.319 0 N-CA-C 105.426 -2.064 . . . . 0.0 105.426 156.021 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.805 HG11 ' P ' ' A' ' 8' ' ' ' DA' . 0.8 OUTLIER -96.73 42.37 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.384 2.074 0 CA-C-O 126.649 3.119 . . . . 0.0 109.234 -159.072 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 1.144 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.1 OUTLIER -79.69 118.28 21.37 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 111.891 -2.413 . . . . 0.0 109.651 -155.52 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.496 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 3.2 m-85 -93.37 143.57 26.15 Favored 'General case' 0 C--N 1.382 1.985 0 CA-C-N 113.754 -1.566 . . . . 0.0 107.986 -173.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.24 148.11 52.32 Favored 'General case' 0 C--N 1.383 2.035 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 -171.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' P' ' 122' ' ' TYR . 34.4 ttmt -42.71 -36.09 1.33 Allowed 'General case' 0 C--N 1.382 2.003 0 CA-C-N 113.923 -1.489 . . . . 0.0 109.446 -177.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.87 -67.8 0.23 Allowed 'General case' 0 C--N 1.382 1.988 0 CA-C-N 113.148 -1.842 . . . . 0.0 109.161 173.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.561 ' CG ' HG13 ' P' ' 146' ' ' ILE . 80.2 mt-30 -49.9 -50.77 44.83 Favored 'General case' 0 C--N 1.382 1.986 0 CA-C-N 112.437 -2.165 . . . . 0.0 109.399 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.761 ' HA ' HD12 ' P' ' 124' ' ' LEU . 21.5 m -49.75 -56.86 8.68 Favored 'General case' 0 C--N 1.382 1.994 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 170.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.544 ' CZ ' ' CZ ' ' P' ' 126' ' ' ARG . 1.0 OUTLIER -53.23 -45.51 68.74 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 122.29 1.043 . . . . 0.0 109.74 -170.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.968 ' CD ' HG22 ' P' ' 146' ' ' ILE . 6.9 mt-10 -66.9 -38.56 86.48 Favored 'General case' 0 C--N 1.379 1.853 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.607 178.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.829 HD22 ' HB3' ' P' ' 156' ' ' TRP . 1.4 mt -60.71 -50.01 75.22 Favored 'General case' 0 C--N 1.382 2.005 0 O-C-N 119.62 -1.925 . . . . 0.0 109.9 171.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' P' ' 129' ' ' ARG . 20.1 mt-10 -55.75 -52.18 64.8 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-O 122.613 1.197 . . . . 0.0 109.55 177.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.544 ' CZ ' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -40.38 -60.18 1.15 Allowed 'General case' 0 C--N 1.38 1.898 0 CA-C-N 112.128 -2.305 . . . . 0.0 109.362 176.032 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.817 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.1 OUTLIER -70.5 -32.04 69.38 Favored 'General case' 0 C--N 1.397 2.638 0 CA-C-N 112.274 -2.239 . . . . 0.0 108.343 -167.097 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.765 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 6.3 t80 -67.94 -53.04 29.36 Favored 'General case' 0 C--N 1.384 2.072 0 CA-C-O 121.832 0.825 . . . . 0.0 109.397 170.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.411 ' N ' ' O ' ' P' ' 125' ' ' GLU . 19.6 mmm180 -62.72 -17.77 61.35 Favored 'General case' 0 C--N 1.379 1.888 0 CA-C-N 113.213 -1.812 . . . . 0.0 108.239 -163.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . 0.42 ' NE2' ' HB3' ' P' ' 126' ' ' ARG . 35.9 mt-30 -88.22 -51.68 5.63 Favored 'General case' 0 C--N 1.379 1.882 0 CA-C-O 123.811 1.767 . . . . 0.0 106.482 -179.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.31 125.5 4.43 Favored 'General case' 0 C--N 1.394 2.522 0 CA-C-N 112.19 -2.277 . . . . 0.0 110.843 -168.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . 0.657 ' O ' ' HD1' ' P' ' 133' ' ' TYR . 3.7 ptt-85 -80.02 -6.52 57.74 Favored 'General case' 0 C--N 1.393 2.47 0 CA-C-N 111.774 -2.467 . . . . 0.0 111.318 -160.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.723 ' HE1' ' HD3' ' P' ' 161' ' ' ARG . 3.0 m-30 -148.27 115.01 6.03 Favored 'General case' 0 C--N 1.381 1.951 0 CA-C-O 125.297 2.475 . . . . 0.0 109.768 -161.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.553 HD22 ' HG3' ' P' ' 138' ' ' GLU . 67.2 mt -125.3 133.91 52.45 Favored 'General case' 0 C--N 1.415 3.425 0 O-C-N 119.851 -1.781 . . . . 0.0 108.826 -162.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.33 158.2 21.24 Favored 'General case' 0 C--N 1.381 1.978 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 168.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.575 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -59.15 -50.36 88.17 Favored Pre-proline 0 CA--C 1.584 2.285 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -161.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 77.7 Cg_exo -58.66 -28.86 87.61 Favored 'Trans proline' 0 C--N 1.401 3.338 0 N-CA-C 115.185 1.186 . . . . 0.0 115.185 -175.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.553 ' HG3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -53.45 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.379 1.864 0 CA-C-O 124.295 1.997 . . . . 0.0 106.483 159.895 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 1.028 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.51 -34.87 74.93 Favored 'General case' 0 C--N 1.387 2.226 0 CA-C-N 109.919 -3.31 . . . . 0.0 109.159 -155.124 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.651 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 2.7 mt-10 -52.42 -42.94 64.52 Favored 'General case' 0 C--N 1.379 1.881 0 CA-C-O 123.493 1.616 . . . . 0.0 108.137 175.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -64.76 -35.67 81.82 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 112.501 -2.136 . . . . 0.0 108.97 -169.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.817 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.1 tp -65.91 -43.03 89.36 Favored 'General case' 0 C--N 1.382 1.998 0 CA-C-O 123.201 1.477 . . . . 0.0 109.163 168.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -55.34 -35.82 65.62 Favored 'General case' 0 C--N 1.389 2.292 0 CA-C-N 112.61 -2.086 . . . . 0.0 108.036 174.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.581 ' N ' ' O ' ' P' ' 140' ' ' GLU . 0.7 OUTLIER -72.43 -43.17 64.2 Favored 'General case' 0 C--N 1.389 2.29 0 CA-C-N 113.762 -1.563 . . . . 0.0 110.407 -178.113 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 81.3 mt -66.11 -44.87 83.05 Favored 'General case' 0 C--N 1.379 1.89 0 CA-C-O 124.838 2.256 . . . . 0.0 108.301 -164.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 1.01 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -98.83 -13.42 8.09 Favored 'Isoleucine or valine' 0 C--N 1.39 2.344 0 CA-C-N 110.905 -2.861 . . . . 0.0 108.064 -166.249 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 81.8 34.98 0.08 Allowed 'General case' 0 C--N 1.381 1.975 0 CA-C-O 125.586 2.612 . . . . 0.0 107.946 153.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 1.01 HD12 HD11 ' P' ' 146' ' ' ILE . 8.6 mt -95.63 172.36 8.1 Favored 'General case' 0 C--N 1.396 2.593 0 CA-C-N 111.47 -2.605 . . . . 0.0 109.078 167.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.586 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.1 p -91.27 141.53 26.29 Favored Pre-proline 0 CA--C 1.589 2.454 0 CA-C-O 122.795 1.283 . . . . 0.0 108.264 166.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.538 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 0.3 OUTLIER -48.21 -46.99 20.94 Favored 'Trans proline' 0 C--N 1.403 3.429 0 C-N-CA 124.934 3.756 . . . . 0.0 115.404 -167.289 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . 0.465 ' HA ' ' HB2' ' P' ' 154' ' ' LYS . 0.3 OUTLIER -52.85 -30.55 34.39 Favored 'General case' 0 C--N 1.383 2.065 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.112 169.278 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.586 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.3 mt-30 -73.87 -30.58 62.72 Favored 'General case' 0 C--N 1.391 2.401 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 179.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.696 HG13 ' CD2' ' P' ' 157' ' ' PHE . 0.9 OUTLIER -64.07 -67.05 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.382 2.018 0 CA-C-N 122.011 2.187 . . . . 0.0 109.743 165.803 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 1.028 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -32.93 -60.08 0.33 Allowed 'General case' 0 C--N 1.387 2.201 0 C-N-CA 124.615 1.166 . . . . 0.0 110.845 -177.254 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.697 HG21 " C5'" ' A' ' 8' ' ' ' DA' . 37.5 mm -64.78 -34.94 73.5 Favored 'Isoleucine or valine' 0 C--N 1.382 2.01 0 CA-C-N 112.794 -2.003 . . . . 0.0 108.756 -169.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.829 ' HB3' HD22 ' P' ' 124' ' ' LEU . 6.1 t90 -67.47 -33.07 74.37 Favored 'General case' 0 C--N 1.384 2.109 0 O-C-N 121.691 -0.631 . . . . 0.0 109.353 168.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.765 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 39.2 m-85 -74.89 -41.71 59.24 Favored 'General case' 0 C--O 1.272 2.272 0 O-C-N 120.966 -1.084 . . . . 0.0 111.94 174.599 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' P' ' 154' ' ' LYS . 77.3 mt-30 -50.98 -59.8 3.77 Favored 'General case' 0 C--N 1.377 1.77 0 O-C-N 119.785 -1.822 . . . . 0.0 106.703 170.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -56.5 -20.28 19.57 Favored 'General case' 0 C--N 1.389 2.314 0 CA-C-O 117.409 -1.281 . . . . 0.0 110.333 -168.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.561 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 0.5 OUTLIER -76.39 -50.35 14.42 Favored 'General case' 0 C--O 1.282 2.816 0 CA-C-N 121.2 1.818 . . . . 0.0 110.313 174.666 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.723 ' HD3' ' HE1' ' P' ' 133' ' ' TYR . 0.0 OUTLIER -67.5 -34.13 76.5 Favored 'General case' 0 C--O 1.267 2.019 0 CA-C-N 122.784 2.538 . . . . 0.0 111.166 -158.431 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -69.02 -40.21 78.79 Favored 'General case' 0 C--N 1.381 1.935 0 O-C-N 119.89 -1.756 . . . . 0.0 109.104 171.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -37.98 89.41 Favored 'General case' 0 C--N 1.382 1.997 0 O-C-N 121.322 -0.862 . . . . 0.0 109.016 -166.051 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.569 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -51.59 -61.74 2.06 Favored 'General case' 0 C--N 1.379 1.86 0 CA-C-O 124.699 2.19 . . . . 0.0 106.729 -175.715 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.504 ' HG2' HG23 ' P' ' 164' ' ' THR . 6.0 mmmt -59.15 -47.62 84.61 Favored 'General case' 0 C--N 1.385 2.143 1 CA-C-N 108.361 -4.018 . . . . 0.0 108.085 -159.322 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -54.67 -42.55 71.51 Favored 'General case' 0 C--N 1.381 1.938 0 CA-C-N 112.475 -2.148 . . . . 0.0 109.336 -178.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . . . . . . . . . . . -63.41 -30.66 71.75 Favored 'General case' 0 C--N 1.384 2.068 0 CA-C-O 124.464 2.078 . . . . 0.0 109.322 -175.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.81 -21.91 31.97 Favored 'General case' 0 C--N 1.393 2.461 0 CA-C-N 112.344 -2.207 . . . . 0.0 110.074 -176.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -52.93 -32.53 46.17 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-O 123.944 1.831 . . . . 0.0 109.94 167.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -78.97 -33.68 44.94 Favored 'General case' 0 C--N 1.381 1.939 0 CA-C-N 112.141 -2.3 . . . . 0.0 107.466 -155.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.31 87.37 0.83 Allowed 'General case' 0 C--N 1.382 1.984 0 CA-C-N 113.506 -1.679 . . . . 0.0 108.916 -160.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . 0.463 ' C ' ' CG ' ' P' ' 173' ' ' TYR . . . 