data_2k2o_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 2k2o _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . 0.263 95.6 m-70 . . . . . 0 CA--C 1.479 -1.755 0 N-CA-C 104.918 -2.253 . . . . 0.0 104.918 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 928' ' ' THR . . . . . 0.523 HG23 ' HH2' ' A' ' 973' ' ' TRP . 1.5 m 62.76 89.41 0.09 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 125.301 1.625 . . . . 0.0 108.196 -171.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.535 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.5 OUTLIER -128.69 128.87 44.94 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 106.816 -1.549 . . . . 0.0 106.816 174.754 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . 0.463 ' O ' ' HG2' ' A' 1027 ' ' ARG . 87.2 t80 -121.78 136.3 54.93 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 121.495 -0.753 . . . . 0.0 109.058 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 23.4 m -69.57 120.21 15.01 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 176.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -94.98 146.81 23.99 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.745 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.3 pt-20 -152.86 158.08 41.65 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 118.436 0.562 . . . . 0.0 111.229 -169.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 3.7 p -160.53 129.37 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.408 0.623 . . . . 0.0 111.137 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.639 ' HA ' ' O ' ' A' 1021 ' ' ARG . 50.5 m-85 -88.94 112.66 23.59 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.786 -176.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -85.81 142.8 28.67 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . 1.051 ' HB3' ' HB3' ' A' 1020 ' ' ARG . 0.0 OUTLIER -144.44 162.22 37.07 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -178.329 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.604 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 44.8 mt-10 -131.18 162.2 30.48 Favored 'General case' 0 C--O 1.246 0.91 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 16.6 t -135.16 146.25 48.57 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.203 176.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.533 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 18.1 ptt180 -152.58 162.42 41.25 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -176.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -67.49 152.58 96.08 Favored Pre-proline 0 C--N 1.31 -1.141 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 171.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -56.89 94.42 0.06 OUTLIER 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 122.1 1.866 . . . . 0.0 112.98 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 94.07 65.44 1.03 Allowed Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 108.071 -2.012 . . . . 0.0 108.071 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -159.33 -156.4 8.06 Favored Glycine 0 N--CA 1.435 -1.418 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.349 -173.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -105.27 125.17 50.69 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.321 -0.94 . . . . 0.0 110.04 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.604 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 56.5 m95 -80.14 147.89 31.18 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-O 121.619 0.724 . . . . 0.0 109.9 -177.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -128.66 171.33 8.81 Favored Pre-proline 0 C--N 1.298 -1.667 0 N-CA-C 103.475 -2.787 . . . . 0.0 103.475 174.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -59.17 135.97 69.56 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 CA-C-N 121.245 1.48 . . . . 0.0 109.801 175.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -58.9 174.06 0.38 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.976 0.893 . . . . 0.0 112.338 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -69.63 -38.47 77.2 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.189 -1.368 . . . . 0.0 107.494 -178.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -122.4 104.23 9.26 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 104.64 -2.356 . . . . 0.0 104.64 170.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 17.5 m -68.02 -52.84 30.9 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -172.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -97.58 125.2 42.17 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.175 173.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 13.0 p -140.9 173.28 11.64 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.681 -171.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -94.68 167.07 11.69 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 171.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.0 -28.84 18.4 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.765 0.711 . . . . 0.0 112.2 177.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -82.05 -39.76 23.01 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.22 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 139.86 -10.75 3.12 Favored Glycine 0 CA--C 1.498 -0.991 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.888 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -60.51 109.23 0.96 Allowed 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 121.193 0.52 . . . . 0.0 110.494 177.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . 0.427 ' HD3' ' N ' ' A' ' 961' ' ' ALA . 9.5 tmtt? -47.52 126.57 10.04 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.581 -1.645 . . . . 0.0 110.698 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.427 ' N ' ' HD3' ' A' ' 960' ' ' LYS . . . -122.74 173.57 7.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.731 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -69.08 160.87 30.21 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.874 0.369 . . . . 0.0 110.337 178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.95 153.95 41.88 Favored Pre-proline 0 N--CA 1.435 -1.199 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -177.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.54 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.4 Cg_exo -47.18 -33.16 15.18 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 124.51 3.473 . . . . 0.0 115.866 -178.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.2 p -71.22 -45.0 64.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.879 0.847 . . . . 0.0 110.182 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -64.47 -27.43 68.98 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.42 -1.263 . . . . 0.0 110.285 175.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 81.2 mt -74.36 110.66 8.82 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 122.072 0.939 . . . . 0.0 110.11 176.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.3 p -129.01 165.11 21.79 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.99 -172.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 12.0 p -81.09 128.2 71.69 Favored Pre-proline 0 N--CA 1.441 -0.916 0 CA-C-O 121.239 0.542 . . . . 0.0 110.638 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.597 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 58.8 Cg_endo -82.27 165.73 16.57 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.562 2.174 . . . . 0.0 109.722 175.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -59.23 112.19 1.15 Allowed 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 121.551 1.501 . . . . 0.0 110.112 173.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . . . . . . . . . . . 114.04 -4.18 23.97 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.83 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.597 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 92.9 m95 -126.18 132.9 51.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 122.225 1.012 . . . . 0.0 111.793 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.662 ' HB2' HE22 ' A' 1033 ' ' GLN . 8.1 tp10 -112.22 129.45 56.26 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 112.797 -2.001 . . . . 0.0 108.162 -175.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.507 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 94.1 m95 -70.85 138.81 50.58 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.644 -1.222 . . . . 0.0 111.129 172.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . 0.602 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 9.8 tp10 -100.88 -47.59 4.74 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.003 -0.999 . . . . 0.0 108.543 -177.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . 0.578 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.8 m-20 -85.88 161.09 19.23 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.155 -177.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -93.17 108.97 20.47 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.377 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . 0.507 ' C ' ' HD3' ' A' 1025 ' ' ARG . . . 55.49 178.05 0.03 OUTLIER 'General case' 0 C--O 1.234 0.254 0 CA-C-O 122.72 1.248 . . . . 0.0 113.491 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.56 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 51.9 m95 -88.09 118.45 27.67 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 113.606 -1.634 . . . . 0.0 108.066 177.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 981' ' ' SER . . . . . 0.649 ' O ' ' HA ' ' A' 1023 ' ' LEU . 34.7 m -110.2 -165.05 0.97 Allowed 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 -177.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -112.89 145.41 40.75 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 121.242 1.837 . . . . 0.0 109.432 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.457 ' HB2' HG13 ' A' 1024 ' ' VAL . 55.3 t0 -86.56 120.15 27.57 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -175.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.3 pp -116.24 15.45 7.72 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.349 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -99.12 30.04 3.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 123.036 1.398 . . . . 0.0 108.257 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.494 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 70.3 mtp85 -138.68 174.05 10.94 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.584 -177.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -80.74 79.62 7.35 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 171.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.581 HG12 ' HG2' ' A' ' 994' ' ' GLU . 25.7 m -135.84 161.09 38.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.97 -175.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.34 168.65 0.34 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.633 0.583 . . . . 0.0 110.553 171.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -54.73 -34.66 62.77 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-O 120.903 0.383 . . . . 0.0 111.314 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -101.03 7.36 43.47 Favored 'General case' 0 N--CA 1.427 -1.618 0 C-N-CA 119.004 -1.079 . . . . 0.0 111.469 -178.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 100.87 -20.8 46.36 Favored Glycine 0 C--O 1.224 -0.494 0 CA-C-N 116.122 -0.49 . . . . 0.0 113.803 173.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 83.1 m95 -54.19 121.7 8.72 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.581 ' HG2' HG12 ' A' ' 988' ' ' VAL . 22.6 mt-10 -99.37 153.63 18.83 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.039 177.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.725 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 27.6 t80 -79.01 94.27 5.26 Favored 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 126.783 2.033 . . . . 0.0 111.918 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -110.17 96.53 0.94 Allowed Glycine 0 N--CA 1.435 -1.423 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 177.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.512 HD13 ' HB3' ' A' 1015 ' ' TYR . 1.1 tt -98.42 130.1 47.73 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.194 0 O-C-N 122.139 -0.624 . . . . 0.0 110.197 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 7.1 m -108.12 85.45 2.12 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.989 -178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 16.2 pt -78.68 121.28 83.37 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.21 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -69.94 135.67 30.62 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.05 1.833 . . . . 0.0 111.373 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -92.63 144.84 11.2 Favored 'Cis proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.23 -1.571 . . . . 0.0 114.331 -0.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 22.7 t0 163.33 155.64 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 112.176 -2.284 . . . . 0.0 105.994 177.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -99.55 -34.92 10.05 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.022 0.439 . . . . 0.0 110.339 -175.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1004 ' ' LYS . . . . . 0.513 ' H ' ' HD2' ' A' 1004 ' ' LYS . 0.0 OUTLIER -123.55 154.0 66.26 Favored Pre-proline 0 C--N 1.317 -0.829 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.172 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -58.49 127.75 25.83 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.25 2.634 . . . . 0.0 110.291 163.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 20.5 pttm -117.88 13.32 14.02 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.196 0.998 . . . . 0.0 109.608 178.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 29.9 t -143.54 136.1 27.24 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 113.908 -1.496 . . . . 0.0 107.766 -178.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.592 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 62.9 m95 -134.09 140.15 46.42 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 124.478 1.111 . . . . 0.0 108.966 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 92.8 t -140.51 157.77 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -83.03 8.76 11.88 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -121.23 134.78 55.2 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 121.278 -0.888 . . . . 0.0 111.603 -175.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.678 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.7 tp10 -69.56 105.1 2.54 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.52 ' H ' ' CE1' ' A' 1016 ' ' HIS . 95.0 mttt -109.26 147.15 33.08 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.743 -1.571 . . . . 0.0 108.47 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 26.5 ptt? -56.27 -36.09 68.19 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -178.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1015 ' ' TYR . . . . . 0.512 ' HB3' HD13 ' A' ' 997' ' ' ILE . 58.9 m-85 -60.93 -4.27 0.97 Allowed 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.725 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 2.6 m80 -54.67 108.03 0.35 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.63 -25.44 16.77 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 123.585 1.659 . . . . 0.0 106.912 173.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -141.71 150.73 42.22 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 111.865 -2.425 . . . . 0.0 109.466 -177.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.5 ' HB3' ' CD2' ' A' 1016 ' ' HIS . 35.2 ptt180 -151.87 141.77 22.03 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 171.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 1.051 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . 4.9 ptp180 -149.63 161.88 41.31 Favored 'General case' 0 CA--C 1.481 -1.687 0 C-N-CA 118.532 -1.267 . . . . 0.0 109.977 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.639 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.9 ptt180 -148.0 149.39 32.05 Favored 'General case' 0 C--N 1.298 -1.673 0 C-N-CA 119.431 -0.907 . . . . 0.0 110.969 -177.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.745 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 37.2 ttm180 -83.83 115.09 22.08 Favored 'General case' 0 N--CA 1.423 -1.806 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.455 -177.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.649 ' HA ' ' O ' ' A' ' 981' ' ' SER . 72.4 mt -80.44 129.66 34.66 Favored 'General case' 0 N--CA 1.425 -1.718 0 N-CA-C 105.179 -2.156 . . . . 0.0 105.179 166.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.457 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.6 m -111.83 133.63 56.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 CA-C-O 121.733 0.778 . . . . 0.0 112.721 -174.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.529 ' HG3' ' HB2' ' A' ' 977' ' ' ASP . 14.6 ttp180 -150.26 101.66 3.01 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 112.926 -1.943 . . . . 0.0 109.373 166.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.602 ' HE2' ' HG2' ' A' ' 976' ' ' GLU . 0.0 OUTLIER -79.43 154.21 29.11 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 -178.29 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.507 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 7.5 ptm180 -136.4 165.75 25.07 Favored 'General case' 0 CA--C 1.488 -1.432 0 N-CA-C 105.076 -2.194 . . . . 0.0 105.076 -170.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 30.4 ttmt -149.9 142.6 24.6 Favored 'General case' 0 C--N 1.281 -2.403 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 -172.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1029 ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -91.37 -13.2 32.89 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 123.568 1.651 . . . . 0.0 107.581 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 25.0 t0 52.69 23.35 2.64 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 111.454 -2.612 . . . . 0.0 110.225 -173.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 25.4 tp 66.38 -47.32 0.43 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.224 2.21 . . . . 0.0 113.284 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 14.6 t -79.02 -21.7 46.56 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -171.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.662 HE22 ' HB2' ' A' ' 974' ' ' GLU . 43.2 mt-30 . . . . . 0 N--CA 1.463 0.211 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -175.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . 0.533 ' HB2' ' OE1' ' A' ' 929' ' ' GLU . 79.7 m-70 . . . . . 0 CA--C 1.5 -0.957 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 928' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' A' 1029 ' ' LYS . 4.7 m 64.19 87.89 0.11 Allowed 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -167.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.689 ' HB3' ' HD3' ' A' 1028 ' ' LYS . 0.8 OUTLIER -121.67 168.02 12.26 Favored 'General case' 0 C--N 1.27 -2.863 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . 0.527 ' O ' ' HG2' ' A' 1027 ' ' ARG . 81.6 t80 -149.51 124.74 10.14 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -176.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 931' ' ' THR . . . . . . . . . . . . . 70.0 m -78.52 113.83 16.9 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 174.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -92.47 163.3 13.89 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 105.715 -1.958 . . . . 0.0 105.715 -174.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.59 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -164.28 142.31 7.01 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 120.265 -0.574 . . . . 0.0 109.791 -172.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.406 HG11 HD12 ' A' ' 967' ' ' LEU . 34.1 m -143.29 126.5 13.31 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 175.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.584 ' HA ' ' O ' ' A' 1021 ' ' ARG . 29.9 m-85 -84.18 149.47 26.13 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.67 -0.644 . . . . 0.0 110.164 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.534 ' O ' ' HA ' ' A' 1020 ' ' ARG . 13.3 tt0 -119.91 121.22 38.55 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -109.28 146.34 34.45 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.15 0.976 . . . . 0.0 112.666 -174.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.554 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 39.6 mt-10 -138.34 160.56 39.18 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 112.909 -1.95 . . . . 0.0 106.54 170.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 15.4 m -145.39 151.48 38.33 Favored 'General case' 0 C--N 1.311 -1.065 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -176.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.576 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 26.9 ptt180 -146.13 160.7 41.57 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.298 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -75.62 163.55 66.52 Favored Pre-proline 0 C--N 1.315 -0.928 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 169.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -68.5 89.22 0.41 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 CA-C-N 120.357 1.163 . . . . 0.0 109.993 172.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 129.41 -1.05 6.04 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 110.262 -1.135 . . . . 0.0 110.262 -174.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . 0.576 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -100.99 -171.93 28.77 Favored Glycine 0 CA--C 1.502 -0.749 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 177.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -122.5 154.84 37.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 119.204 1.502 . . . . 0.0 107.094 172.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.557 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 24.8 m95 -61.72 135.73 57.72 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.709 0.766 . . . . 0.0 112.302 -173.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -135.56 167.27 23.11 Favored Pre-proline 0 C--N 1.307 -1.256 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -49.16 128.42 19.71 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.496 2.13 . . . . 0.0 112.931 -179.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -74.32 -162.31 0.15 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.543 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -89.7 -52.92 4.75 Favored 'General case' 0 CA--C 1.483 -1.603 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -109.17 92.06 3.9 Favored 'General case' 0 N--CA 1.411 -2.382 0 N-CA-C 104.983 -2.229 . . . . 0.0 104.983 -176.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 10.4 m -57.97 -58.06 10.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.672 -172.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 89.1 m-85 -104.97 136.68 43.98 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.062 -0.655 . . . . 0.0 111.37 178.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 3.0 p -149.66 -178.08 6.24 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.039 0.936 . . . . 0.0 112.333 -168.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . 0.47 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 6.5 t70 -108.95 164.94 11.96 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 173.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -54.4 -29.16 48.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 119.379 0.99 . . . . 0.0 111.494 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -82.41 -8.37 59.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 177.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 100.61 -3.7 56.31 Favored Glycine 0 CA--C 1.501 -0.833 0 C-N-CA 119.918 -1.134 . . . . 0.0 112.133 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . 0.47 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 30.6 t70 -59.41 99.15 0.05 Allowed 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 175.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -52.56 129.69 29.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.226 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.11 171.34 8.17 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.666 -176.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -74.53 160.62 30.67 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.1 m -85.67 151.83 56.12 Favored Pre-proline 0 N--CA 1.423 -1.792 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.462 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 2.8 Cg_endo -47.52 -29.89 11.09 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 125.119 3.879 . . . . 0.0 117.729 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 51.1 m -88.23 -35.61 17.21 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 118.98 0.809 . . . . 0.0 109.55 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -65.4 -25.94 67.77 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.009 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.474 HD11 ' CH2' ' A' ' 980' ' ' TRP . 32.9 mt -74.75 122.4 23.22 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.685 0.794 . . . . 0.0 110.351 176.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 24.0 p -124.77 169.53 11.91 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.368 -174.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.565 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 25.6 p -92.7 133.74 28.85 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.26 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.57 ' HG2' ' HB2' ' A' ' 973' ' ' TRP . 93.6 Cg_endo -75.79 170.52 20.01 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.328 2.018 . . . . 0.0 110.835 176.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -56.67 -19.93 32.54 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.201 2.601 . . . . 0.0 115.227 -176.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.668 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . -116.07 14.98 16.19 Favored Glycine 0 N--CA 1.439 -1.103 0 C-N-CA 120.474 -0.869 . . . . 0.0 112.708 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.57 ' HB2' ' HG2' ' A' ' 970' ' ' PRO . 96.4 m95 -129.13 127.78 42.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 118.014 0.907 . . . . 0.0 110.793 178.471 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.424 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 8.9 tp10 -106.4 118.18 35.97 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.616 2.366 . . . . 0.0 108.528 -173.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.637 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 42.8 m95 -69.55 105.12 2.55 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.107 -1.037 . . . . 0.0 111.135 176.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -71.15 -51.09 26.93 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 174.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -74.43 144.84 44.11 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.774 -172.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.63 -36.53 68.04 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -178.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -166.8 150.27 6.84 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.96 0.41 . . . . 0.0 110.806 -174.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.56 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 35.1 m95 -64.68 120.24 12.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 981' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' 1023 ' ' LEU . 19.9 m -115.6 -172.28 2.12 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -174.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -109.88 143.78 39.3 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 120.472 1.487 . . . . 0.0 109.695 -177.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.478 ' HB3' ' HD2' ' A' 1022 ' ' ARG . 17.2 t70 -106.16 131.54 53.29 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.365 -171.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.2 pp -109.33 29.63 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.631 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -106.4 30.51 5.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.952 1.358 . . . . 0.0 107.742 -174.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -138.95 -177.1 4.73 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -178.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -86.79 77.68 9.23 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 173.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.502 HG11 ' HB3' ' A' ' 994' ' ' GLU . 30.3 m -137.1 156.67 34.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.529 -172.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -55.02 165.94 0.59 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.792 -1.094 . . . . 0.0 110.995 170.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -52.88 -25.25 11.09 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 123.582 0.753 . . . . 0.0 112.871 176.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . 0.41 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 95.4 mttt -106.77 13.03 28.42 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.812 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.32 -13.23 66.97 Favored Glycine 0 C--O 1.224 -0.473 0 CA-C-N 115.967 -0.56 . . . . 0.0 113.383 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.47 ' HE3' ' HG2' ' A' 1019 ' ' ARG . 79.4 m95 -59.31 115.38 3.19 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.502 ' HB3' HG11 ' A' ' 988' ' ' VAL . 4.5 pt-20 -105.41 159.25 16.06 Favored 'General case' 0 C--O 1.257 1.451 0 CA-C-O 121.992 0.901 . . . . 0.0 112.543 176.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.791 ' HA ' ' HE2' ' A' 1016 ' ' HIS . 57.1 t80 -83.08 103.0 12.18 Favored 'General case' 0 C--O 1.209 -1.068 0 C-N-CA 128.019 2.528 . . . . 0.0 113.714 -172.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -127.23 137.99 10.24 Favored Glycine 0 N--CA 1.439 -1.152 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 172.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' 1005 ' ' PRO . 0.6 OUTLIER -133.44 149.65 31.41 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 177.13 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 28.8 m -127.82 103.77 7.46 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 121.203 0.525 . . . . 0.0 109.832 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 18.0 pt -95.51 114.18 63.37 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.37 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1000 ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 33.0 Cg_endo -65.87 138.16 51.98 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 122.518 2.145 . . . . 0.0 112.931 -177.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1001 ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 6.6 Cg_endo -89.92 138.53 12.77 Favored 'Cis proline' 0 N--CA 1.45 -1.071 0 C-N-CA 123.143 -1.607 . . . . 0.0 113.883 -1.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 30.9 t0 165.16 151.19 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 111.604 -2.544 . . . . 0.0 104.664 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -112.22 -35.91 5.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 120.631 1.559 . . . . 0.0 110.588 -175.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -96.84 142.33 24.38 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-O 120.934 0.397 . . . . 0.0 111.772 -178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1005 ' ' PRO . . . . . 0.504 ' HA ' ' O ' ' A' ' 997' ' ' ILE . 77.5 Cg_exo -62.66 123.21 11.94 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 N-CA-C 107.405 -1.806 . . . . 0.0 107.405 162.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 34.3 mttm -75.5 -12.61 60.27 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.199 0.523 . . . . 0.0 111.783 -175.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 39.3 t -150.07 151.74 33.69 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 -165.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.707 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 59.4 m95 -138.41 131.95 30.65 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 125.457 1.723 . . . . 0.0 107.254 174.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.431 HG11 ' H ' ' A' 1010 ' ' ALA . 21.3 t -150.18 170.56 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -171.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1010 ' ' ALA . . . . . 0.431 ' H ' HG11 ' A' 1009 ' ' VAL . . . -94.37 95.22 8.74 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 176.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -169.26 172.51 7.24 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.905 -175.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.642 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.2 OUTLIER -150.7 97.68 2.52 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 122.69 1.233 . . . . 0.0 109.238 176.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.586 ' HD3' ' CE1' ' A' ' 995' ' ' TYR . 57.7 mtpt -115.87 144.25 44.29 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 112.869 -1.969 . . . . 0.0 110.084 -176.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 55.5 ttp -46.27 -35.11 4.97 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 124.887 1.275 . . . . 0.0 113.875 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -62.34 -13.0 24.27 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.812 0.339 . . . . 0.0 111.178 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.791 ' HE2' ' HA ' ' A' ' 995' ' ' TYR . 0.4 OUTLIER -48.94 106.14 0.1 Allowed 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.0 177.253 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -18.57 13.91 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.15 175.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -139.73 147.17 40.5 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.169 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.47 ' HG2' ' HE3' ' A' ' 993' ' ' TRP . 50.3 ttp180 -147.58 147.63 30.27 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.579 ' HG2' ' CZ3' ' A' 1008 ' ' TRP . 3.6 ptp180 -155.44 167.78 29.26 Favored 'General case' 0 C--O 1.201 -1.471 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.935 176.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.584 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 28.1 ptt180 -149.93 156.31 41.51 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 123.713 0.633 . . . . 0.0 109.753 177.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.59 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 34.5 ttm180 -88.69 128.25 35.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 117.794 0.27 . . . . 0.0 110.612 177.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' A' ' 981' ' ' SER . 87.2 mt -101.67 128.28 48.04 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 106.924 -1.509 . . . . 0.0 106.924 168.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.491 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 4.5 m -107.44 139.1 30.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.14 0 CA-C-O 121.543 0.687 . . . . 0.0 111.93 -174.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.5 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.1 tpt180 -135.61 104.41 5.79 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.1 171.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.702 ' HE2' ' HE3' ' A' 1028 ' ' LYS . 0.9 OUTLIER -72.4 136.76 46.15 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.046 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.637 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.4 ptm180 -138.03 144.46 41.05 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -172.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.702 ' HE3' ' HE2' ' A' 1026 ' ' LYS . 30.4 mmtp -108.61 150.3 27.71 Favored 'General case' 0 CA--C 1.468 -2.2 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.822 -175.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 35.1 ttmt -99.26 -16.46 18.5 Favored 'General case' 0 C--N 1.275 -2.656 0 N-CA-C 103.996 -2.594 . . . . 0.0 103.996 161.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1030 ' ' ASP . . . . . 0.479 ' C ' ' H ' ' A' 1032 ' ' THR . 8.6 t70 49.27 16.1 0.14 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 111.217 -2.72 . . . . 0.0 111.376 -174.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 29.5 tp 55.74 -37.58 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 127.864 2.465 . . . . 0.0 113.247 -172.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1032 ' ' THR . . . . . 0.479 ' H ' ' C ' ' A' 1030 ' ' ASP . 9.0 t -74.79 -14.08 60.66 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.405 1.082 . . . . 0.0 112.878 -178.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.668 ' HB3' ' HA2' ' A' ' 972' ' ' GLY . 11.5 mm-40 . . . . . 0 N--CA 1.483 1.179 0 CA-C-N 118.999 0.818 . . . . 0.0 109.908 177.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 . . . . . 0 CA--C 1.495 -1.136 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.16 124.01 47.01 Favored 'General case' 0 N--CA 1.415 -2.223 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 163.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.487 ' HB2' ' HE3' ' A' 1026 ' ' LYS . 0.1 OUTLIER -141.67 133.0 26.56 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 171.194 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . 0.414 ' O ' ' HG2' ' A' 1027 ' ' ARG . 73.2 t80 -128.36 135.65 49.85 Favored 'General case' 0 C--N 1.295 -1.771 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 -176.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 34.0 m -77.5 124.45 27.92 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -105.06 159.4 15.86 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 105.153 -2.166 . . . . 0.0 105.153 -173.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.745 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 11.9 pt-20 -151.1 152.55 33.55 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.105 -175.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.601 ' O ' ' HA ' ' A' 1022 ' ' ARG . 8.6 p -137.03 178.63 4.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 N-CA-C 106.438 -1.689 . . . . 0.0 106.438 176.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.535 ' HA ' ' O ' ' A' 1021 ' ' ARG . 49.8 m-85 -142.79 113.11 7.23 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 118.755 0.707 . . . . 0.0 110.761 -174.354 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.581 ' O ' ' HA ' ' A' 1020 ' ' ARG . 31.3 tt0 -79.3 127.42 32.04 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.944 0.778 . . . . 0.0 110.046 173.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . 0.438 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 33.5 m-80 -118.53 152.41 36.02 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.62 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 43.5 mt-10 -140.86 162.11 36.21 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 171.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 24.7 p -137.62 142.37 41.23 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.544 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 15.0 ptt180 -151.63 160.05 43.8 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 123.779 0.832 . . . . 0.0 108.92 -178.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -66.29 161.23 59.33 Favored Pre-proline 0 C--N 1.311 -1.087 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 171.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.64 97.76 0.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 121.554 1.503 . . . . 0.0 111.396 175.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 89.27 62.56 1.34 Allowed Glycine 0 N--CA 1.441 -0.983 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 -178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -156.25 -159.65 9.54 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 121.096 -0.573 . . . . 0.0 111.929 -175.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -103.24 133.08 48.92 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 123.989 0.464 . . . . 0.0 110.263 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.62 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 42.2 m95 -80.78 147.41 30.5 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-O 121.3 0.571 . . . . 0.0 109.876 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -127.56 151.29 74.91 Favored Pre-proline 0 C--N 1.296 -1.758 0 N-CA-C 103.018 -2.956 . . . . 0.0 103.018 170.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -49.35 140.15 27.3 Favored 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 122.426 2.084 . . . . 0.0 111.66 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.64 -178.17 0.38 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.435 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -89.73 -40.11 12.72 Favored 'General case' 0 CA--C 1.473 -1.995 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -120.18 88.15 2.88 Favored 'General case' 0 N--CA 1.399 -3.023 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 31.8 m -64.64 -57.79 8.09 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.715 -1.13 . . . . 0.0 112.384 -170.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -92.77 129.27 38.74 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.725 0.774 . . . . 0.0 111.436 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 954' ' ' THR . . . . . 0.552 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 12.9 p -149.61 178.44 8.84 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.133 -169.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -99.27 172.99 7.0 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 105.567 -2.012 . . . . 0.0 105.567 173.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -53.07 -31.55 42.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.931 0.787 . . . . 0.0 111.437 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -84.16 -7.78 59.27 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.588 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . 0.552 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 74.76 56.52 4.9 Favored Glycine 0 CA--C 1.49 -1.525 0 C-N-CA 120.194 -1.003 . . . . 0.0 111.27 -174.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -105.17 109.66 21.73 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.499 -3.149 . . . . 0.0 102.499 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -46.58 115.95 1.18 Allowed 'General case' 0 C--N 1.319 -0.748 0 O-C-N 124.481 1.113 . . . . 0.0 111.164 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -122.42 -177.26 3.57 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.858 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . 0.535 ' HB2' ' HB2' ' A' ' 966' ' ' GLU . . . -80.52 161.62 24.74 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 176.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.0 m -80.69 159.94 68.01 Favored Pre-proline 0 C--N 1.314 -0.95 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.689 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 41.7 Cg_exo -46.38 -33.8 13.16 Favored 'Trans proline' 0 N--CA 1.478 0.56 0 C-N-CA 123.674 2.916 . . . . 0.0 115.047 -178.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 2.5 p -72.57 -47.51 47.49 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.507 0.67 . . . . 0.0 110.086 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . 0.535 ' HB2' ' HB2' ' A' ' 962' ' ' ALA . 40.0 mt-10 -64.84 -32.86 74.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.112 -1.403 . . . . 0.0 110.488 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.501 HD13 ' CH2' ' A' ' 980' ' ' TRP . 14.5 mt -60.9 110.41 1.33 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.923 0.868 . . . . 0.0 111.175 178.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 18.7 p -104.64 164.35 11.82 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.282 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 14.2 p -97.98 136.04 21.22 Favored Pre-proline 0 N--CA 1.442 -0.835 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.421 175.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.567 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 77.8 Cg_endo -71.76 175.57 9.44 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 123.683 2.922 . . . . 0.0 110.492 177.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.53 -46.59 30.76 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.643 2.228 . . . . 0.0 114.011 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . . . . . . . . . . . -72.11 -51.96 12.58 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.732 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.567 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 96.6 m95 -72.01 144.31 48.86 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -177.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.529 ' HB3' ' O ' ' A' 1028 ' ' LYS . 2.6 tp10 -133.47 156.51 47.6 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 113.297 -1.774 . . . . 0.0 106.455 -177.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.48 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 82.6 m95 -89.56 152.11 21.59 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.616 -0.678 . . . . 0.0 110.703 172.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -131.1 -33.78 1.5 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.54 0.686 . . . . 0.0 109.396 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . 0.454 ' HB3' ' HD2' ' A' 1025 ' ' ARG . 8.2 t0 -71.44 151.49 43.95 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.83 -47.49 74.84 Favored 'General case' 0 C--N 1.318 -0.788 0 O-C-N 123.527 0.517 . . . . 0.0 111.253 -176.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -164.72 171.97 13.64 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -174.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.689 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 31.6 m95 -84.86 87.13 7.31 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.884 0.849 . . . . 0.0 109.14 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 3.2 m -93.45 145.43 24.5 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.715 -1.129 . . . . 0.0 108.575 -176.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . 0.44 ' HA ' ' O ' ' A' 1022 ' ' ARG . 3.5 p90 -73.39 136.03 44.31 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 121.919 0.866 . . . . 0.0 110.722 -176.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.562 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 4.4 t70 -82.92 141.02 32.49 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 113.668 -1.606 . . . . 0.0 111.746 -172.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.5 pp -132.29 5.63 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.442 176.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . 0.565 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 17.1 m120 -92.31 18.91 7.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.042 0.449 . . . . 0.0 111.845 -175.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.565 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 8.2 mpt_? -143.87 -178.27 5.84 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 106.344 -1.725 . . . . 0.0 106.344 -178.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.15 83.73 2.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 118.71 0.687 . . . . 0.0 112.008 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 15.8 m -143.65 157.63 16.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 C-N-CA 124.666 1.186 . . . . 0.0 107.966 178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -55.22 173.01 0.11 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.599 0.36 . . . . 0.0 110.765 175.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.59 -31.4 72.61 Favored 'General case' 0 CA--C 1.492 -1.265 0 O-C-N 121.282 -0.886 . . . . 0.0 110.422 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . 0.422 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 24.4 mtmm -92.6 0.3 57.41 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.038 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.7 -21.16 41.58 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 112.257 -0.337 . . . . 0.0 112.257 175.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.422 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 81.6 m95 -50.6 124.96 11.89 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -99.1 157.63 16.22 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.871 -1.059 . . . . 0.0 109.287 176.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.728 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 86.5 t80 -82.63 86.38 6.84 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 113.366 -1.743 . . . . 0.0 109.096 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . 0.466 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -109.66 84.04 0.35 Allowed Glycine 0 CA--C 1.49 -1.484 0 C-N-CA 120.137 -1.03 . . . . 0.0 111.369 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.459 HD13 HD11 ' A' ' 999' ' ' ILE . 0.4 OUTLIER -92.16 131.92 37.93 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 CA-C-O 121.696 0.76 . . . . 0.0 110.722 -176.37 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 998' ' ' THR . . . . . 0.467 ' HG1' ' HG3' ' A' 1005 ' ' PRO . 4.0 m -132.07 121.88 24.54 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.459 HD11 HD13 ' A' ' 997' ' ' ILE . 59.3 mt -115.24 98.25 50.08 Favored Pre-proline 0 C--N 1.316 -0.859 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -175.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -62.27 132.23 37.82 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.403 2.069 . . . . 0.0 113.405 -176.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -79.46 143.92 70.26 Favored 'Cis proline' 0 CA--C 1.51 -0.698 0 C-N-CA 123.117 -1.618 . . . . 0.0 112.293 -1.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 5.8 t0 -147.2 -174.8 4.61 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 113.764 -1.562 . . . . 0.0 107.883 -173.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -116.16 -61.77 1.68 Allowed 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -160.52 157.85 24.5 Favored Pre-proline 0 C--N 1.315 -0.901 0 N-CA-C 101.907 -3.368 . . . . 0.0 101.907 -177.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1005 ' ' PRO . . . . . 0.467 ' HG3' ' HG1' ' A' ' 998' ' ' THR . 53.7 Cg_exo -59.12 121.11 9.39 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 CA-C-N 122.172 1.811 . . . . 0.0 109.864 174.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 60.6 mttt -66.04 -29.02 69.3 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -177.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.0 t -145.29 140.65 27.94 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 114.438 -1.256 . . . . 0.0 109.286 -165.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.53 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 63.8 m95 -126.12 138.66 53.7 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 125.213 1.57 . . . . 0.0 107.322 176.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.567 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 34.5 t -139.87 166.83 20.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 -176.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1010 ' ' ALA . . . . . 0.492 ' H ' HG11 ' A' 1009 ' ' VAL . . . -92.98 24.41 3.71 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -171.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -135.85 137.28 41.33 Favored 'General case' 0 C--N 1.315 -0.917 0 O-C-N 121.39 -0.819 . . . . 0.0 111.06 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.611 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.3 OUTLIER -92.57 132.41 36.87 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 175.851 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 96.2 mttt -152.53 176.83 11.28 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 -171.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1014 ' ' MET . . . . . 0.404 ' SD ' ' N ' ' A' 1014 ' ' MET . 0.0 OUTLIER -82.56 6.39 17.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.67 0.747 . . . . 0.0 111.008 -178.002 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -90.99 7.92 37.92 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 122.481 1.134 . . . . 0.0 108.243 175.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.728 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 20.7 m80 -88.12 172.29 9.62 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 114.168 -1.378 . . . . 0.0 111.812 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -158.0 -35.77 0.07 Allowed 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 112.3 -2.227 . . . . 0.0 106.266 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1018 ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 996' ' ' GLY . 35.1 m170 -132.08 151.65 51.65 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 170.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 34.4 ptt180 -149.05 148.44 29.72 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 173.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.581 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.7 ptp180 -151.34 152.18 32.79 Favored 'General case' 0 CA--C 1.482 -1.657 0 C-N-CA 117.672 -1.611 . . . . 0.0 110.804 176.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.535 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 25.0 ptt180 -128.08 142.83 51.09 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.624 -177.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.745 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 32.8 ttm180 -78.43 123.32 26.9 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 114.243 -1.344 . . . . 0.0 110.27 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1023 ' ' LEU . . . . . . . . . . . . . 17.5 mt -103.88 129.85 51.42 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 103.978 -2.601 . . . . 0.0 103.978 168.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.448 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 17.0 m -105.87 133.68 49.56 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 O-C-N 123.63 0.582 . . . . 0.0 111.316 -172.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.454 ' HD2' ' HB3' ' A' ' 977' ' ' ASP . 13.4 tpt180 -135.52 103.98 5.66 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 172.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.6 OUTLIER -70.39 138.36 51.24 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.843 -1.54 . . . . 0.0 106.843 177.9 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.48 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 15.0 ptm180 -131.21 143.36 50.53 Favored 'General case' 0 CA--C 1.488 -1.439 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 -173.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.529 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 28.7 ttmt -132.77 134.35 44.6 Favored 'General case' 0 C--N 1.281 -2.371 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -175.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.613 ' C ' ' H ' ' A' 1031 ' ' LEU . 36.3 ttmt -84.17 -22.19 31.06 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 122.795 1.284 . . . . 0.0 107.815 -177.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 34.3 t70 65.6 -33.53 0.17 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 127.928 2.491 . . . . 0.0 112.566 -173.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1031 ' ' LEU . . . . . 0.613 ' H ' ' C ' ' A' 1029 ' ' LYS . 21.9 tp 87.55 9.92 0.15 Allowed 'General case' 0 C--N 1.309 -1.16 0 C-N-CA 128.698 2.799 . . . . 0.0 109.718 174.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 4.4 m -112.69 -8.93 13.76 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 17.6 tt0 . . . . . 0 N--CA 1.439 -1.013 0 CA-C-N 113.534 -1.666 . . . . 0.0 109.654 -174.76 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . 0.51 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 25.2 m-70 . . . . . 0 CA--C 1.503 -0.864 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.65 122.03 45.21 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 160.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.706 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.0 OUTLIER -108.66 175.45 5.46 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.197 175.1 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . 0.726 ' O ' ' HG2' ' A' 1027 ' ' ARG . 85.3 t80 -159.82 119.49 2.91 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 176.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 931' ' ' THR . . . . . . . . . . . . . 27.9 m -73.14 123.26 23.26 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 171.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . 0.646 ' HB2' ' HD2' ' A' 1027 ' ' ARG . 8.5 t70 -100.33 155.86 17.56 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -155.51 147.96 23.91 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.507 -171.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.445 HG12 ' HG3' ' A' ' 964' ' ' PRO . 8.1 p -144.48 -179.53 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 N-CA-C 105.589 -2.004 . . . . 0.0 105.589 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.504 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 67.8 m-85 -136.69 150.81 48.67 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -178.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.556 ' O ' ' HA ' ' A' 1020 ' ' ARG . 7.3 tt0 -122.93 122.36 38.39 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . 0.511 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 29.4 m-80 -113.11 142.57 45.6 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 122.32 1.057 . . . . 0.0 112.833 -173.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 35.7 mt-10 -135.63 161.93 34.15 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 112.672 -2.058 . . . . 0.0 105.664 171.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 939' ' ' SER . . . . . 0.496 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 34.9 p -149.56 158.97 44.66 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 118.65 0.659 . . . . 0.0 112.404 -175.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.492 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 37.5 ptt180 -156.77 159.52 38.37 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.731 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -75.94 165.26 54.59 Favored Pre-proline 0 C--N 1.311 -1.095 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 168.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -62.68 84.61 0.11 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 121.424 1.416 . . . . 0.0 110.643 171.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 132.49 -2.2 4.93 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -175.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . 0.492 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -96.42 -172.33 35.11 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 108.048 -2.021 . . . . 0.0 108.048 177.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -127.57 161.58 28.48 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 120.112 1.956 . . . . 0.0 105.803 170.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.642 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 54.6 m95 -64.07 134.8 55.62 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 122.282 1.039 . . . . 0.0 113.463 -169.