110.14 -93.2 0.73 Allowed Glycine 0 C--N 1.382 3.094 0 N-CA-C 108.607 -1.797 . . . . 0.0 108.607 -154.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . 0.463 ' CG ' ' C ' ' P' ' 172' ' ' GLY . 0.0 OUTLIER 176.89 144.1 0.09 Allowed 'General case' 0 C--N 1.382 2.001 0 CA-C-N 113.464 -1.368 . . . . 0.0 109.289 -177.555 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -166.29 157.96 13.57 Favored 'General case' 0 C--N 1.386 2.163 0 CA-C-N 113.282 -1.781 . . . . 0.0 107.299 155.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 122.47 -98.51 0.63 Allowed Glycine 0 C--N 1.381 3.051 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 -154.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.99 160.63 0.47 Allowed Pre-proline 0 CA--C 1.58 2.12 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 178.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_exo . . . . . 0 CA--C 1.594 3.516 0 C-N-CA 121.512 1.475 . . . . 0.0 111.59 175.444 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . 0.4 ' H72' ' O6 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.561 3.328 0 O5'-C5'-C4' 115.303 3.645 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.556 " C2'" ' H72' ' A' ' 3' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.546 4.426 0 O5'-C5'-C4' 115.434 3.739 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.638 ' O4 ' ' N6 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.04 0 O5'-C5'-C4' 114.508 3.077 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.638 ' N2 ' ' O2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.548 4.644 0 O5'-C5'-C4' 115.157 3.54 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.461 H2'' ' C6 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.543 4.056 0 P-O3'-C3' 123.878 3.482 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.579 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.543 3.994 0 C3'-C2'-C1' 107.278 3.27 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.579 ' C6 ' ' C5 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 2 C5'--C4' 1.547 4.456 0 P-O3'-C3' 123.918 3.515 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.75 " C4'" ' HD2' ' P' ' 111' ' ' LYS . . . . . . . . 1 C5'--C4' 1.55 4.826 1 P-O3'-C3' 124.768 4.223 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.609 " O5'" H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.549 4.743 0 O5'-C5'-C4' 115.734 3.953 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.597 ' C2 ' ' C2 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 2 C5'--C4' 1.544 4.066 0 P-O3'-C3' 123.622 3.268 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.509 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.549 4.794 2 P-O3'-C3' 129.151 7.876 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.547 4.544 0 O5'-C5'-C4' 115.441 3.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.501 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.546 4.39 0 O5'-C5'-C4' 114.5 3.071 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.501 ' C4 ' ' N3 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 2 C5'--C4' 1.545 4.246 0 C4'-C3'-C2' 100.322 -2.878 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.61 ' C5 ' ' H72' ' A' ' 16' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.554 5.317 1 O4'-C1'-N19 112.369 5.712 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.61 ' H72' ' C5 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.572 4.355 0 P-O3'-C3' 124.25 3.792 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.807 1 O5'-C5'-C4' 115.875 4.054 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.538 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.547 4.5 0 O4'-C4'-C3' 108.66 3.06 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.538 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.547 4.521 0 O5'-C5'-C4' 114.74 3.243 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.47 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.547 4.512 0 O5'-C5'-C4' 115.379 3.699 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.6 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.57 4.163 0 O5'-C5'-C4' 115.444 3.746 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.6 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.547 4.463 0 O5'-C5'-C4' 114.417 3.012 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.596 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.546 4.392 0 O5'-C5'-C4' 115.289 3.635 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.596 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.548 4.63 0 O5'-C5'-C4' 114.676 3.197 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.532 " C5'" H2'' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.216 0 O5'-C5'-C4' 115.786 3.99 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.513 ' C4 ' ' C6 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C4'--C3' 1.569 4.097 0 O5'-C5'-C4' 114.738 3.242 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.603 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.546 4.355 0 O5'-C5'-C4' 115.429 3.735 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.603 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.547 4.497 0 C4'-C3'-C2' 99.618 -3.582 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.638 ' O2 ' ' N2 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 2 C5'--C4' 1.546 4.431 0 P-O3'-C3' 123.637 3.28 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.638 ' N6 ' ' O4 ' ' A' ' 3' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.547 4.529 0 O5'-C5'-C4' 114.83 3.307 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.502 ' N3 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.547 4.542 0 O4'-C4'-C3' 108.657 3.057 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.371 0 O4'-C1'-N19 110.551 3.439 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.511 -0.555 0 CA-C-O 121.779 0.8 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.92 167.17 13.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.733 0.777 . . . . 0.0 110.957 -173.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 9.9 p30 168.36 -22.45 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.11 -171.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . 0.489 ' O ' HD13 ' P' ' 105' ' ' LEU . . . -88.9 -59.9 1.55 Allowed Glycine 0 N--CA 1.464 0.536 0 N-CA-C 110.83 -0.908 . . . . 0.0 110.83 171.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.489 HD13 ' O ' ' P' ' 104' ' ' GLY . 1.2 mm? -143.27 148.48 44.63 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-O 122.168 0.985 . . . . 0.0 111.06 -173.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -86.02 50.92 2.62 Favored 'Trans proline' 0 N--CA 1.526 3.44 1 C-N-CA 127.7 5.6 . . . . 0.0 115.26 178.197 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . 0.567 ' O ' ' HG3' ' P' ' 108' ' ' LYS . 0.0 OUTLIER 53.96 -169.38 0.06 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.836 0.827 . . . . 0.0 110.98 -179.558 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . 0.794 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -158.31 36.91 0.24 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.676 0.751 . . . . 0.0 111.157 179.419 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.708 ' HG3' ' N ' ' P' ' 110' ' ' ARG . 3.5 tptm -67.72 160.85 27.25 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.667 0.746 . . . . 0.0 111.86 171.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.794 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.3 OUTLIER -129.97 -149.93 0.42 Allowed 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 122.333 1.063 . . . . 0.0 109.088 -171.733 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.75 ' HD2' " C4'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -105.21 87.66 2.68 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.557 -177.047 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . 0.451 ' NH1' ' CD ' ' P' ' 109' ' ' LYS . 56.4 mtt85 -68.83 -158.33 0.02 OUTLIER 'General case' 0 C--O 1.245 0.852 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.175 169.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.981 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.1 OUTLIER -105.72 116.5 32.05 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.039 0.923 . . . . 0.0 110.396 170.148 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.418 ' CG2' ' OP2' ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -97.85 82.46 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 122.725 1.25 . . . . 0.0 110.105 -175.608 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.981 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -88.74 112.42 23.14 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.663 -169.448 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.677 ' CD1' HD22 ' P' ' 148' ' ' LEU . 0.9 OUTLIER -78.92 150.85 32.0 Favored 'General case' 0 C--O 1.272 2.268 0 CA-C-O 118.215 -0.898 . . . . 0.0 109.71 -171.59 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -69.81 155.48 40.49 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 122.831 2.56 . . . . 0.0 110.006 -172.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.502 ' HB2' ' HE3' ' P' ' 118' ' ' LYS . 0.2 OUTLIER -43.92 -37.12 2.71 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 122.329 1.062 . . . . 0.0 111.223 176.515 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.21 -58.31 9.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 122.953 1.359 . . . . 0.0 110.206 172.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.611 ' O ' HD12 ' P' ' 124' ' ' LEU . 78.6 mt-30 -55.51 -47.9 75.5 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.775 177.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.503 ' HA ' HD12 ' P' ' 124' ' ' LEU . 3.2 m -53.03 -44.93 67.72 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.348 -0.845 . . . . 0.0 110.242 170.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.508 ' CE2' ' NH1' ' P' ' 126' ' ' ARG . 11.1 t80 -65.43 -40.24 93.07 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 121.714 -0.616 . . . . 0.0 111.088 -171.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.64 ' HB2' HG21 ' P' ' 146' ' ' ILE . 0.0 OUTLIER -71.46 -26.71 62.83 Favored 'General case' 0 C--O 1.265 1.878 0 O-C-N 120.83 -1.169 . . . . 0.0 111.303 169.606 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.611 HD12 ' O ' ' P' ' 120' ' ' GLN . 1.4 mt -73.67 -40.65 63.53 Favored 'General case' 0 C--O 1.247 0.931 0 O-C-N 119.026 -2.296 . . . . 0.0 110.739 172.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -61.5 -45.68 93.2 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 123.152 1.453 . . . . 0.0 111.442 171.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.508 ' NH1' ' CE2' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -45.92 -65.1 0.59 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.941 172.451 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.798 ' HG3' HD13 ' P' ' 142' ' ' LEU . 0.7 OUTLIER -65.22 -31.32 72.43 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 118.652 -0.69 . . . . 0.0 109.911 -172.463 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.627 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 26.1 t80 -75.78 -44.69 40.17 Favored 'General case' 0 C--O 1.264 1.831 0 CA-C-N 120.685 1.584 . . . . 0.0 112.974 171.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . . . . . . . . . 5.8 mtp180 -67.23 -13.58 62.11 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 119.12 -2.237 . . . . 0.0 110.502 -173.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . 0.413 HE21 ' CA ' ' P' ' 126' ' ' ARG . 54.1 mt-30 -106.0 -33.62 7.85 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 126.369 1.867 . . . . 0.0 111.559 179.233 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.51 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.0 OUTLIER -151.8 108.58 3.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 123.862 1.791 . . . . 