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -136.27 175.62 3.41 Favored Pre-proline 0 C--N 1.309 -1.171 0 N-CA-C 104.391 -2.448 . . . . 0.0 104.391 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.86 126.92 24.14 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.707 1.605 . . . . 0.0 111.814 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . 0.496 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -80.84 15.01 1.92 Allowed 'General case' 0 C--O 1.239 0.532 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -178.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 78.37 -62.19 0.35 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 125.293 1.437 . . . . 0.0 108.623 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.83 83.77 2.79 Favored 'General case' 0 N--CA 1.417 -2.098 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.3 m -72.26 -58.72 3.18 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.694 -171.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . 0.504 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 88.3 m-85 -97.88 123.93 42.07 Favored 'General case' 0 C--N 1.309 -1.196 0 C-N-CA 119.053 -1.059 . . . . 0.0 110.095 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 954' ' ' THR . . . . . 0.447 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 76.5 p -136.35 171.41 14.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.359 -170.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -95.75 176.93 5.95 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 105.685 -1.969 . . . . 0.0 105.685 175.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.64 -24.42 5.54 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 178.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . 0.698 HD22 ' HB2' ' A' ' 959' ' ' ASP . 4.1 p-10 -96.66 -4.03 41.64 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.655 -0.653 . . . . 0.0 111.35 178.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . 0.447 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 93.53 -1.49 69.21 Favored Glycine 0 CA--C 1.499 -0.96 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.165 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . 0.698 ' HB2' HD22 ' A' ' 957' ' ' ASN . 7.0 t70 -57.55 104.73 0.19 Allowed 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -51.94 133.62 32.28 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.876 0.846 . . . . 0.0 110.908 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -128.63 -173.94 3.1 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.767 -1.106 . . . . 0.0 108.991 -176.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . 0.46 ' HB2' ' HB3' ' A' ' 966' ' ' GLU . . . -75.99 157.81 32.64 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 176.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.5 m -77.52 156.96 80.65 Favored Pre-proline 0 N--CA 1.441 -0.92 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.632 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 52.4 Cg_exo -51.31 -20.12 7.68 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.457 2.772 . . . . 0.0 114.614 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.3 p -70.81 -57.8 4.27 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . 0.46 ' HB3' ' HB2' ' A' ' 962' ' ' ALA . 35.2 tt0 -69.09 -27.83 65.96 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.229 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.506 HD11 ' HA ' ' A' ' 964' ' ' PRO . 31.6 mt -59.81 110.75 1.23 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 24.3 p -116.34 177.54 4.65 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.688 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 9.0 p -101.64 143.19 26.1 Favored Pre-proline 0 C--N 1.307 -1.28 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.676 178.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.566 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 97.4 Cg_endo -74.56 -179.37 4.77 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.029 2.486 . . . . 0.0 109.418 172.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.35 -51.78 9.75 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.922 1.748 . . . . 0.0 114.457 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.439 ' O ' ' HG2' ' A' 1033 ' ' GLN . . . -74.31 -46.24 21.47 Favored Glycine 0 N--CA 1.442 -0.961 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.992 -177.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.566 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 99.2 m95 -69.23 130.43 42.62 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.895 ' HB2' HE21 ' A' 1033 ' ' GLN . 6.5 tp10 -118.66 143.42 46.84 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 126.499 1.92 . . . . 0.0 109.748 -173.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -88.55 152.64 21.72 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.551 0.691 . . . . 0.0 111.446 173.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -137.86 -36.61 0.61 Allowed 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.673 177.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . 0.672 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.4 m-20 -77.62 149.66 34.73 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -174.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -54.81 -51.58 65.37 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 124.782 1.301 . . . . 0.0 113.186 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -168.77 167.76 10.95 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-O 120.877 0.37 . . . . 0.0 110.321 -175.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.632 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 33.5 m95 -74.72 114.71 13.47 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 177.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 2.6 p -123.95 149.23 46.18 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -172.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . 0.575 ' HA ' ' O ' ' A' 1022 ' ' ARG . 1.0 OUTLIER -74.21 129.54 38.01 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.577 0.703 . . . . 0.0 111.28 -172.797 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -87.75 135.26 33.45 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.806 -170.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 26.3 pt -115.68 24.79 4.62 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.985 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . 0.607 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 25.3 t-20 -101.44 15.64 28.18 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.783 0.802 . . . . 0.0 110.369 -175.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.607 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 8.7 mpt_? -138.24 -176.74 4.55 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 -174.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -78.01 75.63 4.54 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.953 0.883 . . . . 0.0 109.443 176.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 27.6 m -141.53 152.21 19.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.111 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -55.32 169.37 0.28 Allowed 'General case' 0 C--N 1.323 -0.567 0 O-C-N 123.89 0.744 . . . . 0.0 111.113 173.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -52.58 -32.24 40.17 Favored 'General case' 0 CA--C 1.493 -1.25 0 CA-C-O 121.65 0.738 . . . . 0.0 111.751 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . 0.412 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 70.9 mmtt -104.2 15.17 28.95 Favored 'General case' 0 N--CA 1.417 -2.085 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.95 -176.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 89.48 -15.81 57.76 Favored Glycine 0 C--O 1.226 -0.399 0 CA-C-N 115.587 -0.733 . . . . 0.0 113.028 174.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.684 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 82.0 m95 -58.78 109.53 0.83 Allowed 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -177.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.91 160.27 14.51 Favored 'General case' 0 C--O 1.254 1.301 0 C-N-CA 123.756 0.823 . . . . 0.0 110.952 173.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.662 ' HE1' ' HB ' ' A' ' 997' ' ' ILE . 0.3 OUTLIER -75.7 102.77 5.51 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 125.435 1.494 . . . . 0.0 112.09 -172.454 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . 0.406 ' HA2' ' HB3' ' A' 1005 ' ' PRO . . . -107.72 88.8 0.55 Allowed Glycine 0 CA--C 1.492 -1.405 0 C-N-CA 119.051 -1.547 . . . . 0.0 112.261 173.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.662 ' HB ' ' HE1' ' A' ' 995' ' ' TYR . 2.5 tt -97.24 127.64 49.28 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.082 0 O-C-N 121.341 -1.093 . . . . 0.0 110.198 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 998' ' ' THR . . . . . 0.409 ' HG1' ' HG3' ' A' 1005 ' ' PRO . 20.7 m -118.42 82.9 1.92 Allowed 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 23.3 pt -104.4 130.81 22.63 Favored Pre-proline 0 C--N 1.316 -0.88 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.291 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.54 145.29 87.15 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.703 2.269 . . . . 0.0 112.754 -178.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1001 ' ' PRO . . . . . 0.426 ' O ' ' HB2' ' A' 1002 ' ' ASP . 7.9 Cg_endo -91.26 135.55 9.03 Favored 'Cis proline' 0 N--CA 1.446 -1.323 0 C-N-CA 123.024 -1.657 . . . . 0.0 112.844 -2.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1002 ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' 1001 ' ' PRO . 3.7 t70 158.69 170.37 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 111.523 -2.581 . . . . 0.0 105.822 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -149.81 33.97 0.68 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 118.646 0.657 . . . . 0.0 109.943 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 90.1 mttt -159.92 127.96 2.85 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.671 -176.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1005 ' ' PRO . . . . . 0.688 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 32.8 Cg_exo -68.56 124.26 11.39 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 121.521 1.481 . . . . 0.0 109.984 172.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 45.8 pttt -123.35 8.16 9.06 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -174.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.3 t -138.83 116.48 11.4 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.688 ' CZ2' ' HB2' ' A' 1005 ' ' PRO . 62.0 m95 -121.96 134.49 54.83 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.939 -171.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 15.4 m -156.29 178.08 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 -175.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -94.98 104.64 16.52 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 175.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -169.71 176.38 4.91 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.255 0.347 . . . . 0.0 110.34 -176.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.652 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 10.2 tp10 -163.13 104.4 0.99 Allowed 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 122.221 1.01 . . . . 0.0 108.608 176.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.495 ' H ' ' ND1' ' A' 1016 ' ' HIS . 73.0 mttt -135.62 157.45 46.85 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 113.667 -1.606 . . . . 0.0 109.263 -176.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 49.0 ttp -48.26 -41.64 28.31 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 125.137 1.375 . . . . 0.0 114.339 -177.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -59.23 -16.16 19.39 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.652 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 7.6 m80 -53.53 100.01 0.03 OUTLIER 'General case' 0 CA--C 1.511 -0.542 0 O-C-N 123.635 0.585 . . . . 0.0 111.345 172.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1017 ' ' THR . . . . . 0.491 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.0 OUTLIER -96.88 -22.72 16.72 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 122.845 1.307 . . . . 0.0 108.178 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 14.3 m170 -139.68 157.89 45.03 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 113.437 -1.711 . . . . 0.0 108.237 -178.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.684 ' HG2' ' CE3' ' A' ' 993' ' ' TRP . 44.8 ttp180 -157.82 148.44 20.85 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.556 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 5.4 ptp180 -152.1 166.34 31.96 Favored 'General case' 0 CA--C 1.487 -1.478 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.643 178.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 33.6 ptt180 -145.45 150.02 35.76 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.747 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.575 ' O ' ' HA ' ' A' ' 982' ' ' TYR . 41.4 ttm180 -87.22 120.91 28.99 Favored 'General case' 0 N--CA 1.437 -1.112 0 O-C-N 123.212 0.32 . . . . 0.0 110.758 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 86.1 mt -97.61 124.38 41.88 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 170.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.554 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 16.4 m -109.45 141.88 23.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 CA-C-O 121.823 0.82 . . . . 0.0 111.512 -175.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.526 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.4 tpt180 -134.45 104.78 6.25 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 113.662 -1.608 . . . . 0.0 107.936 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.672 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -75.19 146.62 41.09 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -178.35 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.726 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 13.1 ptm180 -147.35 171.37 15.55 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -170.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.706 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 15.5 ptpt -158.58 152.4 23.5 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 178.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.578 ' C ' ' H ' ' A' 1031 ' ' LEU . 38.1 ttmt -84.23 -10.72 57.45 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 122.812 1.291 . . . . 0.0 107.682 -176.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1030 ' ' ASP . . . . . 0.442 ' HB3' ' HB2' ' A' 1033 ' ' GLN . 32.0 t70 72.23 -20.47 0.25 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 112.011 -2.359 . . . . 0.0 112.717 178.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1031 ' ' LEU . . . . . 0.578 ' H ' ' C ' ' A' 1029 ' ' LYS . 19.7 tp 78.17 -12.86 1.02 Allowed 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 127.78 2.432 . . . . 0.0 112.202 177.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 6.7 t -135.36 9.58 3.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 122.167 0.984 . . . . 0.0 108.822 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.895 HE21 ' HB2' ' A' ' 974' ' ' GLU . 3.1 tp-100 . . . . . 0 N--CA 1.438 -1.067 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 174.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . 0.481 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 9.6 m-70 . . . . . 0 CA--C 1.51 -0.571 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.5 m -166.18 115.54 0.95 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 101.404 -3.554 . . . . 0.0 101.404 169.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.53 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 1.4 pm0 -142.92 136.04 28.2 Favored 'General case' 0 C--N 1.286 -2.193 0 CA-C-N 119.684 1.129 . . . . 0.0 109.005 177.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . 0.447 ' O ' ' HG2' ' A' 1027 ' ' ARG . 79.2 t80 -137.64 137.75 38.76 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -177.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.604 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 17.1 m -76.3 133.65 39.97 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.345 0.117 . . . . 0.0 110.995 178.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -111.08 163.82 13.47 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.515 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 10.6 pt-20 -151.24 150.74 30.94 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -173.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.515 ' O ' ' HA ' ' A' 1022 ' ' ARG . 7.1 p -138.82 175.39 8.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 N-CA-C 106.191 -1.781 . . . . 0.0 106.191 175.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.679 ' HA ' ' O ' ' A' 1021 ' ' ARG . 68.2 m-85 -139.43 146.47 40.14 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -175.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.714 ' O ' ' HA ' ' A' 1020 ' ' ARG . 30.0 tt0 -121.59 120.33 34.5 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -174.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . 0.541 ' HA ' ' O ' ' A' 1019 ' ' ARG . 26.2 m-80 -109.14 140.43 42.74 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.361 1.077 . . . . 0.0 112.891 -172.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.575 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 66.1 mt-10 -133.83 158.68 42.78 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 104.345 -2.465 . . . . 0.0 104.345 170.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 17.4 m -142.56 151.8 41.94 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 119.017 0.826 . . . . 0.0 111.48 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.659 ' O ' ' HA ' ' A' 1017 ' ' THR . 32.1 ptt180 -148.98 159.52 44.14 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.568 178.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -79.68 164.46 53.37 Favored Pre-proline 0 C--N 1.302 -1.499 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 171.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -64.04 91.44 0.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 121.123 1.215 . . . . 0.0 109.909 172.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 123.95 0.53 9.0 Favored Glycine 0 N--CA 1.44 -1.065 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 -175.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . 0.542 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -101.26 -175.08 28.82 Favored Glycine 0 CA--C 1.505 -0.586 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 178.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -119.37 166.7 12.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.977 1.889 . . . . 0.0 105.989 169.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.575 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 40.8 m95 -71.72 138.73 48.72 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-O 122.146 0.974 . . . . 0.0 112.408 -171.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -129.16 174.32 4.69 Favored Pre-proline 0 C--N 1.307 -1.251 0 N-CA-C 103.736 -2.691 . . . . 0.0 103.736 175.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -56.74 133.29 57.06 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 CA-C-N 121.364 1.523 . . . . 0.0 111.335 174.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.86 -170.88 0.12 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.681 0.753 . . . . 0.0 112.456 177.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.51 -36.82 13.51 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -178.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -120.43 105.65 11.07 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 104.912 -2.255 . . . . 0.0 104.912 169.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.1 m -66.62 -64.3 0.88 Allowed 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.101 -176.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . 0.577 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 73.4 m-85 -93.02 135.56 34.08 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 118.834 -1.146 . . . . 0.0 110.446 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 77.0 p -147.2 -177.27 5.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -174.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -103.29 -178.05 3.55 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 170.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.59 -26.08 12.44 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 176.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -87.52 -51.33 5.97 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 121.907 -0.496 . . . . 0.0 110.869 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 146.05 -7.63 1.43 Allowed Glycine 0 CA--C 1.493 -1.344 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.741 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.96 108.64 1.25 Allowed 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 175.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 961' ' ' ALA . 50.7 tttm -47.19 119.94 2.88 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.598 1.186 . . . . 0.0 110.526 178.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.46 ' O ' ' HG2' ' A' ' 960' ' ' LYS . . . -90.2 175.4 7.15 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . 0.414 ' HB2' ' CB ' ' A' ' 966' ' ' GLU . . . -72.44 -52.82 14.2 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.148 -1.021 . . . . 0.0 112.683 -175.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 57.1 p 138.48 156.53 0.0 OUTLIER Pre-proline 0 C--N 1.309 -1.191 0 C-N-CA 126.913 2.085 . . . . 0.0 109.919 -171.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.475 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 4.8 Cg_endo -58.92 -26.34 80.68 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 121.879 1.719 . . . . 0.0 112.291 172.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 50.7 m -74.19 -53.31 10.1 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 175.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . 0.414 ' CB ' ' HB2' ' A' ' 962' ' ' ALA . 33.3 mt-10 -75.42 5.26 6.0 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.79 111.94 23.9 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 172.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 18.7 p -110.74 174.31 5.92 Favored 'General case' 0 C--N 1.296 -1.761 0 CA-C-O 121.221 0.534 . . . . 0.0 111.491 -174.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.403 ' HA ' ' NH2' ' A' 1027 ' ' ARG . 16.1 p -108.73 128.85 24.77 Favored Pre-proline 0 N--CA 1.436 -1.152 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 173.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 73.5 Cg_endo -73.49 166.02 30.93 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.995 2.464 . . . . 0.0 110.337 177.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -49.64 -30.75 22.91 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.111 2.54 . . . . 0.0 114.13 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.683 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -107.31 23.17 27.54 Favored Glycine 0 N--CA 1.437 -1.235 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.577 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.602 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 75.7 m95 -135.74 132.84 37.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 117.629 0.714 . . . . 0.0 110.335 172.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.612 ' HB3' ' O ' ' A' 1028 ' ' LYS . 3.9 tp10 -111.54 142.15 44.2 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.531 ' CE3' ' HG2' ' A' 1025 ' ' ARG . 75.7 m95 -76.3 138.56 40.6 Favored 'General case' 0 C--N 1.298 -1.663 0 C-N-CA 118.014 -1.474 . . . . 0.0 111.106 170.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . 0.453 ' CG ' ' HB3' ' A' 1026 ' ' LYS . 4.2 pt-20 -108.92 -34.66 6.57 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . 0.402 ' HB3' ' HG3' ' A' 1025 ' ' ARG . 5.5 t0 -87.16 159.39 18.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 175.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -89.58 -31.99 17.33 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.647 -172.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -157.14 170.28 22.86 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 -174.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.556 ' HA ' ' O ' ' A' 1024 ' ' VAL . 23.6 m95 -94.73 110.07 21.96 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 175.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 50.0 m -124.57 158.94 31.8 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -178.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . 0.45 ' HA ' ' O ' ' A' 1022 ' ' ARG . 6.6 p90 -74.65 144.82 43.65 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -167.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -95.53 120.95 36.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.217 -176.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.432 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.6 pp -105.62 9.4 9.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.907 -177.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -94.46 39.68 1.09 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.793 1.282 . . . . 0.0 107.921 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.417 HH21 ' CD ' ' A' ' 994' ' ' GLU . 57.6 mtp85 -145.47 176.88 9.26 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -175.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -77.86 85.5 4.12 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 174.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.453 ' HB ' ' HA2' ' A' ' 992' ' ' GLY . 20.5 m -127.08 -173.34 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.933 -178.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -96.7 -174.15 2.93 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -66.22 -34.01 77.06 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.42 0.628 . . . . 0.0 109.404 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -91.31 6.12 46.55 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.124 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . 0.453 ' HA2' ' HB ' ' A' ' 988' ' ' VAL . . . 67.35 80.34 0.2 Allowed Glycine 0 C--O 1.215 -1.089 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -179.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.508 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 98.2 m95 -151.98 145.25 24.69 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.45 ' HB2' ' HB3' ' A' 1008 ' ' TRP . 4.9 pt-20 -119.4 157.29 28.5 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 122.33 1.062 . . . . 0.0 113.83 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.73 ' O ' ' HA ' ' A' 1008 ' ' TRP . 6.8 t80 -74.21 101.84 4.11 Favored 'General case' 0 C--O 1.209 -1.067 0 C-N-CA 128.686 2.795 . . . . 0.0 112.689 -173.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . 0.405 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -119.82 111.7 2.07 Favored Glycine 0 N--CA 1.434 -1.479 0 C-N-CA 119.63 -1.271 . . . . 0.0 111.299 173.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.557 HG22 ' HA ' ' A' 1016 ' ' HIS . 10.3 pt -121.54 145.12 28.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 175.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 13.6 t -139.04 140.39 38.09 Favored 'General case' 0 N--CA 1.425 -1.711 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 176.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.464 ' O ' HD13 ' A' ' 999' ' ' ILE . 2.3 pp -107.38 130.23 23.14 Favored Pre-proline 0 C--N 1.306 -1.306 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.087 -179.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1000 ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 55.9 Cg_endo -71.69 139.98 34.88 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.345 2.03 . . . . 0.0 112.815 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1001 ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 5.7 Cg_endo -92.85 156.63 19.99 Favored 'Cis proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.747 -1.772 . . . . 0.0 112.028 -3.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1002 ' ' ASP . . . . . 0.422 ' HB3' ' H ' ' A' 1003 ' ' HIS . 12.3 t70 -168.77 -93.98 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.001 175.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1003 ' ' HIS . . . . . 0.422 ' H ' ' HB3' ' A' 1002 ' ' ASP . 0.0 OUTLIER 167.83 -75.64 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.5 0 C-N-CA 125.057 1.343 . . . . 0.0 109.335 -177.377 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -129.14 141.06 40.48 Favored Pre-proline 0 C--N 1.317 -0.823 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -171.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1005 ' ' PRO . . . . . 0.417 ' HG2' ' CB ' ' A' 1018 ' ' HIS . 80.4 Cg_exo -54.45 143.66 65.72 Favored 'Trans proline' 0 CA--C 1.511 -0.628 0 C-N-CA 123.326 2.684 . . . . 0.0 110.3 167.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 43.9 mmtt -106.16 -45.23 4.37 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 -176.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 14.4 m -97.35 144.69 26.86 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 112.624 -2.08 . . . . 0.0 111.359 -169.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.73 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 66.0 m95 -135.22 136.09 41.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.797 1.239 . . . . 0.0 107.862 -178.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.45 HG13 ' N ' ' A' 1010 ' ' ALA . 57.4 t -146.77 173.39 2.64 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.745 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -172.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1010 ' ' ALA . . . . . 0.45 ' N ' HG13 ' A' 1009 ' ' VAL . . . -78.91 -18.79 53.26 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -177.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -92.9 107.68 19.41 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -169.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.421 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 18.2 tp10 -72.19 121.59 19.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.914 0.864 . . . . 0.0 109.78 171.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.472 ' H ' ' ND1' ' A' 1016 ' ' HIS . 28.6 mtpp -124.09 152.85 42.24 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.811 -174.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1014 ' ' MET . . . . . 0.412 ' C ' ' H ' ' A' 1016 ' ' HIS . 51.6 ttp -57.34 -37.99 73.41 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 124.212 0.945 . . . . 0.0 112.4 178.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -72.55 19.76 0.08 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.727 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.9 OUTLIER -69.77 175.07 4.52 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-O 122.174 0.987 . . . . 0.0 112.473 174.914 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1017 ' ' THR . . . . . 0.659 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.7 OUTLIER -158.52 -35.44 0.07 Allowed 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 113.307 -1.77 . . . . 0.0 109.102 -172.924 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1018 ' ' HIS . . . . . 0.417 ' CB ' ' HG2' ' A' 1005 ' ' PRO . 0.2 OUTLIER -138.58 147.48 43.05 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.72 -178.675 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.541 ' O ' ' HA ' ' A' ' 937' ' ' ASN . 40.3 ttp180 -145.91 143.7 29.72 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 177.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.714 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.6 ptp180 -150.88 165.92 32.14 Favored 'General case' 0 C--O 1.2 -1.502 0 O-C-N 123.881 0.738 . . . . 0.0 109.362 176.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.679 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.1 ptt180 -144.59 148.55 34.51 Favored 'General case' 0 C--N 1.295 -1.788 0 O-C-N 123.613 0.57 . . . . 0.0 110.693 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.515 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 37.2 ttm180 -84.48 119.48 25.2 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 123.924 0.765 . . . . 0.0 110.254 178.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1023 ' ' LEU . . . . . . . . . . . . . 69.4 mt -97.99 126.64 43.49 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 168.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.556 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 11.1 m -104.75 143.55 16.02 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.656 0 CA-C-O 121.01 0.433 . . . . 0.0 111.716 -174.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.531 ' HG2' ' CE3' ' A' ' 975' ' ' TRP . 0.5 OUTLIER -148.09 113.66 5.66 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.133 167.797 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.604 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.5 tmtp? -77.56 154.09 32.71 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 177.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 11.4 ptm180 -142.37 153.21 43.6 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 -176.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.612 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 36.3 ttmt -142.08 136.64 30.34 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 -172.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.683 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.0 ttmt -90.23 -24.65 20.9 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 123.057 1.408 . . . . 0.0 107.586 -177.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1030 ' ' ASP . . . . . 0.481 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 16.2 t0 54.7 12.33 0.55 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 112.23 -2.259 . . . . 0.0 111.043 -170.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1031 ' ' LEU . . . . . 0.403 ' H ' ' C ' ' A' 1029 ' ' LYS . 19.0 tp 66.71 -42.18 0.4 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.339 2.256 . . . . 0.0 112.229 -176.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 14.9 p -97.61 30.49 2.91 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -175.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.539 ' CD ' ' HB2' ' A' ' 974' ' ' GLU . 4.3 mm100 . . . . . 0 N--CA 1.472 0.638 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.304 173.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . 0.434 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 16.8 m-70 . . . . . 0 CA--C 1.506 -0.718 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.64 120.75 5.27 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 101.71 -3.441 . . . . 0.0 101.71 165.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.498 ' HG3' ' CE ' ' A' 1026 ' ' LYS . 0.5 OUTLIER -145.27 150.26 36.34 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 176.18 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . 0.548 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.1 t80 -143.21 140.13 30.58 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 175.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 27.8 m -77.91 127.78 32.91 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.789 -0.764 . . . . 0.0 109.886 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -96.55 149.34 21.87 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 104.627 -2.361 . . . . 0.0 104.627 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -150.03 151.49 33.36 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 118.694 0.679 . . . . 0.0 110.721 -172.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.417 ' O ' ' HA ' ' A' 1022 ' ' ARG . 9.8 p -147.8 -178.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 N-CA-C 105.026 -2.213 . . . . 0.0 105.026 176.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.549 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 77.0 m-85 -141.13 151.12 43.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.64 ' O ' ' HA ' ' A' 1020 ' ' ARG . 32.6 tt0 -119.74 113.47 20.68 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 -174.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -105.0 147.13 28.13 Favored 'General case' 0 C--N 1.313 -1.012 0 O-C-N 123.679 0.612 . . . . 0.0 110.684 -176.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.62 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 41.7 mt-10 -142.88 159.43 42.24 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 170.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 939' ' ' SER . . . . . 0.657 ' HB3' ' CD2' ' A' 1018 ' ' HIS . 12.8 p -141.7 145.81 35.32 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.448 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 22.9 ptt180 -148.36 161.44 41.56 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 124.59 1.156 . . . . 0.0 107.949 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -67.28 158.21 82.61 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 172.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.96 88.95 0.07 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 121.656 1.571 . . . . 0.0 111.16 174.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 103.07 71.06 0.86 Allowed Glycine 0 N--CA 1.43 -1.712 0 N-CA-C 108.153 -1.979 . . . . 0.0 108.153 -175.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.04 -146.75 4.81 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.731 -174.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -129.79 132.23 46.46 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 124.475 1.11 . . . . 0.0 110.311 -176.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.62 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 40.9 m95 -76.13 151.91 36.86 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 121.792 0.806 . . . . 0.0 112.052 -173.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -143.79 153.13 57.36 Favored Pre-proline 0 C--N 1.307 -1.271 0 N-CA-C 103.807 -2.664 . . . . 0.0 103.807 176.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -49.2 126.26 15.14 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.667 2.244 . . . . 0.0 112.626 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -75.61 23.87 0.12 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -171.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 79.3 -61.03 0.34 Allowed 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.738 1.615 . . . . 0.0 109.196 177.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -100.88 73.74 1.58 Allowed 'General case' 0 N--CA 1.415 -2.199 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 25.4 m -63.1 -60.42 3.46 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.414 -173.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . 0.549 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 68.4 m-85 -93.49 123.28 36.69 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 119.661 -0.816 . . . . 0.0 111.265 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 15.6 p -142.66 173.88 11.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 113.962 -1.472 . . . . 0.0 110.702 -170.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . 0.45 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 13.0 t70 -92.42 170.07 10.06 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 104.854 -2.276 . . . . 0.0 104.854 170.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.99 -30.89 27.03 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 118.591 0.632 . . . . 0.0 111.526 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -91.44 8.44 36.32 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 89.35 -7.49 81.9 Favored Glycine 0 CA--C 1.503 -0.718 0 C-N-CA 120.14 -1.029 . . . . 0.0 114.033 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . 0.45 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 20.3 t70 -52.89 101.76 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 172.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -54.9 125.86 22.01 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.885 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -125.76 175.86 7.33 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.741 -177.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . 0.542 ' HB3' ' HB2' ' A' ' 966' ' ' GLU . . . -70.38 160.23 32.7 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 7.2 m -89.23 159.93 43.79 Favored Pre-proline 0 N--CA 1.427 -1.624 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -179.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.608 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.4 Cg_exo -47.66 -28.94 10.02 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.184 3.256 . . . . 0.0 116.771 -174.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 25.0 m -76.32 -43.17 42.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 119.041 0.837 . . . . 0.0 109.79 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 962' ' ' ALA . 35.5 mt-10 -64.9 -30.08 71.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.056 176.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.437 HD11 ' CH2' ' A' ' 980' ' ' TRP . 77.5 mt -72.34 114.42 10.44 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.909 176.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 41.6 p -121.34 170.33 9.72 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.622 -175.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 5.1 p -87.16 141.52 32.99 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 121.076 0.465 . . . . 0.0 111.356 178.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.563 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 27.8 Cg_endo -87.49 166.4 7.73 Favored 'Trans proline' 0 C--O 1.242 0.713 0 C-N-CA 122.437 2.092 . . . . 0.0 111.256 176.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.23 108.56 0.99 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 121.617 1.545 . . . . 0.0 110.292 173.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.679 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 115.53 5.67 18.45 Favored Glycine 0 N--CA 1.44 -1.057 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.874 -176.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.563 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 93.7 m95 -138.98 136.56 35.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 117.784 0.792 . . . . 0.0 111.937 178.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.504 ' HB3' ' O ' ' A' 1028 ' ' LYS . 4.8 tp10 -116.19 134.05 55.35 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 125.635 1.574 . . . . 0.0 107.706 -174.027 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.664 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 81.0 m95 -79.66 104.74 10.46 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 118.885 -1.126 . . . . 0.0 109.528 173.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . 0.476 ' CD ' ' HZ1' ' A' 1028 ' ' LYS . 43.5 tt0 -75.84 -42.61 49.16 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 177.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.83 143.0 55.98 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.74 -38.21 73.51 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -175.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.03 152.19 7.47 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 120.593 0.235 . . . . 0.0 110.392 -173.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.625 ' HA ' ' O ' ' A' 1024 ' ' VAL . 40.4 m95 -65.5 113.83 4.44 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 1.5 p -122.65 159.78 27.17 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -171.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 17.1 p90 -74.38 141.18 45.14 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 119.515 1.052 . . . . 0.0 111.205 -174.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.409 ' HB3' ' HB3' ' A' 1022 ' ' ARG . 7.8 t70 -81.56 120.8 25.51 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.701 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 12.6 pt -126.37 42.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -110.59 6.35 21.78 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 113.882 -1.508 . . . . 0.0 107.665 -172.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.524 ' HD3' ' NH1' ' A' 1022 ' ' ARG . 52.2 mtm180 -136.06 -176.25 4.25 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.534 -171.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.27 80.5 3.04 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.996 174.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.482 HG13 ' NH2' ' A' ' 986' ' ' ARG . 22.1 m -135.7 162.04 37.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.016 -174.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -56.13 173.48 0.16 Allowed 'General case' 0 N--CA 1.468 0.466 0 O-C-N 124.526 1.142 . . . . 0.0 111.207 172.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -53.28 -35.57 60.22 Favored 'General case' 0 CA--C 1.493 -1.246 0 C-N-CA 123.689 0.796 . . . . 0.0 111.671 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . 0.449 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 75.6 mmtt -106.46 12.91 29.13 Favored 'General case' 0 N--CA 1.417 -2.101 0 C-N-CA 118.878 -1.129 . . . . 0.0 111.805 -175.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 92.84 -11.46 72.05 Favored Glycine 0 CA--C 1.504 -0.648 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 174.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.51 ' CD2' ' HD2' ' A' 1019 ' ' ARG . 83.1 m95 -54.37 133.29 45.28 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 122.272 1.034 . . . . 0.0 111.848 177.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.673 ' HG2' ' O ' ' A' 1020 ' ' ARG . 5.5 pt-20 -117.82 152.04 36.14 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.579 -1.192 . . . . 0.0 109.864 -178.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.719 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 43.2 t80 -69.4 90.99 0.54 Allowed 'General case' 0 C--O 1.201 -1.451 0 CA-C-N 112.43 -2.168 . . . . 0.0 110.862 -175.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . 0.596 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -114.18 79.91 0.28 Allowed Glycine 0 N--CA 1.436 -1.361 0 C-N-CA 118.952 -1.594 . . . . 0.0 111.874 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -92.88 149.56 4.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 C-N-CA 117.123 -1.831 . . . . 0.0 108.355 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 36.9 m -124.71 98.02 5.54 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.758 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 22.2 pt -74.55 130.32 82.05 Favored Pre-proline 0 C--N 1.319 -0.728 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.479 176.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.51 141.56 42.5 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.914 2.409 . . . . 0.0 113.071 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1001 ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' A' 1002 ' ' ASP . 7.4 Cg_endo -91.29 149.84 18.27 Favored 'Cis proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.406 -1.497 . . . . 0.0 111.534 -2.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1002 ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' 1001 ' ' PRO . 2.6 t70 163.69 160.55 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.987 0 O-C-N 124.972 1.42 . . . . 0.0 107.509 -177.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -134.61 33.88 3.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.314 0.578 . . . . 0.0 109.7 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1004 ' ' LYS . . . . . 0.52 ' HB2' ' HZ2' ' A' 1006 ' ' LYS . 88.3 mttt -158.82 123.54 2.22 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.807 -174.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1005 ' ' PRO . . . . . 0.445 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 33.4 Cg_exo -71.51 133.11 21.75 Favored 'Trans proline' 0 C--O 1.239 0.543 0 C-N-CA 122.278 1.985 . . . . 0.0 110.476 168.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1006 ' ' LYS . . . . . 0.52 ' HZ2' ' HB2' ' A' 1004 ' ' LYS . 54.2 mmtt -94.27 -49.61 5.64 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.141 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 10.3 t -92.08 148.94 21.79 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.243 -177.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.672 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 58.0 m95 -138.37 137.54 37.41 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 176.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.573 ' N ' ' HB3' ' A' ' 995' ' ' TYR . 33.0 t -144.42 169.78 8.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -172.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1010 ' ' ALA . . . . . 0.421 ' N ' HG12 ' A' 1009 ' ' VAL . . . -79.65 -12.96 59.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -179.217 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -91.81 109.42 20.74 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -174.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.535 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 1.0 OUTLIER -81.85 105.11 12.71 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 172.88 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.493 ' H ' ' CE1' ' A' 1016 ' ' HIS . 61.3 mtpt -107.83 161.92 14.47 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.246 -1.343 . . . . 0.0 112.123 -176.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1014 ' ' MET . . . . . 0.452 ' C ' ' H ' ' A' 1016 ' ' HIS . 57.0 ttp -55.15 -44.53 75.21 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.245 -0.889 . . . . 0.0 113.158 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -72.73 18.09 0.1 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.719 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.8 OUTLIER -67.24 114.48 6.0 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.668 172.258 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 1017 ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.0 OUTLIER -93.11 -25.27 17.96 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 122.8 1.286 . . . . 0.0 108.173 176.239 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 1018 ' ' HIS . . . . . 0.657 ' CD2' ' HB3' ' A' ' 939' ' ' SER . 46.2 m80 -141.75 150.5 41.85 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.879 -1.509 . . . . 0.0 109.937 178.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.51 ' HD2' ' CD2' ' A' ' 993' ' ' TRP . 31.2 ptt180 -141.94 148.84 39.31 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 171.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.673 ' O ' ' HG2' ' A' ' 994' ' ' GLU . 37.7 ttp180 -152.61 165.51 34.97 Favored 'General case' 0 C--N 1.283 -2.283 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.476 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 29.0 ptt180 -155.35 159.26 39.8 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 178.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.524 ' NH1' ' HD3' ' A' ' 986' ' ' ARG . 38.6 ttm180 -86.46 132.81 33.84 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.554 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 45.6 mt -102.35 129.34 48.77 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 104.663 -2.347 . . . . 0.0 104.663 166.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.625 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 20.1 m -109.64 141.92 23.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.495 -171.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.486 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.9 tpt180 -141.12 98.52 3.39 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 114.048 -1.433 . . . . 0.0 107.945 172.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.498 ' CE ' ' HG3' ' A' ' 929' ' ' GLU . 0.3 OUTLIER -71.62 134.76 46.59 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 -177.55 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.664 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.3 ptm180 -128.68 143.15 50.87 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -172.375 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.504 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.0 ttmt -137.89 139.28 39.76 Favored 'General case' 0 C--N 1.283 -2.307 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -172.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.679 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 32.4 ttmt -91.49 -17.52 25.57 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 123.737 1.732 . . . . 0.0 107.561 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1030 ' ' ASP . . . . . 0.451 ' C ' ' H ' ' A' 1032 ' ' THR . 21.5 t70 53.02 8.99 0.11 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 111.37 -2.65 . . . . 0.0 112.48 -169.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1031 ' ' LEU . . . . . 0.431 ' H ' ' C ' ' A' 1029 ' ' LYS . 22.9 tp 69.4 -33.46 0.25 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.207 1.803 . . . . 0.0 111.75 -176.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1032 ' ' THR . . . . . 0.451 ' H ' ' C ' ' A' 1030 ' ' ASP . 12.6 t -79.03 -3.48 45.36 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -175.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 . . . . . 0 C--N 1.326 -0.428 0 C-N-CA 119.84 -0.744 . . . . 0.0 111.012 177.675 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . 0.451 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 13.6 m-70 . . . . . 0 CA--C 1.5 -0.978 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.15 108.99 1.94 Allowed 'General case' 0 N--CA 1.412 -2.35 0 N-CA-C 101.428 -3.545 . . . . 0.0 101.428 169.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.465 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.3 OUTLIER -137.39 144.57 42.52 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 178.233 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . 0.482 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.8 t80 -137.39 138.06 39.48 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 105.888 -1.893 . . . . 0.0 105.888 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.567 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 26.9 m -74.08 129.98 38.9 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 176.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . 0.502 ' HB2' ' HD2' ' A' 1027 ' ' ARG . 4.6 t70 -102.34 156.26 17.7 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.509 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.0 pt-20 -150.53 153.64 36.16 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.155 0.502 . . . . 0.0 111.324 -172.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' 1022 ' ' ARG . 9.4 p -146.53 179.01 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 N-CA-C 106.182 -1.784 . . . . 0.0 106.182 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.518 ' HA ' ' O ' ' A' 1021 ' ' ARG . 28.3 m-85 -144.07 113.95 7.25 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 119.653 1.115 . . . . 0.0 111.297 -174.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -81.36 132.78 35.35 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 123.57 0.544 . . . . 0.0 110.211 172.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . 0.471 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 27.6 m-80 -121.55 155.85 34.13 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 124.385 1.074 . . . . 0.0 113.116 -176.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.616 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 42.4 mt-10 -142.29 152.82 43.36 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 105.252 -2.129 . . . . 0.0 105.252 169.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 34.5 m -128.59 144.83 51.23 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 123.488 0.492 . . . . 0.0 111.018 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.492 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 20.7 ptt180 -149.92 161.75 41.68 Favored 'General case' 0 N--CA 1.433 -1.299 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -176.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -66.18 163.15 40.97 Favored Pre-proline 0 C--N 1.312 -1.023 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 172.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -66.64 90.41 0.28 Allowed 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 121.32 1.347 . . . . 0.0 111.271 177.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 97.15 72.19 1.09 Allowed Glycine 0 N--CA 1.434 -1.444 0 N-CA-C 107.88 -2.088 . . . . 0.0 107.88 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.67 -152.57 6.94 Favored Glycine 0 N--CA 1.44 -1.061 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.769 -174.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -108.38 136.29 48.27 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.377 -0.912 . . . . 0.0 109.54 -177.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.628 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 44.8 m95 -85.29 145.81 27.35 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-O 121.782 0.801 . . . . 0.0 109.486 -178.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -127.53 169.11 13.08 Favored Pre-proline 0 C--N 1.298 -1.665 0 N-CA-C 104.232 -2.507 . . . . 0.0 104.232 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -57.68 124.24 15.59 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 121.497 1.464 . . . . 0.0 109.599 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.04 10.7 0.05 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -174.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 79.4 -51.39 0.42 Allowed 'General case' 0 CA--C 1.481 -1.691 0 C-N-CA 124.533 1.133 . . . . 0.0 109.577 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -113.22 94.57 4.94 Favored 'General case' 0 N--CA 1.402 -2.84 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.1 m -72.89 -56.94 4.47 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.216 -173.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -94.92 122.4 37.53 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-O 122.164 0.983 . . . . 0.0 111.694 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 77.4 p -137.77 173.09 12.01 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.503 -173.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -95.85 172.63 7.9 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 171.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.96 -32.37 45.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 119.286 0.948 . . . . 0.0 110.843 174.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -80.39 -2.33 45.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.606 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 89.52 -9.12 78.23 Favored Glycine 0 CA--C 1.496 -1.108 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.843 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -51.8 103.44 0.06 Allowed 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 124.532 0.784 . . . . 0.0 110.733 175.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -51.86 121.91 7.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.444 -1.253 . . . . 0.0 108.472 177.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -123.32 -172.95 2.62 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.177 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -82.97 162.15 21.56 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 963' ' ' SER . . . . . 0.46 ' HB3' ' HD2' ' A' ' 964' ' ' PRO . 