0.0 112.665 -167.762 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . 0.421 ' HB3' ' CD2' ' P' ' 133' ' ' TYR . 4.2 mtt85 -77.79 -9.14 58.87 Favored 'General case' 0 C--O 1.244 0.779 0 O-C-N 120.444 -1.41 . . . . 0.0 113.649 -171.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.421 ' CD2' ' HB3' ' P' ' 132' ' ' ARG . 98.2 m-85 -152.74 116.78 4.86 Favored 'General case' 0 C--O 1.26 1.647 0 C-N-CA 123.712 0.805 . . . . 0.0 109.765 -168.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.598 HD22 ' HB3' ' P' ' 138' ' ' GLU . 23.7 mt -123.11 143.34 50.05 Favored 'General case' 0 C--O 1.276 2.483 0 O-C-N 119.362 -2.086 . . . . 0.0 111.336 -166.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.58 162.7 19.71 Favored 'General case' 0 C--O 1.26 1.647 0 CA-C-N 124.492 3.315 . . . . 0.0 110.137 168.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.898 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -50.77 -60.49 5.38 Favored Pre-proline 0 C--O 1.253 1.274 0 O-C-N 119.974 -1.704 . . . . 0.0 111.585 -170.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.898 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 85.3 Cg_exo -50.67 -31.23 31.52 Favored 'Trans proline' 1 N--CA 1.538 4.128 1 C-N-CA 125.321 4.014 . . . . 0.0 115.57 -177.392 . . . . . . . . 4 3 . 1 . 017 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.598 ' HB3' HD22 ' P' ' 134' ' ' LEU . 2.3 mm-40 -65.54 -61.15 2.26 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 126.101 2.857 . . . . 0.0 108.638 167.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.623 ' NE ' ' HG3' ' P' ' 154' ' ' LYS . 0.1 OUTLIER -74.99 -22.82 58.3 Favored 'General case' 0 C--O 1.276 2.464 0 CA-C-N 112.273 -2.24 . . . . 0.0 113.102 -166.582 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.668 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 3.5 mt-10 -68.78 -39.4 80.2 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 123.844 3.02 . . . . 0.0 111.297 169.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -59.99 -33.72 72.34 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.633 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.798 HD13 ' HG3' ' P' ' 127' ' ' ARG . 0.9 OUTLIER -68.85 -37.14 78.91 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.058 0.932 . . . . 0.0 109.552 169.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.68 -36.68 69.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.219 172.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' P' ' 147' ' ' ARG . 1.6 t -72.09 -42.54 66.04 Favored 'General case' 0 C--O 1.266 1.952 0 N-CA-C 113.971 1.101 . . . . 0.0 113.971 176.118 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . 0.579 ' O ' ' HD2' ' P' ' 147' ' ' ARG . 87.1 mt -66.99 -46.0 75.91 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 125.586 2.612 . . . . 0.0 108.674 -168.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 1.012 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -94.13 -15.36 7.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-N 112.311 -2.222 . . . . 0.0 110.381 -175.499 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . 0.579 ' HD2' ' O ' ' P' ' 145' ' ' LEU . 0.1 OUTLIER 76.75 43.65 0.13 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 123.844 1.783 . . . . 0.0 112.122 165.399 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 1.012 HD12 HD11 ' P' ' 146' ' ' ILE . 5.6 mt -103.7 164.91 11.37 Favored 'General case' 0 C--O 1.253 1.273 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.212 168.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.512 ' HB ' ' HD2' ' P' ' 150' ' ' PRO . 7.1 p -77.42 153.95 81.71 Favored Pre-proline 0 C--N 1.321 -0.662 0 O-C-N 120.452 -1.405 . . . . 0.0 109.263 169.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.512 ' HD2' ' HB ' ' P' ' 149' ' ' THR . 9.0 Cg_endo -60.0 -45.14 25.48 Favored 'Trans proline' 0 N--CA 1.533 3.825 0 C-N-CA 124.418 3.412 . . . . 0.0 114.184 -171.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 1.1 m -60.48 -20.08 58.87 Favored 'General case' 0 C--O 1.27 2.18 0 CA-C-N 122.274 2.306 . . . . 0.0 112.61 166.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.472 ' HB3' ' CE1' ' P' ' 116' ' ' PHE . 40.2 mt-30 -74.35 -28.4 61.12 Favored 'General case' 0 C--O 1.276 2.452 0 CA-C-N 123.853 3.024 . . . . 0.0 108.442 169.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.564 ' O ' ' HD1' ' P' ' 157' ' ' PHE . 1.2 t -72.41 -63.17 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 CA-C-N 124.585 3.357 . . . . 0.0 111.465 168.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.623 ' HG3' ' NE ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -42.47 -50.04 5.24 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.13 0.972 . . . . 0.0 111.934 -179.51 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.486 HD13 ' HA ' ' P' ' 155' ' ' ILE . 0.8 OUTLIER -56.67 -52.91 48.12 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 O-C-N 121.539 -0.726 . . . . 0.0 110.9 177.373 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.676 ' CZ2' ' CE1' ' P' ' 160' ' ' HIS . 4.1 t90 -57.56 -29.98 64.86 Favored 'General case' 0 C--O 1.245 0.865 0 O-C-N 121.265 -0.897 . . . . 0.0 110.0 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.627 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 10.3 m-85 -76.71 -41.38 45.46 Favored 'General case' 0 C--O 1.288 3.113 0 O-C-N 120.227 -1.545 . . . . 0.0 112.999 171.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -51.5 -65.97 0.47 Allowed 'General case' 0 C--N 1.314 -0.957 0 O-C-N 116.624 -3.798 . . . . 0.0 110.863 165.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -58.38 -21.24 49.54 Favored 'General case' 0 C--O 1.276 2.463 0 CA-C-O 115.698 -2.096 . . . . 0.0 111.405 -171.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.676 ' CE1' ' CZ2' ' P' ' 156' ' ' TRP . 0.2 OUTLIER -73.25 -56.87 4.51 Favored 'General case' 0 C--O 1.28 2.696 0 CA-C-N 124.924 3.511 . . . . 0.0 112.93 169.929 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.42 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -62.12 -37.03 83.57 Favored 'General case' 0 C--O 1.27 2.182 0 O-C-N 117.962 -2.961 . . . . 0.0 113.651 -170.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -67.17 -31.65 72.21 Favored 'General case' 0 C--O 1.258 1.511 0 CA-C-N 123.167 2.712 . . . . 0.0 111.33 171.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -68.41 -37.67 80.53 Favored 'General case' 0 C--O 1.256 1.437 0 CA-C-N 121.12 1.782 . . . . 0.0 112.582 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.665 ' O ' ' HB3' ' P' ' 167' ' ' ALA . 0.5 OUTLIER -64.76 -48.97 72.59 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 124.519 2.104 . . . . 0.0 108.823 -172.31 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . 0.478 ' HG2' HG23 ' P' ' 164' ' ' THR . 12.2 mmmt -70.79 -42.76 69.93 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 112.967 -1.924 . . . . 0.0 111.227 -169.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.88 -16.32 63.06 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 124.271 1.029 . . . . 0.0 110.72 170.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.665 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -76.49 -33.87 58.66 Favored 'General case' 0 C--N 1.323 -0.573 0 O-C-N 121.16 -0.962 . . . . 0.0 111.815 171.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . 0.405 ' HG3' ' HA ' ' P' ' 165' ' ' LYS . 0.1 OUTLIER -80.65 -12.92 59.42 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.516 -179.096 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.2 -28.01 69.45 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 123.157 1.456 . . . . 0.0 109.604 166.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -23.04 50.42 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -170.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.89 -121.87 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 -171.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . 0.413 ' O ' ' CB ' ' P' ' 173' ' ' TYR . . . -22.54 -40.98 0.01 OUTLIER Glycine 0 C--N 1.314 -0.65 0 CA-C-O 121.913 0.729 . . . . 0.0 112.315 166.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . 0.413 ' CB ' ' O ' ' P' ' 172' ' ' GLY . 57.8 m-85 101.62 145.21 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 126.507 1.923 . . . . 0.0 110.615 166.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -163.31 171.89 15.46 Favored 'General case' 0 C--O 1.269 2.125 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.479 172.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 60.79 157.51 0.05 OUTLIER Glycine 0 N--CA 1.483 1.778 0 O-C-N 118.949 -2.345 . . . . 0.0 110.632 -169.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . 0.489 ' CG ' ' HD2' ' P' ' 177' ' ' PRO . 6.1 t60 -165.68 147.67 6.3 Favored Pre-proline 0 CA--C 1.51 -0.59 0 O-C-N 121.511 -0.993 . . . . 0.0 110.953 -171.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . 0.489 ' HD2' ' CG ' ' P' ' 176' ' ' HIS . 66.6 Cg_endo . . . . . 0 N--CA 1.527 3.497 1 C-N-CA 126.438 4.759 . . . . 0.0 114.315 176.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.565 3.689 0 O5'-C5'-C4' 114.384 2.989 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.695 ' N1 ' ' N3 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.403 0 P-O3'-C3' 124.116 3.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.528 H2'' ' C8 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.948 0 P-O3'-C3' 122.926 2.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.641 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.524 0 P-O3'-C3' 123.668 3.307 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.522 ' C4 ' ' C5 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.738 0 N19-C1'-C2' 118.212 2.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.509 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.566 3.841 0 N19-C1'-C2' 120.174 3.734 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 1.041 H2'' " H5'" ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.738 1 P-O3'-C3' 125.263 4.636 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 1.041 " H5'" H2'' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.54 3.604 0 P-O3'-C3' 124.395 3.913 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.613 ' C5 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.409 0 O4'-C4'-C3' 108.161 2.561 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.613 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.862 0 P-O3'-C3' 122.854 2.628 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.504 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.394 0 P-O3'-C3' 122.778 2.565 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . 0.454 ' C8 ' H2'' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.537 3.293 0 P-O3'-C3' 122.472 2.31 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.504 ' N3 ' ' C4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.552 0 O4'-C4'-C3' 108.433 2.833 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.735 H2'' H5'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.688 0 C2'-C3'-O3' 116.627 2.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.735 H5'' H2'' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.89 1 O4'-C1'-N19 111.39 4.488 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.496 " H5'" H2'' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.563 3.514 0 P-O3'-C3' 122.147 2.039 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . 0.464 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.541 3.751 0 O5'-C5'-C4' 115.008 3.434 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.5 ' C4 ' ' C6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 1 C4'--C3' 1.568 4.006 0 O4'-C4'-C3' 108.128 2.528 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.5 ' C6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.418 0 O4'-C4'-C3' 108.211 2.