3.8 m -88.61 157.63 49.33 Favored Pre-proline 0 N--CA 1.43 -1.429 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.653 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 6.9 Cg_exo -43.03 -32.46 2.8 Favored 'Trans proline' 0 CA--C 1.542 0.884 1 C-N-CA 125.607 4.204 . . . . 0.0 117.901 -174.81 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 19.9 m -86.64 -35.25 19.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 122.194 0.997 . . . . 0.0 108.951 -176.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -72.96 -12.14 60.83 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.31 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 28.2 mt -89.35 110.36 21.17 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 21.1 p -114.25 -172.01 2.02 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.921 -174.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.588 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 15.4 p -114.96 129.49 25.01 Favored Pre-proline 0 C--N 1.317 -0.825 0 O-C-N 121.96 -0.463 . . . . 0.0 111.172 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.569 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 72.8 Cg_endo -70.69 169.82 19.19 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 123.213 2.609 . . . . 0.0 110.826 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -48.09 -33.56 21.28 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.887 2.391 . . . . 0.0 113.659 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.64 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -110.61 34.01 5.61 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-O 119.233 -0.76 . . . . 0.0 113.76 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.588 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 61.0 m95 -146.24 141.13 27.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.922 0.861 . . . . 0.0 110.878 169.192 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.593 ' HB3' ' O ' ' A' 1028 ' ' LYS . 7.5 tp10 -125.56 147.83 49.13 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 -176.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.453 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 63.6 m95 -75.91 143.54 41.62 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 122.237 1.018 . . . . 0.0 112.875 175.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . 0.592 ' HG2' ' HB3' ' A' 1028 ' ' LYS . 2.4 mm-40 -109.41 -44.38 3.91 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.564 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -91.51 159.13 16.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.137 -170.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.22 -52.81 60.73 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.067 0.947 . . . . 0.0 112.889 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -162.92 160.27 24.68 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 -173.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.653 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 23.8 m95 -75.38 116.8 16.48 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 20.8 m -125.15 159.91 30.37 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 -175.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -74.98 134.86 41.39 Favored 'General case' 0 C--N 1.298 -1.634 0 C-N-CA 119.34 -0.944 . . . . 0.0 110.629 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.467 ' HB2' HG11 ' A' 1024 ' ' VAL . 39.7 t0 -82.01 124.78 30.09 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.36 -176.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.0 pp -121.89 11.97 5.87 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 121.71 0.767 . . . . 0.0 110.516 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -87.54 23.26 1.97 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.396 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 37.8 mtp-105 -146.47 -176.82 5.33 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.151 -174.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.38 83.72 7.39 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.467 HG21 ' O ' ' A' ' 983' ' ' ASP . 27.6 m -135.37 160.49 40.22 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.745 -178.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -55.3 169.11 0.29 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.102 0.561 . . . . 0.0 110.006 169.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -59.62 -33.03 70.97 Favored 'General case' 0 CA--C 1.503 -0.842 0 O-C-N 122.012 -0.43 . . . . 0.0 111.64 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -95.36 4.15 53.68 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 119.851 -0.74 . . . . 0.0 111.046 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.07 -21.79 40.42 Favored Glycine 0 C--O 1.223 -0.571 0 CA-C-N 116.575 -0.284 . . . . 0.0 112.827 175.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.507 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 81.8 m95 -50.92 121.88 6.65 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.449 ' HG2' HG13 ' A' ' 988' ' ' VAL . 19.2 mt-10 -98.96 149.45 22.96 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.556 0.694 . . . . 0.0 110.185 177.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.695 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 55.5 t80 -76.5 87.06 3.22 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 126.304 1.842 . . . . 0.0 109.963 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . 0.604 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -112.86 91.44 0.59 Allowed Glycine 0 CA--C 1.485 -1.81 0 C-N-CA 119.966 -1.111 . . . . 0.0 110.359 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.525 HG21 ' HA ' ' A' 1016 ' ' HIS . 9.5 pt -104.48 151.14 7.07 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.521 -175.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.6 t -137.42 135.85 37.29 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 172.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 62.7 mt -117.44 106.21 47.05 Favored Pre-proline 0 C--N 1.313 -0.995 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.94 137.74 69.29 Favored 'Trans proline' 0 C--O 1.241 0.634 0 C-N-CA 122.618 2.212 . . . . 0.0 112.873 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -82.9 141.85 44.76 Favored 'Cis proline' 0 N--CA 1.45 -1.06 0 C-N-CA 122.756 -1.768 . . . . 0.0 113.336 0.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 28.8 t70 -158.36 -98.62 0.03 OUTLIER 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 112.634 -2.076 . . . . 0.0 108.626 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1003 ' ' HIS . . . . . 0.479 ' HD2' ' HB2' ' A' 1004 ' ' LYS . 2.5 p-80 164.08 -45.78 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.719 1.262 . . . . 0.0 113.189 175.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1004 ' ' LYS . . . . . 0.479 ' HB2' ' HD2' ' A' 1003 ' ' HIS . 52.9 mttp -164.86 141.58 4.91 Favored Pre-proline 0 CA--C 1.51 -0.579 0 N-CA-C 106.033 -1.839 . . . . 0.0 106.033 -169.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -50.16 122.33 9.09 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 121.246 1.297 . . . . 0.0 111.409 173.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 37.6 pttt -107.2 5.5 27.78 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.784 -175.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1007 ' ' SER . . . . . 0.448 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 44.7 t -141.63 138.47 32.57 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -176.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.671 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 49.1 m95 -135.39 135.55 40.73 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.53 ' HB ' ' HB3' ' A' ' 995' ' ' TYR . 81.6 t -143.27 166.37 14.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -172.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -88.63 10.05 21.97 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -122.18 130.97 53.7 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 119.091 0.859 . . . . 0.0 112.927 -175.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.58 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 19.1 tp10 -79.09 112.67 16.52 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 122.064 0.935 . . . . 0.0 108.876 175.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.47 ' H ' ' CE1' ' A' 1016 ' ' HIS . 45.0 mttp -125.11 158.91 32.7 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.929 -1.487 . . . . 0.0 110.7 -175.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 45.0 ttp -53.95 -43.74 70.1 Favored 'General case' 0 C--N 1.311 -1.094 0 O-C-N 124.241 0.963 . . . . 0.0 112.952 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -49.7 -11.19 0.05 Allowed 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 175.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.695 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 16.8 m80 -58.93 154.4 15.38 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.86 1.314 . . . . 0.0 112.007 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -160.31 -34.45 0.05 Allowed 'General case' 0 C--N 1.286 -2.161 0 CA-C-N 111.141 -2.754 . . . . 0.0 105.765 -168.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.97 153.0 46.76 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 113.097 -1.865 . . . . 0.0 108.311 174.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.507 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 40.9 ptt180 -160.1 152.57 20.94 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 173.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.54 ' HG2' ' CZ3' ' A' 1008 ' ' TRP . 4.0 ptp180 -152.29 148.64 27.78 Favored 'General case' 0 CA--C 1.486 -1.492 0 C-N-CA 118.352 -1.339 . . . . 0.0 110.309 177.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.518 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.9 ptt180 -124.65 140.63 52.76 Favored 'General case' 0 C--N 1.293 -1.873 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.927 -177.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.52 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 38.7 ttm180 -81.07 123.12 28.12 Favored 'General case' 0 N--CA 1.422 -1.853 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.725 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.55 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 77.2 mt -95.8 127.01 41.46 Favored 'General case' 0 N--CA 1.422 -1.827 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 168.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.467 HG11 ' HB2' ' A' ' 983' ' ' ASP . 3.1 m -106.55 139.6 27.44 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.386 -174.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.515 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.7 tpt180 -143.19 101.4 3.8 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.186 -1.37 . . . . 0.0 107.845 171.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -71.44 147.46 47.84 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.214 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.502 ' HD2' ' HB2' ' A' ' 932' ' ' ASP . 12.1 ptm180 -140.91 151.46 44.27 Favored 'General case' 0 C--O 1.206 -1.213 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -172.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.616 ' HG2' ' H ' ' A' 1030 ' ' ASP . 30.4 ttmt -138.24 140.26 39.59 Favored 'General case' 0 C--O 1.197 -1.705 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 -174.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.64 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 29.3 ttmt -88.92 -4.47 58.45 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.844 0.831 . . . . 0.0 109.557 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1030 ' ' ASP . . . . . 0.616 ' H ' ' HG2' ' A' 1028 ' ' LYS . 2.1 t70 83.15 -68.6 0.06 Allowed 'General case' 0 CA--C 1.498 -1.055 0 CA-C-N 113.041 -1.891 . . . . 0.0 106.25 -173.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1031 ' ' LEU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 927' ' ' HIS . 34.0 tp 149.9 -29.2 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.706 0 O-C-N 127.171 2.795 . . . . 0.0 108.584 173.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 25.6 p -114.67 14.08 17.5 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.675 0.75 . . . . 0.0 111.218 -170.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' 1029 ' ' LYS . 29.5 tt0 . . . . . 0 N--CA 1.445 -0.703 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.278 -177.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.487 -1.475 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.4 116.42 32.6 Favored 'General case' 0 N--CA 1.409 -2.495 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 163.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.688 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.5 OUTLIER -126.55 132.24 51.38 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 179.874 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . 0.455 ' O ' ' HG2' ' A' 1027 ' ' ARG . 87.4 t80 -124.52 139.17 54.13 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.4 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 20.5 m -74.19 123.39 24.4 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -97.82 150.31 21.41 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 105.048 -2.205 . . . . 0.0 105.048 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.521 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 9.1 pt-20 -143.66 146.89 33.57 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 118.622 0.647 . . . . 0.0 110.899 -175.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 11.2 p -135.45 174.72 12.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.556 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 59.5 m-85 -135.54 146.38 47.98 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 118.674 0.67 . . . . 0.0 110.54 -175.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.591 ' O ' ' HA ' ' A' 1020 ' ' ARG . 53.2 mt-30 -112.87 116.57 30.23 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 124.567 1.167 . . . . 0.0 108.072 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -101.95 137.64 39.96 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 121.957 0.884 . . . . 0.0 112.312 -177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.514 ' HG2' ' HA ' ' A' ' 948' ' ' PRO . 29.3 mt-10 -138.43 150.48 46.54 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 113.261 -1.791 . . . . 0.0 106.619 170.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 47.1 t -144.4 154.91 43.47 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.132 -169.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.503 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 36.6 ptt180 -141.83 157.38 45.08 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . 0.411 ' C ' ' H ' ' A' ' 943' ' ' GLY . 19.2 m-85 -75.91 172.94 8.03 Favored Pre-proline 0 C--N 1.305 -1.353 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -66.73 48.74 0.29 Allowed 'Trans proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.99 2.46 . . . . 0.0 112.259 171.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . 0.579 ' HA2' ' SD ' ' A' 1014 ' ' MET . . . 155.98 37.15 0.02 OUTLIER Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.537 -176.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . 0.503 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -132.62 -173.39 13.29 Favored Glycine 0 CA--C 1.499 -0.949 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -120.14 165.92 14.12 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 174.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.495 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 34.3 m95 -72.56 124.52 25.4 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-O 121.15 0.5 . . . . 0.0 110.306 -173.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -124.97 159.7 57.75 Favored Pre-proline 0 C--N 1.304 -1.388 0 N-CA-C 104.411 -2.44 . . . . 0.0 104.411 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.514 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 88.4 Cg_exo -49.08 138.85 27.42 Favored 'Trans proline' 0 CA--C 1.527 0.152 0 C-N-CA 122.226 1.951 . . . . 0.0 112.493 -178.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -76.78 -161.78 0.22 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.585 -178.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -95.84 -38.24 10.38 Favored 'General case' 0 CA--C 1.481 -1.679 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . 0.7 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 27.8 m-20 -116.45 100.71 8.06 Favored 'General case' 0 N--CA 1.404 -2.726 0 N-CA-C 104.588 -2.375 . . . . 0.0 104.588 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 7.4 m -60.03 -56.78 17.49 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 123.689 0.618 . . . . 0.0 111.421 -172.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . 0.556 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 92.8 m-85 -103.86 135.3 45.65 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-O 121.455 0.645 . . . . 0.0 111.56 -179.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 76.7 p -148.98 -176.05 5.19 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -174.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -106.19 -174.22 2.48 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 173.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.6 -31.05 34.46 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 175.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -77.72 -50.24 12.8 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.959 -0.463 . . . . 0.0 111.215 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 133.65 -3.02 4.6 Favored Glycine 0 CA--C 1.494 -1.28 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -177.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -58.35 107.3 0.47 Allowed 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.174 -1.013 . . . . 0.0 109.678 175.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . 0.7 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 26.2 tptp -47.16 112.69 0.56 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 113.709 -1.587 . . . . 0.0 110.12 175.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -112.68 178.7 4.2 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.279 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . 0.46 ' HB2' ' HB2' ' A' ' 966' ' ' GLU . . . -71.48 155.84 40.13 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 5.9 p -77.81 162.43 67.82 Favored Pre-proline 0 N--CA 1.434 -1.256 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -58.61 -25.6 75.52 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.779 2.319 . . . . 0.0 112.559 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 1.2 m -68.35 -49.93 56.74 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . 0.46 ' HB2' ' HB2' ' A' ' 962' ' ' ALA . 47.4 mt-10 -64.66 -33.92 77.08 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.26 -1.336 . . . . 0.0 112.68 177.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.479 HD11 ' CH2' ' A' ' 980' ' ' TRP . 69.4 mt -67.29 112.16 4.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.811 0.815 . . . . 0.0 111.929 -178.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 21.7 p -117.4 171.19 8.15 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.286 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 19.2 p -87.1 138.54 32.57 Favored Pre-proline 0 C--N 1.319 -0.755 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.637 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.563 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 68.9 Cg_endo -82.88 163.61 15.87 Favored 'Trans proline' 0 C--O 1.243 0.734 0 C-N-CA 122.365 2.043 . . . . 0.0 111.083 178.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -61.82 102.98 0.26 Allowed 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 121.928 1.752 . . . . 0.0 110.15 173.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.462 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 127.21 -7.64 7.14 Favored Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.468 -0.873 . . . . 0.0 111.159 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.563 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.6 m95 -136.49 139.8 42.57 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.611 0.72 . . . . 0.0 111.105 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.559 ' HB2' HE21 ' A' 1033 ' ' GLN . 9.2 tp10 -123.66 136.9 54.75 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 126.26 1.824 . . . . 0.0 108.539 -173.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.617 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 91.3 m95 -84.6 158.73 20.79 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 119.436 1.016 . . . . 0.0 110.724 175.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -139.99 -36.78 0.49 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.09 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . 0.562 ' HB3' ' HD2' ' A' 1025 ' ' ARG . 9.9 t70 -67.43 150.52 48.8 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -68.32 -43.72 76.97 Favored 'General case' 0 C--N 1.314 -0.941 0 O-C-N 123.161 0.288 . . . . 0.0 111.577 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.07 159.27 12.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.749 0.309 . . . . 0.0 110.494 -172.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.55 ' HA ' ' O ' ' A' 1024 ' ' VAL . 17.1 m95 -76.43 91.45 3.31 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -177.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 18.5 t -103.45 162.11 13.3 Favored 'General case' 0 C--O 1.205 -1.254 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . 0.405 ' HA ' ' O ' ' A' 1022 ' ' ARG . 8.2 p90 -73.55 139.27 45.52 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 121.646 0.736 . . . . 0.0 111.801 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.442 ' HB2' HG12 ' A' 1024 ' ' VAL . 26.2 t70 -99.89 130.88 46.12 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.406 -175.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.45 ' HA ' HG23 ' A' ' 988' ' ' VAL . 2.4 pp -114.85 18.79 7.4 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.884 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.99 34.3 1.39 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -175.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.41 ' HB2' HG12 ' A' ' 988' ' ' VAL . 63.1 mtp180 -145.47 179.91 7.1 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -177.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -81.8 82.09 7.6 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 172.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.45 HG23 ' HA ' ' A' ' 984' ' ' ILE . 18.6 m -128.96 -170.79 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.794 -173.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -96.39 -172.23 2.48 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 105.265 -2.124 . . . . 0.0 105.265 -178.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -58.28 -33.42 69.41 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 122.94 0.496 . . . . 0.0 111.155 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -112.12 23.79 13.33 Favored 'General case' 0 N--CA 1.427 -1.601 0 C-N-CA 118.761 -1.176 . . . . 0.0 112.927 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 90.78 -11.91 70.38 Favored Glycine 0 C--O 1.229 -0.212 0 C-N-CA 120.112 -1.042 . . . . 0.0 112.899 173.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.556 ' HE3' ' HG2' ' A' 1019 ' ' ARG . 94.8 m95 -52.18 143.85 13.61 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 175.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.583 ' O ' ' HG3' ' A' 1019 ' ' ARG . 9.6 pt-20 -130.3 143.28 50.68 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 174.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.526 ' CD2' ' HA ' ' A' 1011 ' ' ALA . 1.4 t80 -104.54 115.96 31.25 Favored 'General case' 0 C--N 1.285 -2.226 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.894 -165.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . 0.426 ' HA2' ' O ' ' A' 1007 ' ' SER . . . -132.63 144.76 16.68 Favored Glycine 0 N--CA 1.435 -1.383 0 CA-C-O 122.016 0.787 . . . . 0.0 112.354 -177.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.612 HG23 ' CD2' ' A' 1016 ' ' HIS . 0.1 OUTLIER -93.24 173.66 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.502 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 998' ' ' THR . . . . . 0.402 ' HG1' ' HG3' ' A' 1005 ' ' PRO . 39.6 m -169.17 98.63 0.36 Allowed 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 104.995 -2.224 . . . . 0.0 104.995 178.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.435 ' O ' ' HB2' ' A' 1002 ' ' ASP . 68.0 mt -116.11 108.71 45.66 Favored Pre-proline 0 C--N 1.314 -0.969 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 -175.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.03 140.4 78.63 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 123.38 2.72 . . . . 0.0 113.609 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -76.17 150.28 93.33 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.029 -1.655 . . . . 0.0 111.295 -1.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1002 ' ' ASP . . . . . 0.44 ' CG ' ' H ' ' A' 1003 ' ' HIS . 8.5 t70 -172.15 -153.69 0.08 Allowed 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.14 -0.936 . . . . 0.0 108.899 -172.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1003 ' ' HIS . . . . . 0.44 ' H ' ' CG ' ' A' 1002 ' ' ASP . 4.3 m170 -151.87 -82.48 0.09 Allowed 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.44 0.696 . . . . 0.0 110.351 -178.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 80.6 mttt -128.84 154.4 80.05 Favored Pre-proline 0 C--N 1.309 -1.188 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 177.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1005 ' ' PRO . . . . . 0.402 ' HG3' ' HG1' ' A' ' 998' ' ' THR . 52.4 Cg_exo -55.52 125.34 18.81 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 121.888 1.725 . . . . 0.0 111.305 174.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 20.4 pttp -100.06 4.51 44.72 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.313 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1007 ' ' SER . . . . . 0.426 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 48.5 t -142.89 122.99 13.65 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.217 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.498 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 66.8 m95 -122.89 133.15 54.42 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.36 1.464 . . . . 0.0 107.055 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 15.8 m -143.98 -164.98 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -178.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -91.64 -35.31 14.28 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 120.246 1.385 . . . . 0.0 110.045 174.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1011 ' ' ALA . . . . . 0.526 ' HA ' ' CD2' ' A' ' 995' ' ' TYR . . . 171.72 172.66 0.09 Allowed 'General case' 0 CA--C 1.508 -0.64 0 O-C-N 123.81 0.694 . . . . 0.0 111.962 -172.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' 1013 ' ' LYS . 10.9 pt-20 160.22 -61.93 0.0 OUTLIER 'General case' 0 C--N 1.345 0.4 0 O-C-N 126.691 2.494 . . . . 0.0 112.626 174.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.42 ' N ' ' HG3' ' A' 1012 ' ' GLU . 59.1 mttp -131.14 149.56 52.54 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -165.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1014 ' ' MET . . . . . 0.579 ' SD ' ' HA2' ' A' ' 943' ' ' GLY . 59.4 ttp -65.02 -23.96 67.36 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.738 -1.574 . . . . 0.0 112.63 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1015 ' ' TYR . . . . . 0.429 ' O ' HG22 ' A' ' 997' ' ' ILE . 60.2 m-85 -61.06 -6.94 2.18 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 175.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.612 ' CD2' HG23 ' A' ' 997' ' ' ILE . 16.1 m80 -90.71 106.08 18.26 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.656 -2.35 . . . . 0.0 104.656 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 17.9 p -100.24 -6.45 26.0 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -169.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 13.6 m170 -129.45 142.5 50.77 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 122.062 -0.399 . . . . 0.0 110.826 -174.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 994' ' ' GLU . 10.4 ttm180 -150.94 146.99 26.63 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 177.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.591 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 3.5 ptp180 -148.55 166.51 28.02 Favored 'General case' 0 C--O 1.199 -1.566 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 177.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.55 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 23.7 ptt180 -146.35 150.85 36.49 Favored 'General case' 0 C--N 1.287 -2.128 0 O-C-N 123.389 0.431 . . . . 0.0 110.005 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.521 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.4 ttm180 -88.91 129.57 35.59 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 123.487 0.492 . . . . 0.0 111.422 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.553 HD23 ' OE1' ' A' ' 936' ' ' GLN . 70.8 mt -104.98 137.71 42.32 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 105.217 -2.142 . . . . 0.0 105.217 165.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.55 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 12.8 m -113.16 141.24 29.52 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 CA-C-O 122.027 0.918 . . . . 0.0 111.958 -176.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.562 ' HD2' ' HB3' ' A' ' 977' ' ' ASP . 11.8 tpt180 -138.7 100.69 4.14 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 113.579 -1.646 . . . . 