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.37 0 O4'-C4'-C3' 108.266 2.666 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.497 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.57 4.197 0 N19-C1'-C2' 119.312 3.195 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.515 H2'' ' C8 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 1 C3'--C2' 1.562 4.417 1 P-O3'-C3' 127.101 6.168 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.602 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 1 C4'--C3' 1.57 4.239 2 P-O3'-C3' 132.32 10.516 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.602 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.565 3.717 0 P-O3'-C3' 123.094 2.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.467 H2'' ' C6 ' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.746 0 O4'-C4'-C3' 108.604 3.004 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.516 ' C4 ' ' C6 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 1 C3'--C2' 1.558 4.024 0 N19-C1'-C2' 118.88 2.925 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.54 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.554 3.599 0 P-O3'-C3' 123.631 3.276 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.629 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.399 0 C4'-C3'-C2' 100.891 -2.309 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.641 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.581 0 O4'-C4'-C3' 108.373 2.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.602 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.424 0 O4'-C4'-C3' 108.18 2.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.695 ' N3 ' ' N1 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.695 1 P-O3'-C3' 124.72 4.184 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . 0.458 " H5'" " H1'" ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.543 3.953 1 P-O3'-C3' 129.421 8.101 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.483 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -163.02 132.62 4.25 Favored 'General case' 0 C--N 1.382 1.993 0 CA-C-N 113.64 -1.618 . . . . 0.0 108.65 -178.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 169.37 23.29 0.0 OUTLIER 'General case' 0 C--N 1.395 2.58 0 CA-C-N 113.376 -1.738 . . . . 0.0 109.469 -174.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . 0.677 ' O ' HD23 ' P' ' 105' ' ' LEU . . . -171.05 -104.01 0.17 Allowed Glycine 0 C--N 1.379 2.966 0 N-CA-C 108.831 -1.708 . . . . 0.0 108.831 -161.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.932 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.1 OUTLIER -172.08 155.12 3.56 Favored Pre-proline 0 CA--C 1.581 2.142 0 CA-C-N 113.704 -1.248 . . . . 0.0 108.677 -174.872 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.932 ' HD2' HD13 ' P' ' 105' ' ' LEU . 65.7 Cg_exo -48.92 92.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.116 0 C-N-CA 122.94 2.427 . . . . 0.0 110.346 155.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -106.37 169.66 8.38 Favored 'General case' 0 C--N 1.381 1.975 0 CA-C-O 122.478 1.132 . . . . 0.0 109.098 158.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 9.8 tttp -129.04 -54.33 1.2 Allowed 'General case' 0 C--N 1.382 2.01 0 CA-C-N 113.673 -1.603 . . . . 0.0 108.108 -163.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.463 ' HD2' " H5'" ' B' ' 28' ' ' ' DA' . 2.7 tttt -67.7 135.2 52.37 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 113.675 -1.602 . . . . 0.0 109.56 169.228 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.453 ' HD3' ' C ' ' P' ' 109' ' ' LYS . 1.6 mmt85 -135.1 61.4 1.67 Allowed 'General case' 0 C--N 1.385 2.139 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.218 -169.021 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.68 ' HD3' " O4'" ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -178.91 134.65 0.13 Allowed 'General case' 0 C--N 1.381 1.96 0 CA-C-N 114.487 -1.233 . . . . 0.0 108.02 155.121 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . 0.585 ' O ' ' HG3' ' P' ' 111' ' ' LYS . 2.4 mtp85 -91.81 170.32 9.98 Favored 'General case' 0 C--N 1.38 1.933 0 CA-C-N 114.803 -1.089 . . . . 0.0 108.488 153.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.94 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.4 OUTLIER -80.2 112.99 18.05 Favored 'General case' 0 C--N 1.387 2.203 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 155.256 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.425 HG21 ' OP1' ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -106.35 63.04 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.186 0 CA-C-O 125.921 2.772 . . . . 0.0 107.675 -156.704 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.94 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -75.59 106.09 6.96 Favored 'General case' 0 C--N 1.394 2.53 0 CA-C-N 110.87 -2.877 . . . . 0.0 109.215 -155.727 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.544 ' CD1' ' CD2' ' P' ' 148' ' ' LEU . 0.7 OUTLIER -76.75 143.54 39.85 Favored 'General case' 0 C--N 1.391 2.405 0 CA-C-N 112.354 -2.203 . . . . 0.0 107.742 -169.323 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . 0.433 ' O ' ' N ' ' P' ' 121' ' ' THR . 1.3 p -65.25 150.03 48.93 Favored 'General case' 0 C--N 1.382 2.02 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 -168.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' P' ' 122' ' ' TYR . 33.2 ttmt -45.06 -35.92 3.28 Favored 'General case' 0 C--N 1.382 1.98 0 CA-C-N 114.5 -1.227 . . . . 0.0 109.212 -178.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.2 -59.7 4.23 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-O 124.361 2.029 . . . . 0.0 109.49 174.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.555 ' CG ' HG13 ' P' ' 146' ' ' ILE . 79.6 mt-30 -60.24 -48.09 83.2 Favored 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.332 2.253 . . . . 0.0 109.949 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.635 ' HA ' HD12 ' P' ' 124' ' ' LEU . 4.2 m -47.47 -55.94 8.03 Favored 'General case' 0 C--N 1.385 2.139 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 167.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.587 ' CZ ' ' HG3' ' P' ' 126' ' ' ARG . 0.0 OUTLIER -52.85 -51.37 61.29 Favored 'General case' 0 C--N 1.38 1.912 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.023 -168.498 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.952 ' CD ' HG22 ' P' ' 146' ' ' ILE . 7.8 mt-10 -65.34 -36.37 83.81 Favored 'General case' 0 C--N 1.379 1.869 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.764 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.698 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.3 mt -60.01 -51.87 67.83 Favored 'General case' 0 C--N 1.383 2.062 0 O-C-N 120.885 -1.135 . . . . 0.0 109.735 170.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.469 ' O ' ' N ' ' P' ' 129' ' ' ARG . 19.1 mt-10 -55.89 -49.49 73.25 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-O 122.638 1.208 . . . . 0.0 109.738 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.587 ' HG3' ' CZ ' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -42.39 -70.41 0.11 Allowed 'General case' 0 C--N 1.378 1.826 0 CA-C-N 111.896 -2.411 . . . . 0.0 108.717 176.464 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.653 ' CG ' HD13 ' P' ' 142' ' ' LEU . 0.3 OUTLIER -58.7 -36.59 74.49 Favored 'General case' 0 C--N 1.393 2.484 0 CA-C-N 112.641 -2.072 . . . . 0.0 108.393 -171.179 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.774 ' N ' ' HE2' ' P' ' 157' ' ' PHE . 25.9 t80 -70.42 -47.23 61.73 Favored 'General case' 0 C--N 1.38 1.924 0 CA-C-O 121.638 0.732 . . . . 0.0 110.346 179.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.513 ' HB3' ' NH1' ' P' ' 129' ' ' ARG . 0.0 OUTLIER -62.52 -20.62 64.82 Favored 'General case' 0 C--N 1.381 1.949 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -168.585 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -94.06 -44.15 8.17 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-O 123.886 1.803 . . . . 0.0 106.576 -169.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.31 127.34 5.62 Favored 'General case' 0 C--N 1.394 2.51 0 CA-C-N 112.005 -2.361 . . . . 0.0 109.957 -163.235 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.03 -20.14 49.7 Favored 'General case' 0 C--N 1.397 2.673 0 CA-C-N 111.366 -2.652 . . . . 0.0 110.616 -158.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.674 ' HD1' ' CZ ' ' P' ' 161' ' ' ARG . 18.0 m-85 -153.0 115.57 4.48 Favored 'General case' 0 C--N 1.379 1.863 0 CA-C-O 124.946 2.307 . . . . 0.0 109.094 -154.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.544 HD22 ' HG3' ' P' ' 138' ' ' GLU . 35.8 mt -113.27 139.41 48.84 Favored 'General case' 0 C--N 1.417 3.534 0 O-C-N 119.65 -1.906 . . . . 0.0 108.724 -166.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . 0.409 ' HB2' ' HD2' ' P' ' 137' ' ' PRO . 0.0 OUTLIER -79.25 154.52 29.12 Favored 'General case' 0 C--N 1.384 2.106 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 158.39 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.29 -42.94 97.46 Favored Pre-proline 0 CA--C 1.583 2.224 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.455 -162.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.409 ' HD2' ' HB2' ' P' ' 135' ' ' SER . 0.0 OUTLIER -48.28 -48.48 16.76 Favored 'Trans proline' 0 C--N 1.394 2.942 0 C-N-CA 121.706 1.604 . . . . 0.0 115.903 -178.747 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.544 ' HG3' HD22 ' P' ' 134' ' ' LEU . 5.0 mm-40 -52.85 -60.79 2.83 Favored 'General case' 0 C--N 1.394 2.506 0 CA-C-O 123.89 1.805 . . . . 0.0 106.183 175.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.645 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -70.03 -33.58 72.16 Favored 'General case' 0 C--O 1.27 2.171 0 CA-C-N 109.662 -3.426 . . . . 0.0 109.494 -161.726 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.677 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 6.8 mt-10 -52.76 -47.84 67.18 Favored 'General case' 0 C--N 1.379 1.865 0 CA-C-N 121.434 1.925 . . . . 0.0 107.783 169.12 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -68.08 -36.67 80.2 Favored 'General case' 0 C--N 1.381 1.976 0 CA-C-N 112.241 -2.254 . . . . 0.0 109.033 -164.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.653 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.0 OUTLIER -65.96 -42.07 90.39 Favored 'General case' 0 C--N 1.382 2.0 0 CA-C-O 123.177 1.465 . . . . 0.0 109.073 168.768 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -55.71 -36.69 67.46 Favored 'General case' 0 C--N 1.389 2.319 0 CA-C-N 112.646 -2.07 . . . . 0.0 108.413 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.599 ' N ' ' O ' ' P' ' 140' ' ' GLU . 1.6 t -72.8 -41.18 65.22 Favored 'General case' 0 C--N 1.388 2.261 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.545 -178.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 77.8 mt -66.76 -50.9 61.24 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-O 124.882 2.277 . . . . 0.0 108.048 -165.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.963 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -90.7 -17.94 7.69 Favored 'Isoleucine or valine' 0 C--N 1.387 2.229 0 CA-C-N 110.406 -3.088 . . . . 0.0 107.949 -172.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 81.84 38.35 0.06 Allowed 'General case' 0 C--N 1.386 2.161 0 CA-C-N 111.414 -2.63 . . . . 0.0 107.981 153.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.963 HD12 HD11 ' P' ' 146' ' ' ILE . 6.0 mt -94.92 172.84 7.91 Favored 'General case' 0 C--N 1.39 2.356 0 CA-C-N 112.018 -2.356 . . . . 0.0 109.165 166.216 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.528 ' O ' ' N ' ' P' ' 152' ' ' GLN . 16.8 p -87.84 145.29 36.4 Favored Pre-proline 0 CA--C 1.585 2.304 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 168.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.543 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 65.9 Cg_exo -49.56 -48.28 19.58 Favored 'Trans proline' 0 C--N 1.408 3.701 0 C-N-CA 124.078 3.185 . . . . 0.0 113.909 -167.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.52 -26.27 54.12 Favored 'General case' 0 C--N 1.388 2.255 0 CA-C-N 112.174 -2.285 . . . . 0.0 110.339 173.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' P' ' 149' ' ' THR . 47.3 mt-30 -77.58 -28.44 51.67 Favored 'General case' 0 C--N 1.392 2.42 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 174.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.593 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.0 OUTLIER -64.19 -70.5 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.954 0 CA-C-N 122.326 2.33 . . . . 0.0 109.545 163.395 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.645 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -34.0 -59.21 0.43 Allowed 'General case' 0 C--N 1.385 2.149 0 C-N-CA 124.869 1.267 . . . . 0.0 110.338 -176.818 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.446 HD13 ' HA ' ' P' ' 155' ' ' ILE . 9.4 mm -64.03 -34.5 68.98 Favored 'Isoleucine or valine' 0 C--N 1.385 2.12 0 CA-C-N 112.898 -1.955 . . . . 0.0 110.163 -171.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.698 ' HB3' HD22 ' P' ' 124' ' ' LEU . 5.7 t90 -67.45 -31.55 71.79 Favored 'General case' 0 C--N 1.381 1.95 0 O-C-N 121.305 -0.872 . . . . 0.0 109.472 168.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.774 ' HE2' ' N ' ' P' ' 128' ' ' PHE . 65.0 m-85 -74.62 -40.24 61.64 Favored 'General case' 0 C--O 1.273 2.338 0 O-C-N 121.436 -0.79 . . . . 0.0 111.975 172.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.519 ' N ' ' O ' ' P' ' 154' ' ' LYS . 39.3 mt-30 -54.25 -59.67 4.36 Favored 'General case' 0 C--N 1.378 1.823 0 O-C-N 119.592 -1.943 . . . . 0.0 106.244 170.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -57.11 -24.74 56.27 Favored 'General case' 0 C--N 1.389 2.32 0 CA-C-O 117.509 -1.234 . . . . 0.0 109.935 -169.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.548 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 3.1 t60 -79.08 -41.84 27.79 Favored 'General case' 0 C--O 1.284 2.92 0 CA-C-N 121.779 2.082 . . . . 0.0 111.323 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.682 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -67.66 -38.06 83.26 Favored 'General case' 0 C--O 1.264 1.818 0 CA-C-N 122.946 2.612 . . . . 0.0 109.955 -176.718 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -60.42 -43.87 96.31 Favored 'General case' 0 C--N 1.38 1.908 0 O-C-N 120.659 -1.276 . . . . 0.0 108.101 170.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -23.71 66.44 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.951 -164.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.682 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -73.79 -56.85 4.47 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 125.654 2.645 . . . . 0.0 105.905 -167.289 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . . . . . . . . . 9.3 mtpt -58.78 -44.93 90.82 Favored 'General case' 0 C--N 1.392 2.444 1 CA-C-N 107.632 -4.349 . . . . 0.0 108.829 -169.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 11.8 ttt-85 -60.23 -38.92 84.89 Favored 'General case' 0 C--N 1.38 1.934 0 CA-C-N 112.662 -2.063 . . . . 0.0 108.763 -177.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.6 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -48.95 -42.34 37.06 Favored 'General case' 0 C--N 1.385 2.109 0 CA-C-N 113.541 -1.663 . . . . 0.0 108.538 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -81.54 -24.14 36.8 Favored 'General case' 0 C--N 1.388 2.269 0 CA-C-N 111.763 -2.471 . . . . 0.0 110.361 -166.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.67 -29.68 53.33 Favored 'General case' 0 C--N 1.387 2.22 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.99 170.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -74.61 -40.01 61.82 Favored 'General case' 0 C--N 1.387 2.203 0 CA-C-N 113.059 -1.882 . . . . 0.0 107.993 -165.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -92.63 85.55 5.3 Favored 'General case' 0 C--N 1.382 2.001 0 CA-C-N 113.679 -1.601 . . . . 0.0 109.197 -158.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 125.4 -49.87 0.89 Allowed Glycine 0 C--N 1.382 3.116 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -164.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 102.1 150.37 0.01 OUTLIER 'General case' 0 C--N 1.388 2.279 0 CA-C-N 112.62 -1.79 . . . . 0.0 108.564 172.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -158.57 -179.96 8.56 Favored 'General case' 0 C--N 1.392 2.431 0 CA-C-N 112.969 -1.923 . . . . 0.0 107.942 156.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . 144.2 -97.07 0.19 Allowed Glycine 0 C--N 1.382 3.089 0 N-CA-C 109.106 -1.597 . . . . 0.0 109.106 167.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -47.1 137.51 8.1 Favored Pre-proline 0 CA--C 1.58 2.131 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 159.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo . . . . . 0 CA--C 1.594 3.523 0 C-N-CA 121.532 1.488 . . . . 0.0 111.59 -179.737 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . 0.637 ' H73' ' O6 ' ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.811 0 O5'-C5'-C4' 114.393 2.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.762 " H2'" ' H71' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.554 1 P-O3'-C3' 125.918 5.182 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.762 ' H71' " H2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.892 1 P-O3'-C3' 131.115 9.512 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.598 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.436 0 P-O3'-C3' 123.717 3.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.523 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.891 0 P-O3'-C3' 123.149 2.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.523 ' N3 ' ' C2 ' ' A' ' 5' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.567 3.898 0 C3'-C2'-C1' 106.494 2.71 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.696 " O3'" HG23 ' P' ' 114' ' ' VAL . . . . . . . . 0 C4'--C3' 1.565 3.677 0 C2'-C3'-O3' 118.071 2.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.78 " C4'" ' HD2' ' P' ' 111' ' ' LYS . . . . . . . . 1 C5'--C4' 1.548 4.623 0 O4'-C1'-N19 110.817 3.771 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.606 ' C5 ' ' C4 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.539 3.492 0 O4'-C4'-C3' 108.465 2.865 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.606 ' C4 ' ' C5 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.816 0 N19-C1'-C2' 117.819 2.262 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.429 ' C8 ' H2'' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.538 3.415 0 O4'-C4'-C3' 108.186 2.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . 0.494 H2'' ' C6 ' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.368 0 P-O3'-C3' 122.482 2.318 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.95 " H2'" ' H71' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.586 0 O4'-C4'-C3' 108.443 2.843 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.95 ' H71' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.705 1 P-O3'-C3' 125.988 5.24 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.612 ' C8 ' ' H71' ' A' ' 16' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.542 3.9 1 O4'-C1'-N19 111.186 4.233 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.612 ' H71' ' C8 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.584 0 O4'-C1'-N19 109.552 2.19 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . 0.48 H2'' " H5'" ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.629 0 O5'-C5'-C4' 115.056 3.468 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.48 " H5'" H2'' ' B' ' 17' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.567 3.915 0 O4'-C4'-C3' 108.08 2.48 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.432 ' C8 ' H2'' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.373 0 O4'-C4'-C3' 108.22 2.62 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.562 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.331 0 P-O3'-C3' 123.792 3.41 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.562 ' C5 ' H2'' ' B' ' 20' ' ' ' DG' . . . . . . . . 2 C4'--C3' 1.572 4.382 0 N19-C1'-C2' 119.123 3.077 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.541 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.563 3.486 0 P-O3'-C3' 124.294 3.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.612 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.481 0 C3'-C2'-C1' 106.943 3.031 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.612 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.624 0 O4'-C4'-C3' 108.38 2.78 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . 0.618 ' C2 ' ' C4 ' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.565 3.749 0 P-O3'-C3' 123.798 3.415 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.618 ' C4 ' ' C2 ' ' B' ' 25' ' ' ' DT' . . . . . . . . 2 C3'--C2' 1.56 4.211 0 P-O3'-C3' 123.935 3.529 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.562 ' C8 ' H2'' ' B' ' 26' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.554 3.576 0 P-O3'-C3' 123.343 3.036 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.562 ' C6 ' ' C5 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.443 0 P-O3'-C3' 122.288 2.156 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.598 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.726 0 P-O3'-C3' 123.038 2.781 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.348 0 O4'-C4'-C3' 108.051 2.451 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.6 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.592 0 O4'-C4'-C3' 108.424 2.824 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . 0.474 ' C8 ' H2'' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.542 3.906 0 O4'-C1'-N19 109.463 2.078 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.475 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 5.8 t -103.19 -67.2 0.89 Allowed 'General case' 0 C--N 1.382 2.0 0 CA-C-N 113.656 -1.611 . . . . 0.0 108.687 173.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 170.04 37.69 0.0 OUTLIER 'General case' 0 C--N 1.396 2.604 0 CA-C-N 113.357 -1.747 . . . . 0.0 109.484 175.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . 0.644 ' O ' HD13 ' P' ' 105' ' ' LEU . . . -172.19 -102.47 0.16 Allowed Glycine 0 C--N 1.381 3.029 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 160.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.644 HD13 ' O ' ' P' ' 104' ' ' GLY . 0.3 OUTLIER -171.35 153.17 3.53 Favored Pre-proline 0 CA--C 1.582 2.198 0 CA-C-N 113.713 -1.243 . . . . 0.0 108.508 176.353 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -50.75 78.29 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.083 0 C-N-CA 123.046 2.497 . . . . 0.0 110.608 155.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 70.01 -167.8 0.17 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 122.453 1.121 . . . . 0.0 109.176 -173.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . 0.581 ' O ' ' HD3' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -154.55 46.54 0.56 Allowed 'General case' 0 C--N 1.383 2.033 0 CA-C-N 113.681 -1.6 . . . . 0.0 108.048 179.481 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . . . . . . . . . 1.7 ttpt -96.8 140.23 31.68 Favored 'General case' 0 C--N 1.379 1.86 0 CA-C-N 113.627 -1.624 . . . . 0.0 109.772 175.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.581 ' HD3' ' O ' ' P' ' 108' ' ' LYS . 0.0 OUTLIER -127.61 92.46 3.49 Favored 'General case' 0 C--N 1.382 2.015 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.867 -155.564 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.78 ' HD2' " C4'" ' A' ' 8' ' ' ' DA' . 0.1 OUTLIER -12.45 88.25 0.0 OUTLIER 'General case' 0 C--N 1.38 1.919 0 CA-C-N 113.411 -1.722 . . . . 