0.0 106.682 172.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -74.14 146.22 43.67 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -178.186 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.617 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 10.3 ptm180 -142.62 166.65 24.08 Favored 'General case' 0 CA--C 1.493 -1.234 0 N-CA-C 105.842 -1.91 . . . . 0.0 105.842 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.688 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 13.3 ptpt -156.13 155.8 33.16 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-O 121.033 0.445 . . . . 0.0 110.348 -178.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.462 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 29.3 ttmt -83.73 -21.65 32.21 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 22.0 t70 44.36 23.51 0.07 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 111.298 -2.683 . . . . 0.0 112.024 -171.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 23.0 tp 66.12 -39.42 0.32 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.097 2.159 . . . . 0.0 113.455 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 9.8 t -69.95 -22.58 63.16 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 123.132 0.573 . . . . 0.0 112.092 -176.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.559 HE21 ' HB2' ' A' ' 974' ' ' GLU . 21.1 mt-30 . . . . . 0 CA--C 1.509 -0.627 0 C-N-CA 119.018 -1.073 . . . . 0.0 112.489 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 49.4 m-70 . . . . . 0 CA--C 1.488 -1.433 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 928' ' ' THR . . . . . 0.406 ' HB ' ' HE3' ' A' 1029 ' ' LYS . 1.5 m 63.34 87.58 0.11 Allowed 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 124.601 1.188 . . . . 0.0 107.843 -165.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.815 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.4 OUTLIER -102.75 168.19 9.4 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 179.652 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . 0.629 ' O ' ' HG2' ' A' 1027 ' ' ARG . 89.5 t80 -153.98 120.86 5.62 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 10.2 m -79.23 121.64 25.31 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 174.029 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -103.51 146.12 29.01 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 104.944 -2.243 . . . . 0.0 104.944 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.432 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -145.42 147.91 32.74 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 118.331 0.514 . . . . 0.0 110.965 -173.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 4.6 p -151.88 134.02 5.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 120.981 0.42 . . . . 0.0 110.085 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.562 ' HA ' ' O ' ' A' 1021 ' ' ARG . 94.9 m-85 -93.4 152.1 19.33 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -175.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.575 ' HG2' ' CE1' ' A' ' 953' ' ' TYR . 21.5 mt-30 -112.09 113.69 26.1 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 105.434 -2.062 . . . . 0.0 105.434 174.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . 0.482 ' HB3' ' HB1' ' A' ' 949' ' ' ALA . 12.2 m-80 -106.34 139.42 40.86 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -176.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.599 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 85.3 mt-10 -135.07 152.67 51.89 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 176.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 50.5 m -145.34 137.47 25.67 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.163 0.506 . . . . 0.0 111.596 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.542 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 18.3 ptt180 -139.82 161.63 37.11 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 124.446 1.098 . . . . 0.0 108.084 -174.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -65.29 161.56 48.61 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 170.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -66.21 86.73 0.25 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 121.458 1.439 . . . . 0.0 111.912 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 99.85 70.04 0.92 Allowed Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 107.728 -2.149 . . . . 0.0 107.728 -175.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -166.08 -148.04 5.41 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.57 -173.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -110.77 128.4 55.73 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 122.737 0.415 . . . . 0.0 110.984 -176.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.599 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 56.1 m95 -73.53 152.73 40.55 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-O 121.835 0.826 . . . . 0.0 109.695 176.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -133.57 169.18 14.62 Favored Pre-proline 0 C--N 1.3 -1.549 0 N-CA-C 103.452 -2.795 . . . . 0.0 103.452 171.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.2 124.4 16.16 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 N-CA-C 107.959 -1.593 . . . . 0.0 107.959 170.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . 0.482 ' HB1' ' HB3' ' A' ' 937' ' ' ASN . . . -37.68 -58.25 0.91 Allowed 'General case' 0 N--CA 1.483 1.215 0 O-C-N 124.877 1.361 . . . . 0.0 113.894 -171.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -168.29 -39.81 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 104.633 -2.358 . . . . 0.0 104.633 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -131.31 160.17 35.75 Favored 'General case' 0 N--CA 1.434 -1.259 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 168.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.0 m -93.65 -57.8 2.46 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 118.205 0.457 . . . . 0.0 110.391 -175.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . 0.575 ' CE1' ' HG2' ' A' ' 936' ' ' GLN . 58.3 m-85 -97.46 127.4 43.39 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 122.008 0.909 . . . . 0.0 110.729 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 954' ' ' THR . . . . . 0.485 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 1.1 p -144.0 167.14 23.08 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.31 -170.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -97.63 -173.68 2.7 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . 0.493 ' HA ' ' CE1' ' A' ' 935' ' ' TYR . . . -51.25 -27.18 8.54 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . 0.51 HD22 ' HB2' ' A' ' 959' ' ' ASP . 23.1 p-10 -92.78 -37.74 12.17 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.293 0.568 . . . . 0.0 111.518 178.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . 0.485 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 110.38 52.15 0.6 Allowed Glycine 0 CA--C 1.484 -1.864 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 -173.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . 0.51 ' HB2' HD22 ' A' ' 957' ' ' ASN . 17.7 t70 -121.07 106.38 11.51 Favored 'General case' 0 N--CA 1.419 -2.004 0 N-CA-C 100.977 -3.712 . . . . 0.0 100.977 176.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -44.21 123.89 3.67 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 124.926 1.391 . . . . 0.0 112.251 -176.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -121.93 -174.93 2.99 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 113.318 -1.764 . . . . 0.0 108.933 -175.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . 0.495 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -71.8 147.88 46.8 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 3.7 m -75.29 158.72 83.5 Favored Pre-proline 0 C--N 1.313 -1.018 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.582 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 29.2 Cg_exo -54.75 -21.49 25.66 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.916 2.411 . . . . 0.0 114.428 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 5.7 p -74.27 -49.44 23.15 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.78 0.8 . . . . 0.0 109.31 175.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . 0.495 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 32.6 mt-10 -65.36 -30.01 70.79 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.295 -1.32 . . . . 0.0 110.666 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.47 HD13 ' HA ' ' A' ' 964' ' ' PRO . 71.4 mt -67.49 111.74 4.29 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.284 0.634 . . . . 0.0 109.557 176.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.2 p -116.55 168.51 10.11 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -171.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 5.8 p -96.86 121.9 58.17 Favored Pre-proline 0 N--CA 1.44 -0.973 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.369 175.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.598 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 28.9 Cg_endo -82.8 175.56 8.56 Favored 'Trans proline' 0 C--O 1.242 0.686 0 C-N-CA 123.92 3.08 . . . . 0.0 111.198 178.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.86 111.05 0.85 Allowed 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 122.15 1.9 . . . . 0.0 111.645 176.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.534 ' O ' ' HA ' ' A' 1029 ' ' LYS . . . 108.69 -3.54 32.32 Favored Glycine 0 N--CA 1.431 -1.653 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.852 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.598 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 97.3 m95 -120.4 122.62 41.15 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 122.405 1.098 . . . . 0.0 112.688 -178.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.563 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 7.5 tp10 -108.18 123.18 48.34 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 126.953 2.101 . . . . 0.0 111.599 -172.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 24.0 m95 -78.95 105.84 10.55 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.699 172.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . 0.473 ' CD ' ' HE3' ' A' 1028 ' ' LYS . 38.9 mt-10 -73.4 -43.94 59.46 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 121.581 0.705 . . . . 0.0 109.663 175.083 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.02 146.18 54.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.466 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -76.62 -32.11 57.84 Favored 'General case' 0 C--N 1.318 -0.785 0 O-C-N 123.462 0.476 . . . . 0.0 110.84 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -163.43 157.23 19.62 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.582 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 27.1 m95 -72.93 113.22 9.72 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 177.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 18.8 m -120.45 150.36 40.93 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 -172.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . 0.486 ' HA ' ' O ' ' A' 1022 ' ' ARG . 0.3 OUTLIER -74.2 126.57 30.9 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.688 0.756 . . . . 0.0 110.727 -175.675 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -83.03 143.19 30.78 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-N 113.516 -1.675 . . . . 0.0 111.041 -167.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 15.6 pt -133.66 23.45 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.942 0.877 . . . . 0.0 109.38 176.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . 0.429 ' O ' ' HD3' ' A' ' 986' ' ' ARG . 3.4 t-20 -96.12 13.94 25.55 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 178.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.429 ' HD3' ' O ' ' A' ' 985' ' ' ASN . 1.0 OUTLIER -134.02 177.46 7.72 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 114.243 -1.344 . . . . 0.0 107.414 -175.071 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -88.27 82.17 7.14 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.926 0.869 . . . . 0.0 109.471 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.465 HG13 ' HG2' ' A' ' 994' ' ' GLU . 15.4 m -138.49 164.64 26.29 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 114.147 -1.388 . . . . 0.0 109.373 -177.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -55.44 169.98 0.26 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.923 0.489 . . . . 0.0 110.494 171.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -58.61 -30.92 67.6 Favored 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 121.911 -0.493 . . . . 0.0 111.664 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . 0.484 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 48.1 mttm -98.67 9.86 42.37 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 119.414 -0.915 . . . . 0.0 110.868 178.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.69 -13.98 65.28 Favored Glycine 0 C--O 1.226 -0.357 0 CA-C-N 116.724 -0.217 . . . . 0.0 112.646 174.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.484 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 85.1 m95 -51.54 130.97 29.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.844 0.83 . . . . 0.0 112.718 178.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.465 ' HG2' HG13 ' A' ' 988' ' ' VAL . 29.5 mt-10 -107.96 155.79 19.93 Favored 'General case' 0 C--O 1.251 1.148 0 C-N-CA 124.042 0.937 . . . . 0.0 109.413 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.607 ' O ' ' HA ' ' A' 1008 ' ' TRP . 26.2 t80 -81.08 96.72 7.25 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 112.456 -2.156 . . . . 0.0 110.216 -177.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -121.86 106.06 1.05 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 118.863 -1.637 . . . . 0.0 111.86 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.511 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -111.0 151.1 13.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 O-C-N 120.931 -1.335 . . . . 0.0 108.484 178.539 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 5.2 m -127.69 103.3 7.23 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 176.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 62.9 mt -80.64 123.42 82.61 Favored Pre-proline 0 C--N 1.318 -0.803 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -61.84 142.16 92.52 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.462 2.108 . . . . 0.0 112.938 -178.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -96.87 145.96 6.24 Favored 'Cis proline' 0 N--CA 1.452 -0.938 0 C-N-CA 123.366 -1.514 . . . . 0.0 113.636 -2.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 6.6 t70 168.28 -179.54 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 104.435 -2.431 . . . . 0.0 104.435 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -132.37 -33.86 1.25 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 118.861 0.755 . . . . 0.0 112.074 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 79.3 mttt -112.8 132.51 22.25 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -177.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -59.61 134.31 57.04 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 123.179 2.586 . . . . 0.0 109.99 168.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -116.94 15.86 15.16 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 122.434 1.112 . . . . 0.0 109.196 -177.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 41.9 t -148.01 137.81 22.51 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 113.948 -1.478 . . . . 0.0 108.235 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.607 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 56.5 m95 -136.17 137.34 40.82 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.49 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 47.0 t -143.21 178.65 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 N-CA-C 104.183 -2.525 . . . . 0.0 104.183 -173.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1010 ' ' ALA . . . . . 0.471 ' H ' HG13 ' A' 1009 ' ' VAL . . . -99.83 4.34 45.16 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 120.072 1.305 . . . . 0.0 112.657 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -86.59 -168.29 2.18 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 121.736 -0.602 . . . . 0.0 112.294 -178.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.552 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.4 OUTLIER -159.39 106.8 1.75 Allowed 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.735 0.778 . . . . 0.0 108.954 -174.739 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.416 ' H ' ' CE1' ' A' 1016 ' ' HIS . 98.2 mttt -113.55 148.32 36.34 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.761 -178.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 51.7 ttp -47.67 -39.14 16.49 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 124.146 0.904 . . . . 0.0 112.158 176.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -61.37 -0.35 0.37 Allowed 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.552 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 2.9 m80 -61.83 118.95 7.86 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 178.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1017 ' ' THR . . . . . 0.522 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 25.4 p -104.79 -18.45 14.25 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.736 174.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 5.1 m80 -140.93 151.18 44.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.9 -177.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -156.94 151.88 26.0 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 170.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.441 ' HB3' ' OD1' ' A' ' 937' ' ' ASN . 6.1 ptp180 -151.26 163.84 37.96 Favored 'General case' 0 C--O 1.187 -2.199 0 C-N-CA 118.886 -1.126 . . . . 0.0 109.567 175.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.562 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 25.6 ptt180 -141.75 148.62 39.29 Favored 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.919 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 982' ' ' TYR . 41.3 ttm180 -90.42 122.11 32.99 Favored 'General case' 0 N--CA 1.44 -0.933 0 O-C-N 123.525 0.515 . . . . 0.0 111.684 -178.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.581 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 83.6 mt -91.58 129.59 37.53 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 106.009 -1.849 . . . . 0.0 106.009 166.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1024 ' ' VAL . . . . . . . . . . . . . 8.0 m -112.16 137.45 44.86 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 CA-C-O 122.219 1.009 . . . . 0.0 111.518 -177.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.451 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 6.3 tpt180 -137.06 101.32 4.52 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 113.1 -1.863 . . . . 0.0 108.278 171.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -82.1 148.9 28.3 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.629 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 11.5 ptm180 -144.07 179.24 7.33 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 104.915 -2.254 . . . . 0.0 104.915 -171.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.815 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 15.8 ptpt -162.17 160.71 27.45 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 175.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 972' ' ' GLY . 35.6 ttmt -87.81 -16.47 34.01 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-O 123.027 1.394 . . . . 0.0 107.758 -177.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 22.7 t70 55.46 16.56 1.85 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 112.019 -2.355 . . . . 0.0 110.661 -172.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 37.8 tp 62.51 -56.62 0.14 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.583 1.553 . . . . 0.0 112.26 -172.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 11.6 p -87.1 0.61 54.99 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 -172.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.563 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 47.6 mt-30 . . . . . 0 CA--C 1.519 -0.24 0 C-N-CA 118.16 -1.416 . . . . 0.0 110.302 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . 0.505 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 42.2 m-70 . . . . . 0 N--CA 1.445 -0.696 0 N-CA-C 106.155 -1.795 . . . . 0.0 106.155 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -168.58 116.98 0.7 Allowed 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 169.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -137.58 129.77 29.21 Favored 'General case' 0 C--N 1.288 -2.07 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 174.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -121.55 138.12 54.44 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.559 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 31.3 m -77.84 122.34 25.32 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 175.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -96.56 175.02 6.55 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.655 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.6 pt-20 -168.83 143.72 3.24 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.497 0.665 . . . . 0.0 110.958 -171.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.454 ' O ' ' HA ' ' A' 1022 ' ' ARG . 13.0 p -135.47 -177.61 2.08 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 173.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.57 ' HA ' ' O ' ' A' 1021 ' ' ARG . 87.3 m-85 -137.27 146.18 44.42 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 118.862 0.755 . . . . 0.0 109.09 -178.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.493 ' O ' ' HA ' ' A' 1020 ' ' ARG . 30.9 tt0 -116.81 118.05 31.42 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 -179.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 -109.18 142.33 40.13 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-O 122.141 0.972 . . . . 0.0 111.536 -175.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.568 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 62.0 mt-10 -128.95 162.57 27.26 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 170.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 38.1 m -146.89 152.75 39.2 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.978 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' 1017 ' ' THR . 25.9 ptt180 -149.45 159.84 43.95 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 114.947 -1.024 . . . . 0.0 108.876 177.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -75.82 161.71 74.82 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 170.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . 0.422 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 23.0 Cg_exo -66.42 92.91 0.29 Allowed 'Trans proline' 0 N--CA 1.458 -0.586 0 N-CA-C 109.169 -1.127 . . . . 0.0 109.169 171.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 119.68 11.03 7.38 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -172.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -109.45 -174.07 21.01 Favored Glycine 0 CA--C 1.498 -0.988 0 N-CA-C 108.203 -1.959 . . . . 0.0 108.203 176.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -120.97 159.26 25.97 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 105.561 -2.014 . . . . 0.0 105.561 170.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.568 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 43.0 m95 -71.07 125.96 28.29 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-O 121.428 0.633 . . . . 0.0 111.374 -172.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -114.9 172.54 3.53 Favored Pre-proline 0 C--N 1.299 -1.607 0 N-CA-C 102.634 -3.099 . . . . 0.0 102.634 170.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -54.73 147.66 49.01 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 CA-C-N 121.649 1.624 . . . . 0.0 111.848 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -69.35 -170.06 0.25 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.777 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.21 -29.01 13.45 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 -179.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -120.53 88.15 2.88 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 103.765 -2.68 . . . . 0.0 103.765 173.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 20.5 m -62.03 -51.97 65.87 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.004 -172.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 79.8 m-85 -103.31 133.9 47.61 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 119.551 -0.86 . . . . 0.0 111.097 177.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 72.7 p -142.91 174.77 10.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.48 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -109.81 -173.48 2.27 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.84 -36.19 36.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 114.044 1.128 . . . . 0.0 114.044 -174.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -101.34 11.13 39.79 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 92.78 0.18 69.31 Favored Glycine 0 CA--C 1.497 -1.042 0 C-N-CA 119.53 -1.319 . . . . 0.0 111.578 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -56.82 104.11 0.14 Allowed 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 174.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . 0.473 ' HD3' ' C ' ' A' ' 960' ' ' LYS . 7.8 tmtm? -49.52 118.5 2.8 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 124.158 0.911 . . . . 0.0 108.887 176.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -121.71 176.0 5.95 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.13 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -66.32 149.9 49.68 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 123.638 0.586 . . . . 0.0 110.661 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 15.6 m -85.38 156.73 59.44 Favored Pre-proline 0 N--CA 1.437 -1.119 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.503 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.3 Cg_exo -48.16 -32.81 19.85 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.397 3.398 . . . . 0.0 116.636 -173.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.6 p -75.81 -45.33 36.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.461 1.124 . . . . 0.0 109.437 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -65.2 -27.26 68.56 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.037 -1.892 . . . . 0.0 110.585 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.467 HD13 ' CH2' ' A' ' 980' ' ' TRP . 33.1 mt -71.49 120.6 17.31 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.061 0.944 . . . . 0.0 110.371 175.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 26.1 p -125.07 170.94 10.68 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.979 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 6.6 p -82.87 148.53 57.52 Favored Pre-proline 0 C--N 1.315 -0.925 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.998 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.549 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 20.0 Cg_endo -91.6 165.75 3.42 Favored 'Trans proline' 0 C--O 1.239 0.568 0 C-N-CA 123.004 2.469 . . . . 0.0 111.267 174.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.11 108.33 1.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 121.709 1.606 . . . . 0.0 110.579 174.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.601 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 118.93 1.71 14.45 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 120.908 -0.663 . . . . 0.0 111.859 -177.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.549 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 90.1 m95 -137.43 137.54 38.87 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 122.2 1.0 . . . . 0.0 111.161 177.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.586 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 9.4 tp10 -118.23 143.23 46.71 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.155 -1.839 . . . . 0.0 106.115 -174.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.518 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 98.7 m95 -83.53 153.77 24.2 Favored 'General case' 0 C--N 1.296 -1.736 0 O-C-N 120.693 -1.255 . . . . 0.0 110.418 171.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -121.55 -42.2 2.45 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . 0.748 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 1.6 m-20 -77.05 155.83 32.22 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.432 178.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -75.81 -56.72 4.41 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -171.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -156.54 147.88 22.37 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -175.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.503 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 17.6 m95 -61.39 120.43 10.45 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 124.167 0.917 . . . . 0.0 109.295 -172.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 981' ' ' SER . . . . . 0.6 ' O ' ' HA ' ' A' 1023 ' ' LEU . 42.4 m -111.63 -166.69 1.1 Allowed 'General case' 0 C--O 1.201 -1.45 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 17.6 p90 -109.82 154.34 23.13 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 119.825 1.193 . . . . 0.0 112.208 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.52 ' HB3' ' HB3' ' A' 1022 ' ' ARG . 9.0 t70 -99.89 131.57 45.78 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.672 -171.