0.0 110.341 159.518 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -89.68 166.38 13.63 Favored 'General case' 0 C--N 1.39 2.333 0 CA-C-N 112.441 -2.163 . . . . 0.0 108.785 157.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.96 ' CD ' HD21 ' P' ' 115' ' ' LEU . 1.2 ttm180 -83.54 116.99 22.83 Favored 'General case' 0 C--N 1.383 2.059 0 CA-C-N 113.522 -1.672 . . . . 0.0 107.021 -170.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.696 HG23 " O3'" ' A' ' 7' ' ' ' DA' . 0.1 OUTLIER -100.05 70.44 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.388 2.27 0 CA-C-O 124.913 2.292 . . . . 0.0 107.968 -164.497 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.96 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.1 OUTLIER -76.56 108.87 9.86 Favored 'General case' 0 C--N 1.387 2.227 0 CA-C-N 111.842 -2.436 . . . . 0.0 109.456 -161.122 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.514 ' HE2' ' HB2' ' P' ' 156' ' ' TRP . 2.0 m-85 -75.62 141.38 42.85 Favored 'General case' 0 C--N 1.389 2.287 0 CA-C-N 112.872 -1.967 . . . . 0.0 108.152 -170.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.2 p -66.82 148.05 52.44 Favored 'General case' 0 C--N 1.382 1.994 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 -170.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' P' ' 122' ' ' TYR . 31.5 ttmt -43.24 -36.37 1.76 Allowed 'General case' 0 C--N 1.382 1.979 0 CA-C-N 113.425 -1.716 . . . . 0.0 109.218 -177.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' P' ' 122' ' ' TYR . . . -53.68 -66.78 0.33 Allowed 'General case' 0 C--N 1.382 1.978 0 CA-C-O 124.178 1.942 . . . . 0.0 109.14 174.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.557 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.0 mt-30 -48.52 -49.35 36.44 Favored 'General case' 0 C--N 1.382 2.001 0 CA-C-N 112.448 -2.16 . . . . 0.0 109.527 177.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.721 ' HA ' HD12 ' P' ' 124' ' ' LEU . 19.5 m -51.6 -54.27 29.51 Favored 'General case' 0 C--N 1.384 2.101 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 171.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.664 ' HE1' ' NH1' ' P' ' 126' ' ' ARG . 0.9 OUTLIER -52.96 -46.5 68.23 Favored 'General case' 0 C--N 1.384 2.085 0 CA-C-O 122.428 1.109 . . . . 0.0 110.095 -172.085 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.713 ' HG3' HG22 ' P' ' 146' ' ' ILE . 0.2 OUTLIER -66.89 -38.74 86.83 Favored 'General case' 0 C--N 1.379 1.871 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.87 179.84 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' P' ' 121' ' ' THR . 1.3 mt -60.56 -50.23 74.36 Favored 'General case' 0 C--N 1.385 2.112 0 O-C-N 120.305 -1.497 . . . . 0.0 109.525 172.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.457 ' O ' ' N ' ' P' ' 129' ' ' ARG . 23.4 mt-10 -55.81 -50.35 70.77 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-O 122.626 1.203 . . . . 0.0 109.653 177.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.664 ' NH1' ' HE1' ' P' ' 122' ' ' TYR . 0.0 OUTLIER -41.46 -68.38 0.19 Allowed 'General case' 0 C--N 1.378 1.808 0 CA-C-N 112.09 -2.323 . . . . 0.0 108.844 175.184 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.769 ' CG ' HD13 ' P' ' 142' ' ' LEU . 1.1 mmt85 -60.56 -36.19 77.89 Favored 'General case' 0 C--N 1.386 2.165 0 CA-C-N 113.06 -1.882 . . . . 0.0 108.418 -170.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.796 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 13.7 t80 -70.2 -48.09 58.67 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-N 119.066 0.848 . . . . 0.0 110.123 176.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' P' ' 125' ' ' GLU . 14.7 mtm180 -62.5 -18.88 62.88 Favored 'General case' 0 C--N 1.381 1.945 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 -168.132 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -95.35 -41.04 9.21 Favored 'General case' 0 C--N 1.38 1.907 0 CA-C-O 123.975 1.845 . . . . 0.0 107.059 -173.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.442 ' OE1' HD21 ' P' ' 134' ' ' LEU . 1.8 tt0 -156.46 123.59 5.3 Favored 'General case' 0 C--N 1.393 2.487 0 CA-C-N 111.888 -2.414 . . . . 0.0 108.982 -156.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . 0.445 ' NH1' ' HG3' ' P' ' 132' ' ' ARG . 0.0 OUTLIER -77.73 -16.54 58.37 Favored 'General case' 0 C--N 1.384 2.08 0 CA-C-N 111.805 -2.452 . . . . 0.0 110.249 -172.021 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . 0.458 ' HD1' ' HA ' ' P' ' 133' ' ' TYR . 0.2 OUTLIER -155.27 123.84 6.02 Favored 'General case' 0 C--N 1.38 1.913 0 CA-C-O 124.886 2.279 . . . . 0.0 109.308 -154.255 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.523 HD11 ' HD3' ' P' ' 127' ' ' ARG . 30.9 mt -136.05 136.93 40.63 Favored 'General case' 0 C--N 1.404 2.954 0 O-C-N 119.884 -1.76 . . . . 0.0 109.359 -164.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . 0.402 ' HB2' ' HD2' ' P' ' 137' ' ' PRO . 0.1 OUTLIER -82.45 151.71 26.44 Favored 'General case' 0 C--N 1.383 2.05 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 172.948 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.68 -39.49 76.98 Favored Pre-proline 0 CA--C 1.588 2.406 0 O-C-N 121.405 -0.81 . . . . 0.0 109.259 -165.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.402 ' HD2' ' HB2' ' P' ' 135' ' ' SER . 0.1 OUTLIER -55.71 -42.56 66.24 Favored 'Trans proline' 0 C--N 1.396 3.033 0 N-CA-C 119.2 2.731 . . . . 0.0 119.2 175.638 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.413 ' HB3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -49.32 -71.28 0.07 Allowed 'General case' 0 C--N 1.379 1.855 0 CA-C-O 124.626 2.155 . . . . 0.0 107.548 162.771 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.824 ' CZ ' ' HG2' ' P' ' 154' ' ' LYS . 0.0 OUTLIER -69.26 -37.07 77.75 Favored 'General case' 0 C--N 1.391 2.376 0 CA-C-N 109.563 -3.471 . . . . 0.0 108.492 -157.37 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.636 ' O ' ' N ' ' P' ' 144' ' ' SER . 2.4 mt-10 -53.29 -40.3 64.63 Favored 'General case' 0 C--N 1.381 1.952 0 CA-C-O 123.103 1.43 . . . . 0.0 108.023 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . 0.424 ' O ' ' HB3' ' P' ' 144' ' ' SER . 3.9 t-160 -63.3 -36.0 82.23 Favored 'General case' 0 C--N 1.38 1.898 0 CA-C-N 112.937 -1.938 . . . . 0.0 108.445 -171.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.769 HD13 ' CG ' ' P' ' 127' ' ' ARG . 1.7 tp -66.02 -43.19 88.39 Favored 'General case' 0 C--N 1.383 2.024 0 CA-C-O 123.037 1.399 . . . . 0.0 109.16 168.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.628 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -56.07 -33.17 64.78 Favored 'General case' 0 C--N 1.388 2.268 0 CA-C-N 112.75 -2.023 . . . . 0.0 108.28 173.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.636 ' N ' ' O ' ' P' ' 140' ' ' GLU . 7.4 t -73.5 -44.26 58.2 Favored 'General case' 0 C--N 1.387 2.228 0 CA-C-N 113.631 -1.622 . . . . 0.0 109.698 -177.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 83.0 mt -68.04 -44.22 76.9 Favored 'General case' 0 C--N 1.38 1.933 0 CA-C-O 124.793 2.235 . . . . 0.0 108.255 -163.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 1.009 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -100.2 -13.08 8.31 Favored 'Isoleucine or valine' 0 C--N 1.39 2.34 0 CA-C-N 110.931 -2.85 . . . . 0.0 107.916 -167.696 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 82.37 34.74 0.07 Allowed 'General case' 0 C--N 1.382 1.993 0 CA-C-O 125.508 2.575 . . . . 0.0 107.942 152.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 1.009 HD12 HD11 ' P' ' 146' ' ' ILE . 9.3 mt -96.26 169.59 9.83 Favored 'General case' 0 C--N 1.397 2.637 0 CA-C-N 111.573 -2.558 . . . . 0.0 109.516 170.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.648 ' O ' ' N ' ' P' ' 152' ' ' GLN . 22.5 p -91.56 139.81 25.17 Favored Pre-proline 0 CA--C 1.593 2.597 0 CA-C-O 122.661 1.22 . . . . 0.0 108.543 170.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.417 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 15.0 Cg_exo -56.07 -35.31 94.67 Favored 'Trans proline' 1 C--N 1.415 4.047 0 C-N-CA 122.688 2.259 . . . . 0.0 112.92 -159.674 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 1.3 m -59.65 -28.5 67.3 Favored 'General case' 0 C--N 1.384 2.071 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.866 167.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.648 ' N ' ' O ' ' P' ' 149' ' ' THR . 45.1 mt-30 -72.8 -30.83 64.39 Favored 'General case' 0 C--O 1.271 2.197 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.609 HG12 ' N ' ' P' ' 154' ' ' LYS . 1.4 t -64.35 -74.66 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 122.094 2.224 . . . . 0.0 109.326 164.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.824 ' HG2' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -38.22 -45.71 0.99 Allowed 'General case' 0 C--N 1.385 2.128 0 C-N-CA 125.452 1.501 . . . . 0.0 110.873 -173.069 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . 0.542 HD13 ' HA ' ' P' ' 155' ' ' ILE . 0.7 OUTLIER -59.28 -64.72 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.382 2.015 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 -179.445 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.721 ' HB3' HD22 ' P' ' 124' ' ' LEU . 2.1 t90 -49.6 -30.9 9.53 Favored 'General case' 0 C--N 1.385 2.126 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -176.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.796 ' HE1' ' N ' ' P' ' 128' ' ' PHE . 45.9 m-85 -74.57 -44.93 48.54 Favored 'General case' 0 C--O 1.278 2.598 0 O-C-N 121.252 -0.905 . . . . 0.0 112.228 171.215 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -46.05 -64.31 0.78 Allowed 'General case' 0 C--N 1.378 1.815 0 O-C-N 119.0 -2.312 . . . . 0.0 107.005 167.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' P' ' 163' ' ' LYS . 1.4 m120 -55.97 -21.54 21.62 Favored 'General case' 0 C--N 1.386 2.193 0 CA-C-O 117.431 -1.271 . . . . 0.0 110.551 -164.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.534 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 1.0 OUTLIER -80.69 -41.58 23.44 Favored 'General case' 0 C--O 1.292 3.31 0 CA-C-N 121.621 2.01 . . . . 0.0 112.436 176.73 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.751 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -66.26 -39.27 89.36 Favored 'General case' 0 C--O 1.267 1.984 0 CA-C-N 123.825 3.011 . . . . 0.0 109.116 -167.505 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -66.16 -31.25 71.99 Favored 'General case' 0 C--N 1.381 1.963 0 O-C-N 120.076 -1.64 . . . . 0.0 109.669 169.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' P' ' 159' ' ' ASN . 6.1 ttmm -65.05 -32.05 73.57 Favored 'General case' 0 C--N 1.381 1.971 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 -171.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.751 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.3 OUTLIER -69.13 -57.1 5.85 Favored 'General case' 0 CA--C 1.572 1.826 0 CA-C-O 125.732 2.682 . . . . 0.0 105.246 -166.054 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . . . . . . . . . 8.2 mtpt -58.11 -50.44 73.47 Favored 'General case' 0 C--N 1.39 2.346 1 CA-C-N 107.929 -4.214 . . . . 0.0 108.787 -168.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . . . . . . . . . 8.9 ttt85 -53.97 -39.61 66.14 Favored 'General case' 0 C--N 1.381 1.961 0 CA-C-N 112.561 -2.109 . . . . 0.0 108.991 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -64.75 -31.36 72.55 Favored 'General case' 0 C--N 1.382 2.013 0 CA-C-O 124.387 2.041 . . . . 0.0 109.384 -172.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.95 -22.67 31.39 Favored 'General case' 0 C--N 1.392 2.443 0 CA-C-N 112.39 -2.186 . . . . 0.0 109.982 -176.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -54.04 -32.29 54.04 Favored 'General case' 0 C--N 1.38 1.908 0 CA-C-O 123.874 1.797 . . . . 0.0 110.092 168.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -75.95 -33.2 59.81 Favored 'General case' 0 C--N 1.381 1.965 0 CA-C-N 112.284 -2.235 . . . . 0.0 107.762 -154.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -77.82 91.7 4.15 Favored 'General case' 0 C--N 1.382 2.011 0 CA-C-N 113.438 -1.71 . . . . 0.0 109.062 -159.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 116.06 -86.77 0.42 Allowed Glycine 0 C--N 1.384 3.197 0 N-CA-C 108.739 -1.744 . . . . 0.0 108.739 -155.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . 0.417 ' N ' ' CD1' ' P' ' 173' ' ' TYR . 0.0 OUTLIER 148.83 170.95 0.0 OUTLIER 'General case' 0 C--N 1.382 1.982 0 CA-C-N 113.196 -1.502 . . . . 0.0 109.634 170.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.86 54.37 2.69 Favored 'General case' 0 C--N 1.388 2.246 0 CA-C-N 111.868 -2.424 . . . . 0.0 109.686 173.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -65.42 103.52 0.82 Allowed Glycine 0 C--N 1.38 3.0 0 N-CA-C 109.379 -1.489 . . . . 0.0 109.379 -157.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . 0.458 ' CG ' ' HD2' ' P' ' 177' ' ' PRO . 0.4 OUTLIER -156.81 165.83 17.92 Favored Pre-proline 0 CA--C 1.579 2.094 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -176.713 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . 0.458 ' HD2' ' CG ' ' P' ' 176' ' ' HIS . 68.3 Cg_exo . . . . . 0 CA--C 1.593 3.461 0 C-N-CA 121.516 1.477 . . . . 0.0 111.587 170.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.567 3.856 0 O5'-C5'-C4' 114.351 2.965 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ' DG' . . . . . 0.603 " C2'" ' H71' ' A' ' 3' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.3 0 O4'-C4'-C3' 108.138 2.538 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . 0.603 ' H71' " C2'" ' A' ' 2' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.567 3.856 0 P-O3'-C3' 122.553 2.378 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.661 ' N1 ' ' N3 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.565 3.731 0 P-O3'-C3' 123.445 3.121 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ' DT' . . . . . 0.554 ' C2 ' ' N3 ' ' A' ' 6' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.567 3.864 1 P-O3'-C3' 126.54 5.7 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . 0.591 ' C5 ' ' C6 ' ' A' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.568 3.956 1 P-O3'-C3' 126.295 5.496 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ' DA' . . . . . 0.803 " C5'" ' HG2' ' P' ' 113' ' ' ARG . . . . . . . . 0 C5'--C4' 1.538 3.383 1 P-O3'-C3' 124.532 4.027 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ' DA' . . . . . 0.912 H2'' H5'' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.539 3.445 0 C4'-C3'-C2' 100.818 -2.382 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ' DG' . . . . . 0.912 H5'' H2'' ' A' ' 8' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.562 3.353 0 P-O3'-C3' 123.031 2.776 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.56 ' C7 ' ' C8 ' ' A' ' 9' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.566 3.815 0 P-O3'-C3' 122.726 2.522 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.479 ' N2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.539 3.475 0 O4'-C4'-C3' 108.002 2.402 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.561 3.347 0 P-O3'-C3' 122.518 2.348 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.71 " H2'" ' H72' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.564 3.624 0 O4'-C4'-C3' 108.288 2.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.71 ' H72' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.566 3.793 0 C2'-C3'-O3' 116.673 2.249 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ' DG' . . . . . 0.679 H5'' H2'' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.543 3.941 1 O4'-C1'-N19 111.241 4.302 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ' DT' . . . . . 0.667 ' H71' ' N9 ' ' A' ' 15' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.564 3.563 0 P-O3'-C3' 123.894 3.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.727 0 O5'-C5'-C4' 115.08 3.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' ' DC' . . . . . 0.472 ' C4 ' ' N6 ' ' B' ' 19' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.538 1 P-O3'-C3' 126.838 5.948 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' ' DA' . . . . . 0.472 ' N6 ' ' C4 ' ' B' ' 18' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.539 3.508 0 O4'-C4'-C3' 108.253 2.653 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' ' DG' . . . . . 0.47 H2'' ' C5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.537 3.29 0 P-O3'-C3' 124.147 3.706 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.607 H2'' ' C6 ' ' B' ' 22' ' ' ' DC' . . . . . . . . 2 C4'--C3' 1.571 4.27 0 N19-C1'-C2' 119.009 3.006 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' ' DC' . . . . . 0.607 ' C6 ' H2'' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.556 3.76 0 N19-C1'-C2' 118.365 2.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' ' DA' . . . . . 0.632 ' C2 ' ' C2 ' ' B' ' 24' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.54 3.564 1 P-O3'-C3' 130.654 9.128 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' ' DC' . . . . . 0.632 ' C2 ' ' C2 ' ' B' ' 23' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.563 3.543 0 O4'-C4'-C3' 108.619 3.019 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.567 3.901 0 C2'-C3'-O3' 116.634 2.235 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' ' DT' . . . . . 0.44 " C2'" ' C8 ' ' B' ' 27' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.558 3.958 0 N19-C1'-C2' 119.252 3.157 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . 0.595 ' C5 ' ' C6 ' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.555 3.671 0 P-O3'-C3' 122.856 2.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 0.599 ' C2 ' ' C2 ' ' B' ' 29' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.561 3.349 0 P-O3'-C3' 122.511 2.343 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.661 ' N3 ' ' N1 ' ' A' ' 4' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.565 3.672 0 O4'-C4'-C3' 108.261 2.661 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . 0.577 ' C2 ' ' C2 ' ' B' ' 31' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.538 3.358 0 O4'-C4'-C3' 107.979 2.379 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' ' DC' . . . . . 0.577 ' C2 ' ' C2 ' ' B' ' 30' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.564 3.617 0 O4'-C4'-C3' 108.302 2.702 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.92 0 P-O3'-C3' 121.98 1.9 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' P' P ' 101' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.529 3.494 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' P' P ' 102' ' ' SER . . . . . . . . . . . . . 1.8 m -146.51 101.46 3.47 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-N 113.678 -1.601 . . . . 0.0 108.656 -177.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 103' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 169.86 -26.11 0.0 OUTLIER 'General case' 0 C--N 1.389 2.311 0 CA-C-N 113.503 -1.68 . . . . 0.0 108.131 -175.083 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.16 163.06 27.83 Favored Glycine 0 C--N 1.381 3.056 0 N-CA-C 108.892 -1.683 . . . . 0.0 108.892 170.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 105' ' ' LEU . . . . . 0.817 HD13 ' HD2' ' P' ' 106' ' ' PRO . 0.0 OUTLIER -95.19 170.12 8.35 Favored Pre-proline 0 CA--C 1.581 2.138 0 CA-C-N 113.689 -1.255 . . . . 0.0 108.723 171.264 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.817 ' HD2' HD13 ' P' ' 105' ' ' LEU . 46.6 Cg_exo -46.17 93.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.397 3.127 0 C-N-CA 122.983 2.455 . . . . 0.0 110.363 155.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 107' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -139.18 146.17 40.22 Favored 'General case' 0 C--N 1.382 1.991 0 CA-C-O 122.452 1.12 . . . . 0.0 109.126 161.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 108' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.31 112.65 25.43 Favored 'General case' 0 C--N 1.383 2.027 0 CA-C-N 113.725 -1.58 . . . . 0.0 108.151 176.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 109' ' ' LYS . . . . . 0.833 ' HE3' ' H ' ' P' ' 110' ' ' ARG . 0.0 OUTLIER -64.55 165.26 10.33 Favored 'General case' 0 C--N 1.381 1.964 0 CA-C-N 113.704 -1.589 . . . . 0.0 109.05 -169.636 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 110' ' ' ARG . . . . . 0.833 ' H ' ' HE3' ' P' ' 109' ' ' LYS . 0.8 OUTLIER -123.03 57.08 1.14 Allowed 'General case' 0 C--N 1.382 1.986 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.039 -155.425 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 111' ' ' LYS . . . . . 0.472 ' HD2' " O3'" ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -82.17 87.46 6.52 Favored 'General case' 0 C--N 1.382 2.012 0 CA-C-O 123.725 1.726 . . . . 0.0 108.363 174.723 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 112' ' ' ARG . . . . . . . . . . . . . 23.3 mtt-85 -64.28 175.84 1.2 Allowed 'General case' 0 C--N 1.39 2.353 0 CA-C-N 111.801 -2.454 . . . . 0.0 108.848 155.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 113' ' ' ARG . . . . . 0.9 ' CD ' HD21 ' P' ' 115' ' ' LEU . 0.8 OUTLIER -91.24 118.44 30.48 Favored 'General case' 0 C--N 1.383 2.029 0 CA-C-N 113.686 -1.597 . . . . 0.0 107.171 160.753 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 114' ' ' VAL . . . . . 0.459 HG23 ' P ' ' A' ' 8' ' ' ' DA' . 0.0 OUTLIER -103.42 67.27 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.386 2.179 0 CA-C-O 125.349 2.499 . . . . 0.0 108.053 -162.022 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 115' ' ' LEU . . . . . 0.9 HD21 ' CD ' ' P' ' 113' ' ' ARG . 0.2 OUTLIER -76.75 108.99 10.16 Favored 'General case' 0 C--N 1.39 2.341 0 CA-C-N 111.633 -2.53 . . . . 0.0 109.405 -158.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 116' ' ' PHE . . . . . 0.4 ' CD1' ' CD2' ' P' ' 148' ' ' LEU . 2.1 m-85 -75.66 142.67 42.5 Favored 'General case' 0 C--N 1.389 2.294 0 CA-C-N 112.667 -2.06 . . . . 0.0 108.208 -170.424 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 117' ' ' THR . . . . . . . . . . . . . 1.1 p -66.01 149.48 50.17 Favored 'General case' 0 C--N 1.383 2.026 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 -171.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 118' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -45.06 -36.9 3.81 Favored 'General case' 0 C--N 1.381 1.973 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.067 -177.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 119' ' ' ALA . . . . . . . . . . . . . . . -53.5 -57.91 9.02 Favored 'General case' 0 C--N 1.382 2.002 0 CA-C-N 113.136 -1.847 . . . . 0.0 109.655 175.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 120' ' ' GLN . . . . . 0.572 ' CG ' HG13 ' P' ' 146' ' ' ILE . 81.7 mt-30 -60.9 -48.66 80.77 Favored 'General case' 0 C--N 1.382 2.01 0 C-N-CA 126.728 2.011 . . . . 0.0 109.694 179.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 121' ' ' THR . . . . . 0.691 ' HA ' HD12 ' P' ' 124' ' ' LEU . 5.7 m -47.6 -54.68 11.15 Favored 'General case' 0 C--N 1.383 2.062 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 169.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 122' ' ' TYR . . . . . 0.57 ' CZ ' ' HG3' ' P' ' 126' ' ' ARG . 0.0 OUTLIER -52.3 -51.17 60.1 Favored 'General case' 0 C--N 1.38 1.922 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.09 -170.361 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 123' ' ' GLU . . . . . 0.942 ' CD ' HG22 ' P' ' 146' ' ' ILE . 7.8 mt-10 -64.89 -37.38 87.45 Favored 'General case' 0 C--N 1.379 1.89 0 CA-C-N 113.964 -1.471 . . . . 0.0 107.601 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 124' ' ' LEU . . . . . 0.705 HD22 ' HB3' ' P' ' 156' ' ' TRP . 3.3 mt -60.82 -49.67 76.56 Favored 'General case' 0 C--N 1.384 2.097 0 O-C-N 120.967 -1.083 . . . . 0.0 110.28 171.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 125' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' P' ' 129' ' ' ARG . 