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 30.8 pt -119.87 28.32 3.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 122.209 1.004 . . . . 0.0 109.011 173.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -106.4 24.35 12.69 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 123.012 1.387 . . . . 0.0 108.963 -175.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -139.5 -177.61 5.02 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 -179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -83.93 80.76 9.05 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 172.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.896 HG13 ' HG2' ' A' ' 994' ' ' GLU . 29.2 m -135.97 156.14 36.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.352 -170.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.37 170.14 0.16 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.956 170.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -52.62 -34.18 49.93 Favored 'General case' 0 CA--C 1.498 -1.02 0 C-N-CA 123.479 0.711 . . . . 0.0 111.239 176.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . 0.424 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 84.5 mttt -98.35 2.97 48.54 Favored 'General case' 0 N--CA 1.422 -1.842 0 CA-C-N 114.924 -1.035 . . . . 0.0 111.947 -176.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 100.67 -16.08 57.94 Favored Glycine 0 C--O 1.223 -0.576 0 C-N-CA 121.27 -0.49 . . . . 0.0 111.888 178.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.71 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 71.3 m95 -55.8 116.61 3.04 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.896 ' HG2' HG13 ' A' ' 988' ' ' VAL . 5.0 mt-10 -99.76 155.44 17.64 Favored 'General case' 0 C--O 1.257 1.451 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.432 176.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.504 ' HD2' ' HB2' ' A' 1011 ' ' ALA . 21.9 t80 -69.47 102.67 1.85 Allowed 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 129.015 2.926 . . . . 0.0 110.829 -178.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -124.13 122.41 4.8 Favored Glycine 0 CA--C 1.503 -0.659 0 C-N-CA 119.33 -1.414 . . . . 0.0 111.876 172.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.982 ' HB ' ' HD2' ' A' 1016 ' ' HIS . 1.3 tt -133.24 139.57 48.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 O-C-N 121.663 -0.904 . . . . 0.0 109.291 -179.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 35.0 m -132.61 116.81 17.13 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.401 ' HA ' ' HD2' ' A' 1000 ' ' PRO . 12.2 pt -114.18 97.38 45.39 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-O 121.188 0.518 . . . . 0.0 111.891 -175.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1000 ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 999' ' ' ILE . 18.7 Cg_endo -58.88 132.98 50.77 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.632 2.888 . . . . 0.0 114.415 -175.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -79.59 146.02 75.26 Favored 'Cis proline' 0 N--CA 1.454 -0.835 0 C-N-CA 122.743 -1.774 . . . . 0.0 112.015 -0.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 6.2 t70 -153.53 -159.91 1.05 Allowed 'General case' 0 C--N 1.293 -1.878 0 CA-C-N 113.873 -1.512 . . . . 0.0 107.91 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -138.0 -57.67 0.66 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.248 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 63.0 mttp -165.26 155.69 12.09 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 102.837 -3.023 . . . . 0.0 102.837 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -60.53 122.0 10.61 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 CA-C-N 121.758 1.664 . . . . 0.0 109.244 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 46.7 pttt -83.78 -7.51 59.45 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.566 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 9.6 t -144.01 135.22 25.62 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -174.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.579 ' HE3' ' HB2' ' A' ' 994' ' ' GLU . 42.6 m95 -134.24 135.39 42.91 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 125.436 1.71 . . . . 0.0 106.405 175.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 2.6 m -162.9 -174.01 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 -174.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -97.4 104.74 16.78 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1011 ' ' ALA . . . . . 0.504 ' HB2' ' HD2' ' A' ' 995' ' ' TYR . . . -178.25 -176.96 0.55 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -175.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.548 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.2 OUTLIER -174.63 118.03 0.2 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.805 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.43 ' H ' ' ND1' ' A' 1016 ' ' HIS . 46.9 mttp -132.37 153.4 50.81 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.421 -172.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 23.0 ttt -53.03 -44.03 67.03 Favored 'General case' 0 C--N 1.315 -0.918 0 O-C-N 124.607 1.192 . . . . 0.0 113.38 -177.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1015 ' ' TYR . . . . . 0.422 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 54.0 m-85 -68.47 9.63 0.33 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.982 ' HD2' ' HB ' ' A' ' 997' ' ' ILE . 22.0 m170 -69.72 175.65 4.1 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.908 0.861 . . . . 0.0 112.233 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1017 ' ' THR . . . . . 0.445 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 1.1 m -155.75 -42.0 0.08 Allowed 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 -169.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 16.7 m170 -132.02 144.31 50.68 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.49 -174.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.71 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 42.7 ttp180 -151.92 146.09 25.36 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.493 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 5.5 ptp180 -156.15 165.48 36.28 Favored 'General case' 0 C--O 1.198 -1.627 0 C-N-CA 117.575 -1.65 . . . . 0.0 110.824 178.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.57 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 29.4 ptt180 -144.38 151.36 39.17 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.792 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.655 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 36.2 ttm180 -83.7 129.76 34.95 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.6 ' HA ' ' O ' ' A' ' 981' ' ' SER . 72.9 mt -98.95 128.22 45.05 Favored 'General case' 0 N--CA 1.414 -2.275 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 167.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.513 HG13 ' HB2' ' A' ' 983' ' ' ASP . 1.4 m -104.76 145.1 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.828 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.503 -171.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.748 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -156.22 114.08 3.29 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 124.999 1.437 . . . . 0.0 111.299 168.001 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.56 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 1.8 tmmm? -82.09 144.83 30.52 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 -176.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.518 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 6.3 ptm180 -135.79 137.89 42.04 Favored 'General case' 0 C--O 1.209 -1.036 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 -172.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.556 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 30.2 ttmt -123.08 137.85 54.82 Favored 'General case' 0 C--N 1.284 -2.258 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.012 -171.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.652 ' C ' ' H ' ' A' 1031 ' ' LEU . 36.8 ttmt -89.1 -21.14 23.53 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-O 123.228 1.49 . . . . 0.0 108.26 -177.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 21.5 t70 66.67 -22.91 0.1 Allowed 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 111.927 -2.397 . . . . 0.0 112.28 -169.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1031 ' ' LEU . . . . . 0.652 ' H ' ' C ' ' A' 1029 ' ' LYS . 27.6 tp 88.46 -25.34 0.08 Allowed 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 129.029 2.932 . . . . 0.0 110.899 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 34.4 p -74.77 -16.35 60.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.307 0.575 . . . . 0.0 111.363 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.586 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 98.0 mt-30 . . . . . 0 C--O 1.233 0.203 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.459 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 56.9 m-70 . . . . . 0 CA--C 1.502 -0.889 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.6 m -161.2 124.43 3.25 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 102.804 -3.035 . . . . 0.0 102.804 168.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.475 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.4 OUTLIER -153.25 145.96 24.29 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 178.639 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -141.14 143.7 34.42 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.615 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 25.7 m -74.15 125.71 28.97 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 177.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -101.36 156.78 17.25 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 105.085 -2.191 . . . . 0.0 105.085 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.457 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.0 pt-20 -147.77 152.48 37.79 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.448 -174.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.488 HG12 ' HG3' ' A' ' 964' ' ' PRO . 12.2 p -141.95 174.76 5.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.49 ' HA ' ' O ' ' A' 1021 ' ' ARG . 68.6 m-85 -135.61 150.39 49.65 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.557 ' O ' ' HA ' ' A' 1020 ' ' ARG . 36.8 tt0 -126.18 127.53 45.85 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -178.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . 0.982 ' HB3' ' HG2' ' A' 1020 ' ' ARG . 0.0 OUTLIER -137.92 152.23 48.78 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 -177.05 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.621 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 46.3 mt-10 -135.22 161.05 36.48 Favored 'General case' 0 C--O 1.245 0.834 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 178.065 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 939' ' ' SER . . . . . 0.484 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 17.9 p -133.36 147.92 51.83 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.143 0.497 . . . . 0.0 111.336 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.466 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 21.6 ptt180 -149.02 161.44 41.91 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.81 158.38 69.69 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 171.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . 0.463 ' HG3' HG23 ' A' 1017 ' ' THR . 24.5 Cg_exo -62.78 92.32 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 121.345 1.363 . . . . 0.0 110.259 174.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 97.0 70.58 1.03 Allowed Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 108.974 -1.65 . . . . 0.0 108.974 -176.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -160.5 -131.24 1.2 Allowed Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.102 -175.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -137.42 131.07 31.45 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.547 -0.827 . . . . 0.0 111.047 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.621 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 36.1 m95 -78.92 149.98 32.22 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-O 121.512 0.672 . . . . 0.0 110.485 -177.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -137.84 166.06 29.07 Favored Pre-proline 0 C--N 1.305 -1.352 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 171.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -49.31 127.95 19.04 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 CA-C-N 121.262 1.486 . . . . 0.0 110.285 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . 0.484 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -47.78 -51.7 21.46 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 124.725 1.266 . . . . 0.0 111.613 -174.61 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 163.33 -35.37 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 178.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . 0.412 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 15.6 m-20 -132.13 102.27 5.73 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 174.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 952' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 936' ' ' GLN . 24.1 m -68.96 -46.2 68.76 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -172.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . 0.412 ' CE1' ' HB2' ' A' ' 936' ' ' GLN . 59.7 m-85 -104.79 130.57 52.87 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.874 0.845 . . . . 0.0 110.591 175.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 5.0 p -145.02 173.09 12.19 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.264 -1.334 . . . . 0.0 111.017 -166.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . 0.478 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 11.3 t70 -97.72 170.74 8.79 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 175.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.49 -27.95 7.52 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 119.548 1.067 . . . . 0.0 113.67 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -95.39 2.19 54.5 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 98.07 -3.87 60.5 Favored Glycine 0 CA--C 1.497 -1.049 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.845 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . 0.478 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 38.6 t70 -51.74 108.41 0.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 O-C-N 124.388 0.699 . . . . 0.0 110.308 176.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . 0.412 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 51.8 tptt -47.14 111.1 0.36 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.537 1.148 . . . . 0.0 109.076 172.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -120.96 -179.91 4.17 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.604 -174.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -74.75 146.63 42.01 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 13.6 m -76.16 156.82 83.73 Favored Pre-proline 0 C--N 1.313 -1.011 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.546 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 53.1 Cg_exo -50.91 -25.13 15.14 Favored 'Trans proline' 0 N--CA 1.487 1.101 0 C-N-CA 123.537 2.825 . . . . 0.0 115.407 -177.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 9.3 p -71.3 -49.47 42.46 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.861 0.839 . . . . 0.0 108.993 176.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -66.2 -28.15 68.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.699 175.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.497 HD13 ' HA ' ' A' ' 964' ' ' PRO . 67.7 mt -66.46 110.72 3.24 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 10.6 p -126.27 -179.95 4.98 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.891 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.673 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 24.0 p -94.65 124.92 53.44 Favored Pre-proline 0 C--N 1.308 -1.239 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.689 178.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.575 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 80.3 Cg_endo -78.53 162.84 27.38 Favored 'Trans proline' 0 C--N 1.336 -0.118 0 C-N-CA 123.197 2.598 . . . . 0.0 110.461 178.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -59.45 100.91 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 121.66 1.574 . . . . 0.0 110.942 174.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.656 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 127.34 -3.57 7.2 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -176.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.673 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 94.7 m95 -141.21 145.98 36.33 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 122.68 0.392 . . . . 0.0 110.307 177.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.563 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 5.5 tp10 -131.69 157.57 43.41 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 126.004 1.722 . . . . 0.0 106.41 -175.248 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.635 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 98.4 m95 -90.34 148.05 23.09 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 120.468 -1.395 . . . . 0.0 112.691 170.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -113.2 -43.82 3.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 178.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . 0.467 ' HB3' ' NE ' ' A' 1025 ' ' ARG . 69.4 m-20 -78.22 161.19 27.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.788 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -84.18 -57.48 3.16 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 115.186 1.551 . . . . 0.0 115.186 -176.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -155.77 142.69 18.99 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 121.408 -0.808 . . . . 0.0 110.404 -170.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.546 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 15.4 m95 -66.84 130.49 43.33 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.118 0.485 . . . . 0.0 109.97 -173.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 981' ' ' SER . . . . . 0.425 ' O ' ' HA ' ' A' 1023 ' ' LEU . 62.3 m -128.67 166.39 19.01 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 -179.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 20.4 p90 -74.41 142.55 44.98 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -178.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.494 ' HB2' HG13 ' A' 1024 ' ' VAL . 31.9 t0 -97.96 122.03 40.6 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.024 -177.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.2 pp -114.46 22.66 5.65 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.385 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -97.98 27.44 4.52 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.522 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 50.6 mtp180 -141.78 -177.16 5.06 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 -173.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.31 84.89 6.97 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 16.8 m -141.1 157.21 22.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.477 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -53.06 169.45 0.1 Allowed 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.773 172.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -55.33 -34.17 63.98 Favored 'General case' 0 CA--C 1.507 -0.675 0 C-N-CA 123.061 0.544 . . . . 0.0 112.439 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -98.68 11.85 37.26 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.418 0.628 . . . . 0.0 110.008 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 69.85 81.27 0.24 Allowed Glycine 0 N--CA 1.431 -1.654 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.243 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.513 ' CE3' ' HD2' ' A' 1019 ' ' ARG . 99.5 m95 -148.13 131.53 16.63 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.66 ' HG2' ' O ' ' A' 1020 ' ' ARG . 6.4 pt-20 -108.02 150.88 26.58 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-O 121.611 0.719 . . . . 0.0 112.493 -177.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.685 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -74.67 94.63 2.72 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 112.556 -2.111 . . . . 0.0 111.329 -173.339 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -110.88 101.37 1.34 Allowed Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 120.33 -0.938 . . . . 0.0 111.272 177.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.46 HD12 ' HB3' ' A' 1015 ' ' TYR . 0.7 OUTLIER -110.19 133.19 56.34 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.055 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.792 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 8.7 m -118.61 97.05 5.54 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 120.608 0.242 . . . . 0.0 110.357 -177.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.443 ' O ' HD12 ' A' ' 999' ' ' ILE . 2.4 pp -81.41 133.59 53.01 Favored Pre-proline 0 C--N 1.319 -0.724 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.764 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1000 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 51.5 Cg_endo -70.55 143.36 46.8 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.825 2.35 . . . . 0.0 113.736 -175.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1001 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 9.3 Cg_endo -93.7 143.86 9.01 Favored 'Cis proline' 0 N--CA 1.451 -1.009 0 C-N-CA 123.057 -1.643 . . . . 0.0 112.198 -3.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 2.7 t70 170.0 167.28 0.06 Allowed 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 113.342 -1.754 . . . . 0.0 107.718 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 13.9 p-80 -142.24 33.49 1.51 Allowed 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.845 0.355 . . . . 0.0 110.148 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -163.5 124.74 1.5 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.426 -175.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1005 ' ' PRO . . . . . 0.545 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 51.5 Cg_exo -63.79 126.29 17.13 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 121.525 1.484 . . . . 0.0 109.445 166.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 55.2 pttt -107.21 7.71 29.58 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.949 0.88 . . . . 0.0 109.188 -178.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.0 t -144.28 138.03 27.65 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.421 -1.263 . . . . 0.0 108.651 -177.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.564 ' CE3' ' HG3' ' A' ' 994' ' ' GLU . 66.9 m95 -133.72 140.24 46.88 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 98.4 t -139.34 152.86 23.65 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -78.86 100.32 7.13 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 175.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1011 ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' A' ' 995' ' ' TYR . . . 177.19 -174.2 0.12 Allowed 'General case' 0 C--O 1.235 0.293 0 O-C-N 123.876 0.735 . . . . 0.0 110.588 -171.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.753 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.3 OUTLIER -172.34 104.52 0.17 Allowed 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 106.491 -1.67 . . . . 0.0 106.491 177.61 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.446 ' H ' ' CE1' ' A' 1016 ' ' HIS . 21.9 mttp -141.66 166.93 23.39 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 112.852 -1.976 . . . . 0.0 110.283 -170.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 55.6 ttp -49.95 -47.34 52.62 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -173.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1015 ' ' TYR . . . . . 0.46 ' HB3' HD12 ' A' ' 997' ' ' ILE . 33.2 m-85 -62.25 -0.89 0.61 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.753 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 15.3 m80 -59.28 111.05 1.22 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 118.55 0.613 . . . . 0.0 112.229 175.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1017 ' ' THR . . . . . 0.463 HG23 ' HG3' ' A' ' 942' ' ' PRO . 42.1 p -96.32 -28.63 14.4 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 123.478 1.609 . . . . 0.0 107.525 174.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 7.2 m170 -139.3 156.26 47.16 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 112.658 -2.064 . . . . 0.0 109.348 -178.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.513 ' HD2' ' CE3' ' A' ' 993' ' ' TRP . 38.0 ptt180 -149.93 145.76 26.67 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 171.016 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.982 ' HG2' ' HB3' ' A' ' 937' ' ' ASN . 53.9 mtp180 -144.09 167.4 22.46 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.3 ptt180 -157.38 154.48 28.96 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.611 174.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.522 ' NH1' ' HD2' ' A' ' 986' ' ' ARG . 35.8 ttm180 -90.31 133.27 35.07 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 123.604 0.565 . . . . 0.0 109.775 178.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.487 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 71.9 mt -102.12 130.76 48.81 Favored 'General case' 0 N--CA 1.421 -1.909 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 165.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.494 HG13 ' HB2' ' A' ' 983' ' ' ASP . 1.8 m -106.35 145.09 14.56 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.354 -174.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.749 ' NE ' ' HA ' ' A' 1025 ' ' ARG . 0.6 OUTLIER -158.99 115.99 2.73 Favored 'General case' 0 C--N 1.31 -1.146 0 O-C-N 125.218 1.574 . . . . 0.0 113.017 168.233 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.8 tmmm? -76.29 142.38 41.34 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.204 0.526 . . . . 0.0 109.765 -177.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.635 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 11.2 ptm180 -130.69 144.52 51.49 Favored 'General case' 0 CA--C 1.497 -1.076 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -173.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.529 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 58.5 tttt -134.02 135.3 43.29 Favored 'General case' 0 C--N 1.286 -2.157 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.191 -167.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.656 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 34.6 ttmt -84.58 -20.26 31.77 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 123.473 1.606 . . . . 0.0 107.362 179.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1030 ' ' ASP . . . . . 0.433 ' H ' ' HG2' ' A' 1028 ' ' LYS . 24.6 t70 61.95 -17.71 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 111.246 -2.706 . . . . 0.0 113.555 -171.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1031 ' ' LEU . . . . . 0.629 ' H ' ' C ' ' A' 1029 ' ' LYS . 18.5 tp 81.25 -10.54 1.19 Allowed 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 128.43 2.692 . . . . 0.0 110.621 -178.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 17.6 p -87.69 -3.5 58.96 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.384 0.612 . . . . 0.0 111.394 -177.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.563 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 80.3 mt-30 . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.691 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . 0.541 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 6.1 m-70 . . . . . 0 CA--C 1.493 -1.215 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.87 127.26 48.77 Favored 'General case' 0 N--CA 1.42 -1.971 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 162.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.507 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 0.0 OUTLIER -138.48 149.66 45.64 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 104.853 -2.277 . . . . 0.0 104.853 171.715 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -154.48 138.65 16.53 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 -174.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 931' ' ' THR . . . . . . . . . . . . . 45.4 m -79.77 132.82 36.25 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 177.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -110.04 156.88 19.94 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.438 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.0 pt-20 -154.21 159.48 41.37 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 121.282 0.563 . . . . 0.0 111.118 -173.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.626 ' O ' ' HA ' ' A' 1022 ' ' ARG . 8.8 p -147.96 179.6 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 176.022 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.479 ' HA ' ' O ' ' A' 1021 ' ' ARG . 77.9 m-85 -139.97 118.51 12.25 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 118.468 0.576 . . . . 0.0 110.418 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.468 ' O ' ' HA ' ' A' 1020 ' ' ARG . 47.3 mt-30 -78.46 122.47 25.87 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 170.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . 0.45 ' HB3' ' HB3' ' A' ' 949' ' ' ALA . 24.5 m-80 -117.5 143.24 46.26 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 123.338 0.655 . . . . 0.0 112.049 -176.