27.2 mt-10 -53.97 -55.39 27.53 Favored 'General case' 0 C--N 1.38 1.905 0 CA-C-O 122.347 1.07 . . . . 0.0 108.394 176.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 126' ' ' ARG . . . . . 0.603 ' HG2' HH11 ' P' ' 126' ' ' ARG . 0.0 OUTLIER -39.08 -68.38 0.17 Allowed 'General case' 0 C--N 1.379 1.861 0 CA-C-N 111.935 -2.393 . . . . 0.0 108.882 179.697 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 127' ' ' ARG . . . . . 0.889 ' HG2' HD13 ' P' ' 142' ' ' LEU . 0.0 OUTLIER -58.54 -34.47 71.05 Favored 'General case' 0 C--N 1.394 2.536 0 CA-C-N 112.673 -2.058 . . . . 0.0 108.469 -174.831 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 128' ' ' PHE . . . . . 0.715 ' N ' ' HE1' ' P' ' 157' ' ' PHE . 9.0 t80 -67.73 -50.94 54.72 Favored 'General case' 0 C--N 1.388 2.264 0 O-C-N 121.213 -0.93 . . . . 0.0 110.382 176.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 129' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' P' ' 125' ' ' GLU . 3.2 mmm180 -62.56 -13.15 27.79 Favored 'General case' 0 C--N 1.38 1.931 0 CA-C-N 112.894 -1.957 . . . . 0.0 108.073 -165.353 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 130' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -107.88 -39.74 5.46 Favored 'General case' 0 C--N 1.379 1.886 0 C-N-CA 126.319 1.848 . . . . 0.0 107.444 -169.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 131' ' ' GLN . . . . . 0.511 ' HG3' ' CD2' ' P' ' 134' ' ' LEU . 0.4 OUTLIER -153.99 109.08 3.13 Favored 'General case' 0 C--N 1.386 2.164 0 CA-C-N 112.003 -2.362 . . . . 0.0 109.34 -152.914 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 132' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -77.04 -18.09 58.33 Favored 'General case' 0 C--N 1.393 2.479 0 CA-C-N 112.45 -2.159 . . . . 0.0 110.556 -167.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 133' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -156.81 112.51 2.92 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-N 114.212 -1.358 . . . . 0.0 108.065 -154.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 134' ' ' LEU . . . . . 0.599 HD11 ' HB3' ' P' ' 127' ' ' ARG . 20.4 mt -127.88 130.63 48.85 Favored 'General case' 0 C--N 1.398 2.701 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 -154.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.19 156.79 20.17 Favored 'General case' 0 C--N 1.382 1.987 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 136' ' ' ALA . . . . . 0.463 ' HB3' ' HD3' ' P' ' 137' ' ' PRO . . . -58.36 -43.3 98.03 Favored Pre-proline 0 CA--C 1.585 2.319 0 O-C-N 121.452 -0.78 . . . . 0.0 109.377 -158.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 137' ' ' PRO . . . . . 0.463 ' HD3' ' HB3' ' P' ' 136' ' ' ALA . 0.2 OUTLIER -56.5 -40.17 86.35 Favored 'Trans proline' 0 C--N 1.395 3.001 0 N-CA-C 119.056 2.675 . . . . 0.0 119.056 176.694 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 138' ' ' GLU . . . . . 0.459 ' HB3' HD22 ' P' ' 134' ' ' LEU . 0.2 OUTLIER -49.79 -73.7 0.04 OUTLIER 'General case' 0 C--N 1.38 1.902 0 CA-C-O 124.049 1.88 . . . . 0.0 107.497 161.721 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 139' ' ' ARG . . . . . 0.921 ' CZ ' ' HG3' ' P' ' 154' ' ' LYS . 2.1 ptt180 -69.79 -33.53 72.51 Favored 'General case' 0 C--N 1.391 2.386 0 CA-C-N 109.722 -3.399 . . . . 0.0 108.774 -156.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 140' ' ' GLU . . . . . 0.682 ' O ' ' HB3' ' P' ' 143' ' ' ALA . 1.7 mt-10 -53.1 -45.99 68.49 Favored 'General case' 0 C--N 1.38 1.928 0 CA-C-O 123.578 1.656 . . . . 0.0 108.127 174.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 141' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -66.99 -35.49 80.07 Favored 'General case' 0 C--N 1.381 1.96 0 CA-C-N 112.439 -2.164 . . . . 0.0 109.417 -164.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 142' ' ' LEU . . . . . 0.889 HD13 ' HG2' ' P' ' 127' ' ' ARG . 1.1 tp -65.31 -41.79 93.67 Favored 'General case' 0 C--N 1.382 1.987 0 CA-C-O 123.369 1.557 . . . . 0.0 108.981 169.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 143' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' P' ' 140' ' ' GLU . . . -57.04 -36.41 70.46 Favored 'General case' 0 C--N 1.39 2.36 0 CA-C-N 112.224 -2.262 . . . . 0.0 107.971 173.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 144' ' ' SER . . . . . 0.555 ' N ' ' O ' ' P' ' 140' ' ' GLU . 2.1 t -69.76 -43.07 72.98 Favored 'General case' 0 C--N 1.388 2.275 0 CA-C-N 113.22 -1.809 . . . . 0.0 111.083 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 145' ' ' LEU . . . . . . . . . . . . . 82.5 mt -69.04 -48.14 63.63 Favored 'General case' 0 C--N 1.38 1.891 0 CA-C-O 124.851 2.263 . . . . 0.0 108.205 -163.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 146' ' ' ILE . . . . . 0.966 HD11 HD12 ' P' ' 148' ' ' LEU . 0.0 OUTLIER -92.02 -13.89 8.69 Favored 'Isoleucine or valine' 0 C--N 1.389 2.325 0 CA-C-N 110.675 -2.966 . . . . 0.0 107.958 -169.407 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 147' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 82.27 36.13 0.07 Allowed 'General case' 0 C--N 1.382 1.987 0 CA-C-O 125.761 2.696 . . . . 0.0 107.66 152.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 148' ' ' LEU . . . . . 0.966 HD12 HD11 ' P' ' 146' ' ' ILE . 8.3 mt -95.18 173.82 7.37 Favored 'General case' 0 C--N 1.396 2.594 0 CA-C-N 111.353 -2.658 . . . . 0.0 109.083 166.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 149' ' ' THR . . . . . 0.426 ' O ' ' N ' ' P' ' 152' ' ' GLN . 16.6 p -89.16 148.22 40.32 Favored Pre-proline 0 CA--C 1.586 2.349 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 164.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 150' ' ' PRO . . . . . 0.544 ' HA ' ' HB2' ' P' ' 143' ' ' ALA . 86.6 Cg_exo -50.36 -51.99 9.89 Favored 'Trans proline' 0 C--N 1.408 3.69 0 C-N-CA 123.48 2.787 . . . . 0.0 113.543 -169.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 151' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.0 -11.59 3.6 Favored 'General case' 0 C--N 1.388 2.252 0 CA-C-N 113.341 -1.754 . . . . 0.0 110.782 175.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 152' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' P' ' 149' ' ' THR . 43.6 mt-30 -86.31 -30.55 22.17 Favored 'General case' 0 C--O 1.279 2.656 0 CA-C-N 120.0 1.273 . . . . 0.0 108.443 167.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 153' ' ' VAL . . . . . 0.723 HG13 ' CE2' ' P' ' 157' ' ' PHE . 1.4 t -63.52 -72.93 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.38 1.919 0 CA-C-N 123.534 2.879 . . . . 0.0 109.779 163.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 154' ' ' LYS . . . . . 0.921 ' HG3' ' CZ ' ' P' ' 139' ' ' ARG . 0.0 OUTLIER -32.43 -56.11 0.34 Allowed 'General case' 0 C--N 1.385 2.117 0 C-N-CA 124.358 1.063 . . . . 0.0 110.822 -176.68 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 155' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.81 -45.13 95.12 Favored 'Isoleucine or valine' 0 C--N 1.385 2.131 0 CA-C-N 113.549 -1.66 . . . . 0.0 108.937 -171.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 156' ' ' TRP . . . . . 0.705 ' HB3' HD22 ' P' ' 124' ' ' LEU . 2.7 t90 -62.97 -31.54 72.67 Favored 'General case' 0 C--N 1.381 1.947 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.06 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 157' ' ' PHE . . . . . 0.723 ' CE2' HG13 ' P' ' 153' ' ' VAL . 66.0 m-85 -74.87 -35.57 62.32 Favored 'General case' 0 C--O 1.279 2.623 0 O-C-N 121.275 -0.89 . . . . 0.0 111.819 170.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 158' ' ' GLN . . . . . 0.549 ' N ' ' O ' ' P' ' 154' ' ' LYS . 33.0 mt-30 -56.96 -62.76 1.52 Allowed 'General case' 0 C--N 1.378 1.817 0 O-C-N 119.047 -2.283 . . . . 0.0 106.802 169.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 159' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -56.65 -24.91 51.71 Favored 'General case' 0 C--N 1.393 2.46 0 CA-C-O 117.062 -1.447 . . . . 0.0 109.525 -166.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 160' ' ' HIS . . . . . 0.544 ' HB3' ' CE2' ' P' ' 128' ' ' PHE . 4.1 t60 -74.38 -49.19 23.67 Favored 'General case' 0 C--O 1.283 2.835 0 CA-C-N 121.463 1.938 . . . . 0.0 109.914 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 161' ' ' ARG . . . . . 0.724 ' O ' HG23 ' P' ' 164' ' ' THR . 0.0 OUTLIER -68.18 -41.88 80.81 Favored 'General case' 0 C--O 1.267 2.003 0 CA-C-N 122.19 2.268 . . . . 0.0 109.527 -160.651 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 162' ' ' TYR . . . . . 0.562 ' CZ ' ' HD2' ' P' ' 166' ' ' ARG . 40.5 t80 -66.91 -31.08 71.43 Favored 'General case' 0 C--N 1.381 1.948 0 O-C-N 119.952 -1.717 . . . . 0.0 109.514 171.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -32.25 73.69 Favored 'General case' 0 C--N 1.381 1.936 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -171.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 164' ' ' THR . . . . . 0.724 HG23 ' O ' ' P' ' 161' ' ' ARG . 0.5 OUTLIER -68.24 -57.05 6.6 Favored 'General case' 0 CA--C 1.573 1.847 0 CA-C-O 124.831 2.253 . . . . 0.0 105.384 -166.415 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 165' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -58.13 -45.79 86.71 Favored 'General case' 0 C--N 1.386 2.165 0 CA-C-N 108.428 -3.987 . . . . 0.0 109.358 -169.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 166' ' ' ARG . . . . . 0.562 ' HD2' ' CZ ' ' P' ' 162' ' ' TYR . 0.0 OUTLIER -42.04 -54.96 3.36 Favored 'General case' 0 C--N 1.382 1.984 0 CA-C-N 112.992 -1.913 . . . . 0.0 111.468 170.113 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' P' P ' 167' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' P' ' 164' ' ' THR . . . -45.61 -42.52 11.36 Favored 'General case' 0 C--N 1.392 2.42 0 CA-C-N 111.763 -2.471 . . . . 0.0 108.849 -178.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 168' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -81.7 -24.5 36.14 Favored 'General case' 0 C--N 1.385 2.128 0 CA-C-N 112.086 -2.324 . . . . 0.0 111.06 -166.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 169' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -51.95 -33.44 37.65 Favored 'General case' 0 C--N 1.388 2.245 0 CA-C-N 113.544 -1.662 . . . . 0.0 109.484 167.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 170' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -72.82 -27.41 61.94 Favored 'General case' 0 C--N 1.385 2.131 0 CA-C-N 112.62 -2.082 . . . . 0.0 109.156 -165.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 171' ' ' LYS . . . . . . . . . . . . . 26.9 mttm -88.7 104.42 16.86 Favored 'General case' 0 C--N 1.379 1.866 0 CA-C-N 113.502 -1.681 . . . . 0.0 107.794 -163.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 172' ' ' GLY . . . . . . . . . . . . . . . 47.19 75.46 0.18 Allowed Glycine 0 CA--C 1.564 3.149 0 N-CA-C 108.276 -1.93 . . . . 0.0 108.276 -152.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 173' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -32.53 146.9 0.01 OUTLIER 'General case' 0 C--N 1.389 2.293 0 CA-C-O 123.724 1.726 . . . . 0.0 109.125 169.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 174' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.0 54.12 2.65 Favored 'General case' 0 C--N 1.391 2.376 0 CA-C-N 111.009 -2.814 . . . . 0.0 109.493 175.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 175' ' ' GLY . . . . . . . . . . . . . . . -59.89 -23.09 58.64 Favored Glycine 0 C--N 1.38 2.976 0 N-CA-C 110.482 -1.047 . . . . 0.0 110.482 -154.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' P' P ' 176' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -90.89 131.08 38.38 Favored Pre-proline 0 CA--C 1.581 2.144 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 -164.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' P' P ' 177' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo . . . . . 0 CA--C 1.594 3.481 0 C-N-CA 121.565 1.51 . . . . 0.0 111.588 -156.93 . . . . . . . . 0 0 . 1 stop_ save_