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.64 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 52.4 mt-10 -136.18 150.76 49.16 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 174.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 939' ' ' SER . . . . . 0.494 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 31.8 p -134.85 146.63 49.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 117.895 0.316 . . . . 0.0 111.72 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.549 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 25.0 ptt180 -153.3 161.33 42.48 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 124.156 0.982 . . . . 0.0 108.685 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -68.71 153.21 96.16 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 172.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . 0.495 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 70.2 Cg_exo -55.49 97.97 0.06 OUTLIER 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 121.893 1.729 . . . . 0.0 111.219 174.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 93.88 66.99 1.05 Allowed Glycine 0 N--CA 1.435 -1.374 0 N-CA-C 107.849 -2.101 . . . . 0.0 107.849 -175.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -159.01 -155.68 7.73 Favored Glycine 0 N--CA 1.434 -1.485 0 C-N-CA 120.138 -1.03 . . . . 0.0 113.145 -176.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -116.47 131.23 57.0 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 113.541 -1.329 . . . . 0.0 110.032 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.64 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 48.1 m95 -79.9 154.21 28.49 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.407 0.622 . . . . 0.0 110.609 -175.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -136.53 173.96 5.0 Favored Pre-proline 0 C--N 1.306 -1.284 0 N-CA-C 103.806 -2.665 . . . . 0.0 103.806 173.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.63 128.9 32.3 Favored 'Trans proline' 0 C--N 1.346 0.436 0 CA-C-N 121.522 1.579 . . . . 0.0 109.47 173.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . 0.494 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -71.51 37.58 0.06 Allowed 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.849 1.426 . . . . 0.0 114.849 -175.111 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 85.18 -57.45 0.09 Allowed 'General case' 0 CA--C 1.474 -1.948 0 C-N-CA 125.274 1.43 . . . . 0.0 107.981 174.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -119.04 101.56 8.11 Favored 'General case' 0 N--CA 1.401 -2.903 0 N-CA-C 104.393 -2.447 . . . . 0.0 104.393 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.2 m -64.05 -57.76 8.7 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.085 0.241 . . . . 0.0 111.545 -172.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -98.35 126.3 43.82 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 954' ' ' THR . . . . . 0.434 ' HG1' ' ND2' ' A' ' 937' ' ' ASN . 37.5 p -149.66 -178.23 6.33 Favored 'General case' 0 C--O 1.246 0.896 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -172.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -105.33 -177.15 3.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 175.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.16 -31.63 32.29 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.27 -41.46 20.15 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 129.5 -2.07 6.09 Favored Glycine 0 CA--C 1.498 -0.974 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.887 177.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.43 104.36 0.62 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 114.626 -0.787 . . . . 0.0 109.181 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . 0.404 ' HD3' ' N ' ' A' ' 961' ' ' ALA . 9.3 tmtt? -48.87 120.14 3.66 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.404 ' N ' ' HD3' ' A' ' 960' ' ' LYS . . . -125.39 -172.45 2.59 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.653 -175.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . 0.448 ' CB ' ' HG ' ' A' ' 967' ' ' LEU . . . -62.16 140.89 58.41 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 121.902 0.858 . . . . 0.0 111.35 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 963' ' ' SER . . . . . 0.479 ' O ' ' HB2' ' A' ' 967' ' ' LEU . 15.0 m -102.47 162.64 19.61 Favored Pre-proline 0 N--CA 1.43 -1.466 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -176.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.592 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.2 Cg_endo -51.23 -37.95 60.35 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.733 2.289 . . . . 0.0 114.249 -177.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 25.5 p -79.91 -47.46 15.02 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 121.906 -0.496 . . . . 0.0 111.03 175.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . 0.404 ' HB2' ' H ' ' A' ' 963' ' ' SER . 45.2 mt-10 -65.65 -8.23 19.39 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.479 ' HB2' ' O ' ' A' ' 963' ' ' SER . 1.0 OUTLIER -102.02 112.49 25.15 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 -175.322 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.91 155.5 18.88 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.089 -176.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.5 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 16.0 p -76.85 126.95 85.07 Favored Pre-proline 0 C--N 1.313 -1.005 0 C-N-CA 120.169 -0.613 . . . . 0.0 109.49 174.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.582 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 52.6 Cg_endo -80.27 166.14 20.64 Favored 'Trans proline' 0 C--O 1.238 0.479 0 C-N-CA 122.886 2.39 . . . . 0.0 111.363 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.82 102.8 0.21 Allowed 'Trans proline' 0 C--O 1.24 0.585 0 C-N-CA 121.84 1.694 . . . . 0.0 110.266 173.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.659 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 121.63 3.47 10.18 Favored Glycine 0 N--CA 1.429 -1.8 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.383 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.582 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 93.5 m95 -138.57 137.62 37.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.96 0.886 . . . . 0.0 112.177 177.094 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.625 ' HB3' ' O ' ' A' 1028 ' ' LYS . 3.5 tp10 -122.0 137.2 54.89 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.163 -1.38 . . . . 0.0 108.262 -175.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.607 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 80.9 m95 -81.07 100.41 9.0 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 120.996 -1.065 . . . . 0.0 110.48 175.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . 0.44 ' HB3' ' HB3' ' A' 1028 ' ' LYS . 8.4 pt-20 -75.9 -31.54 59.24 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 177.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -78.07 146.43 35.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.387 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.59 -46.38 66.45 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -166.75 156.41 11.22 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.437 0.637 . . . . 0.0 111.596 -173.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.635 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 37.7 m95 -70.75 119.63 15.18 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.422 -0.808 . . . . 0.0 108.822 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 19.6 m -125.35 148.51 48.72 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -175.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' A' 1022 ' ' ARG . 7.2 p90 -73.68 135.85 43.75 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 119.251 0.932 . . . . 0.0 110.284 -175.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.573 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 12.5 t70 -88.21 126.34 35.1 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 114.423 -1.262 . . . . 0.0 111.048 -172.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.459 ' HA ' HG23 ' A' ' 988' ' ' VAL . 2.3 pp -121.01 16.19 6.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.471 -179.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . 0.501 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 16.7 t-20 -90.36 16.89 7.94 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.848 -177.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.573 ' HD3' ' OD2' ' A' ' 983' ' ' ASP . 5.0 mpt_? -141.47 -175.86 4.52 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -175.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -73.85 84.21 1.68 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.286 0.565 . . . . 0.0 110.812 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.476 HG12 ' HG2' ' A' ' 994' ' ' GLU . 17.9 m -141.13 -171.89 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -104.0 -172.7 2.15 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -58.36 -35.44 71.95 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.734 0.778 . . . . 0.0 111.829 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -106.75 9.1 31.19 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.363 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.72 -121.55 7.2 Favored Glycine 0 C--O 1.205 -1.701 0 N-CA-C 105.691 -2.964 . . . . 0.0 105.691 -174.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.452 ' H ' ' HB3' ' A' 1021 ' ' ARG . 42.9 m95 52.72 99.4 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 173.075 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.476 ' HG2' HG12 ' A' ' 988' ' ' VAL . 26.2 mt-10 -98.6 148.95 23.28 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.69 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.7 ' HD2' ' HE2' ' A' 1016 ' ' HIS . 19.9 t80 -65.79 96.65 0.3 Allowed 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 127.059 2.144 . . . . 0.0 111.098 177.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -118.93 102.89 0.96 Allowed Glycine 0 N--CA 1.444 -0.825 0 C-N-CA 119.255 -1.45 . . . . 0.0 111.975 174.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.447 HG22 ' HD2' ' A' 1016 ' ' HIS . 0.1 OUTLIER -108.71 143.24 19.37 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 O-C-N 119.951 -1.911 . . . . 0.0 107.563 178.447 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 998' ' ' THR . . . . . 0.593 ' HG1' ' HG3' ' A' 1005 ' ' PRO . 7.9 m -138.92 127.97 23.84 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.4 HD12 ' N ' ' A' ' 999' ' ' ILE . 3.7 mp -100.37 97.95 7.17 Favored Pre-proline 0 C--N 1.313 -0.99 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.26 140.85 38.02 Favored 'Trans proline' 0 C--O 1.238 0.478 0 C-N-CA 122.607 2.204 . . . . 0.0 114.071 -173.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -80.89 155.98 84.18 Favored 'Cis proline' 0 CA--C 1.512 -0.575 0 C-N-CA 123.177 -1.593 . . . . 0.0 110.857 -2.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1002 ' ' ASP . . . . . 0.433 ' CG ' ' H ' ' A' 1003 ' ' HIS . 21.1 t70 -159.18 -133.84 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.336 -174.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1003 ' ' HIS . . . . . 0.433 ' H ' ' CG ' ' A' 1002 ' ' ASP . 5.8 p-80 -158.37 -45.09 0.06 Allowed 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 122.999 0.52 . . . . 0.0 111.25 -174.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 61.1 tttt -167.26 145.67 4.18 Favored Pre-proline 0 N--CA 1.448 -0.543 0 C-N-CA 119.651 -0.819 . . . . 0.0 108.793 -173.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1005 ' ' PRO . . . . . 0.593 ' HG3' ' HG1' ' A' ' 998' ' ' THR . 52.1 Cg_exo -64.55 124.61 13.53 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 121.058 1.172 . . . . 0.0 109.724 167.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1006 ' ' LYS . . . . . 0.434 ' HG3' ' H ' ' A' 1007 ' ' SER . 57.8 pttt -70.64 -59.42 2.84 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1007 ' ' SER . . . . . 0.434 ' H ' ' HG3' ' A' 1006 ' ' LYS . 34.3 t -97.38 150.59 20.83 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 120.594 0.235 . . . . 0.0 111.179 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.481 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 53.0 m95 -137.37 145.55 43.43 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 125.113 1.508 . . . . 0.0 107.454 175.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.472 ' N ' ' HB3' ' A' ' 995' ' ' TYR . 10.8 m -161.92 -155.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 -177.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -103.14 -36.34 8.16 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 119.553 1.07 . . . . 0.0 113.104 -174.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -61.22 108.88 0.98 Allowed 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -168.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.464 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 4.9 tp10 -66.58 118.04 9.61 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 172.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' 1016 ' ' HIS . 83.1 mttt -122.18 155.92 34.8 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.747 -174.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1014 ' ' MET . . . . . 0.441 ' C ' ' H ' ' A' 1016 ' ' HIS . 23.7 ttt -55.88 -47.66 76.97 Favored 'General case' 0 CA--C 1.503 -0.864 0 O-C-N 123.951 0.782 . . . . 0.0 111.593 178.019 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1015 ' ' TYR . . . . . 0.495 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 31.6 p90 -75.09 28.07 0.09 Allowed 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.083 -0.647 . . . . 0.0 112.66 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.7 ' HE2' ' HD2' ' A' ' 995' ' ' TYR . 9.0 m170 -82.54 116.81 22.13 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 121.731 -0.606 . . . . 0.0 110.61 173.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 4.4 m -93.2 -28.99 15.94 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 123.088 1.423 . . . . 0.0 107.561 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 31.2 m80 -139.19 156.83 46.83 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 113.383 -1.735 . . . . 0.0 110.68 -176.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -156.37 150.74 25.53 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 105.75 -1.945 . . . . 0.0 105.75 169.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.468 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.9 ptp180 -149.99 163.65 37.56 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 118.267 -1.373 . . . . 0.0 110.86 176.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.479 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 21.9 ptt180 -143.36 142.3 31.23 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.911 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.626 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 33.0 ttm180 -82.3 129.19 34.8 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.112 -178.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.635 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 97.0 mt -102.16 133.65 46.68 Favored 'General case' 0 N--CA 1.427 -1.609 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 166.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 13.8 m -111.11 138.99 37.09 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.009 -176.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.474 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 13.8 tpt180 -138.56 110.28 7.12 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.543 170.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.507 ' HE2' ' HG2' ' A' ' 929' ' ' GLU . 2.2 tmtp? -69.63 147.02 51.21 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.607 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 9.8 ptm180 -140.71 129.49 23.04 Favored 'General case' 0 C--O 1.201 -1.496 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -177.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.625 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 36.0 ttmt -121.55 135.5 55.01 Favored 'General case' 0 C--N 1.275 -2.661 0 CA-C-N 115.373 -0.831 . . . . 0.0 108.849 -174.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.659 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 35.5 ttmt -84.59 -23.54 29.57 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 123.709 1.719 . . . . 0.0 107.058 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1030 ' ' ASP . . . . . 0.541 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 16.7 t70 61.77 -5.24 0.15 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 110.811 -2.904 . . . . 0.0 111.62 -169.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1031 ' ' LEU . . . . . 0.604 ' H ' ' C ' ' A' 1029 ' ' LYS . 36.7 tp 74.56 -34.33 0.27 Allowed 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 127.67 2.388 . . . . 0.0 111.892 -177.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 8.1 t -68.27 -15.46 63.58 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -175.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.471 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 93.4 mt-30 . . . . . 0 C--N 1.333 -0.148 0 C-N-CA 120.429 -0.509 . . . . 0.0 110.764 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . 0.458 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 46.1 m-70 . . . . . 0 N--CA 1.421 -1.913 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.09 115.73 0.97 Allowed 'General case' 0 N--CA 1.413 -2.314 0 N-CA-C 101.495 -3.52 . . . . 0.0 101.495 172.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -142.22 132.08 24.32 Favored 'General case' 0 C--N 1.274 -2.686 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 177.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -128.69 140.43 51.75 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -177.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.604 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 38.7 m -70.64 126.72 30.4 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -96.35 166.36 11.75 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -161.07 149.31 15.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-O 121.204 0.526 . . . . 0.0 110.719 -172.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.558 ' O ' ' HA ' ' A' 1022 ' ' ARG . 14.8 p -145.33 175.07 2.69 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 176.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.594 ' CD2' ' HD3' ' A' 1020 ' ' ARG . 75.8 m-85 -135.62 151.47 50.28 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.49 ' O ' ' HA ' ' A' 1020 ' ' ARG . 13.0 tt0 -123.2 118.09 26.84 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 178.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -106.82 141.11 38.58 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.831 0.824 . . . . 0.0 111.121 -174.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.595 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 67.5 mt-10 -136.65 157.66 46.25 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 175.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 40.7 t -144.69 141.63 29.45 Favored 'General case' 0 N--CA 1.426 -1.632 0 CA-C-O 121.073 0.463 . . . . 0.0 109.997 -178.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.541 HH21 ' HB2' ' A' 1016 ' ' HIS . 21.6 ptt180 -139.03 159.61 41.73 Favored 'General case' 0 N--CA 1.435 -1.203 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 177.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -71.89 161.42 78.84 Favored Pre-proline 0 C--N 1.303 -1.452 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 170.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . 0.547 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 31.4 Cg_exo -61.84 86.16 0.1 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 121.374 1.383 . . . . 0.0 111.031 175.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 103.15 70.18 0.83 Allowed Glycine 0 N--CA 1.434 -1.484 0 N-CA-C 107.716 -2.154 . . . . 0.0 107.716 -173.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.62 -140.57 2.9 Favored Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 120.35 -0.929 . . . . 0.0 113.647 -175.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -127.97 122.62 32.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.702 -0.749 . . . . 0.0 111.532 -173.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.595 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 74.6 m95 -70.47 135.59 48.77 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -142.88 178.78 1.36 Allowed Pre-proline 0 C--N 1.302 -1.482 0 N-CA-C 103.073 -2.936 . . . . 0.0 103.073 -179.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.05 124.29 15.91 Favored 'Trans proline' 0 C--O 1.238 0.501 0 CA-C-N 122.735 2.012 . . . . 0.0 111.423 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -49.23 -49.99 40.52 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.626 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 173.88 -38.7 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -122.5 116.07 23.3 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 174.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 6.6 m -63.64 -59.51 4.51 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -174.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . 0.436 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 91.7 m-85 -110.03 135.3 51.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.788 0.328 . . . . 0.0 110.425 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 954' ' ' THR . . . . . 0.441 ' HA ' ' HA ' ' A' ' 960' ' ' LYS . 58.5 p -142.74 179.91 6.72 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.55 0.691 . . . . 0.0 110.183 -171.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -98.21 174.36 6.55 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 104.911 -2.255 . . . . 0.0 104.911 172.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.54 -34.96 52.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 118.587 0.631 . . . . 0.0 110.952 174.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -86.36 -0.54 56.13 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 96.6 -10.12 66.69 Favored Glycine 0 CA--C 1.501 -0.782 0 C-N-CA 119.739 -1.219 . . . . 0.0 113.308 177.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -51.64 99.2 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 954' ' ' THR . 0.2 OUTLIER -60.36 137.9 58.06 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -177.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -134.24 -178.98 5.29 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.397 -175.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . 0.507 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -70.72 153.06 43.15 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 172.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 3.7 m -76.32 158.51 81.53 Favored Pre-proline 0 C--N 1.313 -1.017 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -178.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.584 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 53.9 Cg_exo -44.94 -31.73 5.68 Favored 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 124.263 3.308 . . . . 0.0 116.317 -178.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.8 t -71.61 -45.54 61.83 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . 0.507 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 35.2 mt-10 -65.19 -25.88 67.9 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.373 175.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.535 HD12 ' HA ' ' A' ' 964' ' ' PRO . 57.4 mt -71.43 112.05 7.24 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.702 0.763 . . . . 0.0 110.208 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 20.6 p -118.77 169.99 9.38 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.881 -172.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 20.3 p -83.91 129.21 59.9 Favored Pre-proline 0 N--CA 1.443 -0.781 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.646 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.566 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 53.5 Cg_endo -82.59 163.28 16.64 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.931 2.421 . . . . 0.0 110.642 177.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -59.61 104.82 0.23 Allowed 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.02 1.813 . . . . 0.0 110.657 174.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.501 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 121.19 -1.67 11.57 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.066 -177.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.566 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.4 m95 -136.81 141.57 42.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 117.256 0.528 . . . . 0.0 111.167 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.975 ' HB3' HE22 ' A' 1033 ' ' GLN . 2.9 pt-20 -117.94 148.37 42.25 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -177.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.532 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 85.5 m95 -84.64 98.36 10.15 Favored 'General case' 0 C--N 1.296 -1.732 0 C-N-CA 119.169 -1.013 . . . . 0.0 110.327 167.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . 0.4 ' HG2' ' HE3' ' A' 1026 ' ' LYS . 8.9 tp10 -67.83 -41.19 83.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.06 -1.427 . . . . 0.0 108.21 176.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . 0.546 ' HB3' ' NE ' ' A' 1025 ' ' ARG . 64.9 m-20 -84.1 158.68 21.32 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.842 -177.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -75.53 -63.79 1.21 Allowed 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 -175.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -154.21 144.38 22.02 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -171.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.584 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 6.8 m95 -68.4 130.06 41.76 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -173.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 981' ' ' SER . . . . . 0.504 ' O ' ' HA ' ' A' 1023 ' ' LEU . 22.9 t -136.18 -175.12 3.88 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . 0.529 ' CD2' ' HA ' ' A' ' 991' ' ' LYS . 0.1 OUTLIER -77.05 151.82 35.35 Favored 'General case' 0 C--N 1.295 -1.791 0 CA-C-N 118.986 0.812 . . . . 0.0 112.179 -175.394 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.504 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 54.0 t0 -91.0 125.5 35.82 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 172.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.3 pp -119.06 6.76 6.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . 0.538 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 67.1 t30 -93.63 18.36 10.21 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.801 0.81 . . . . 0.0 110.767 -172.066 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.538 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 5.7 mpt_? -139.86 -176.35 4.55 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -177.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -75.29 75.55 2.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.991 0.9 . . . . 0.0 110.302 176.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.543 HG11 ' HG2' ' A' ' 994' ' ' GLU . 9.7 m -143.92 152.81 15.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.169 -1.378 . . . . 0.0 108.531 -177.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -55.8 170.52 0.28 Allowed 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 123.64 0.776 . . . . 0.0 111.966 177.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -57.5 -33.39 67.98 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 121.374 0.607 . . . . 0.0 111.074 174.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . 0.552 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 81.6 mttt -96.38 6.79 48.02 Favored 'General case' 0 N--CA 1.428 -1.546 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.931 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 93.62 -14.2 65.83 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.058 175.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.552 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 74.2 m95 -50.84 135.34 24.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.199 1.0 . . . . 0.0 113.262 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.543 ' HG2' HG11 ' A' ' 988' ' ' VAL . 41.7 mt-10 -114.61 148.75 37.64 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.407 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.753 ' O ' ' HA ' ' A' 1008 ' ' TRP . 3.9 t80 -81.37 100.9 9.49 Favored 'General case' 0 C--O 1.199 -1.561 0 CA-C-N 112.985 -1.916 . . . . 0.0 108.966 -177.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -123.29 101.64 0.71 Allowed Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 119.125 -1.512 . . . . 0.0 111.895 173.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.562 HG21 ' CD2' ' A' 1016 ' ' HIS . 0.7 OUTLIER -102.57 151.04 6.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 O-C-N 120.864 -1.374 . . . . 0.0 107.741 179.65 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 15.8 m -127.91 102.77 6.91 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 15.8 pt -86.89 112.5 47.67 Favored Pre-proline 0 C--N 1.319 -0.721 0 C-N-CA 120.08 -0.648 . . . . 0.0 110.935 174.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -70.55 147.04 56.89 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.72 2.28 . . . . 0.0 112.975 -176.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -83.6 136.04 26.13 Favored 'Cis proline' 0 N--CA 1.451 -0.999 0 C-N-CA 122.931 -1.695 . . . . 0.0 112.993 -0.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 39.3 t0 167.23 154.98 0.03 OUTLIER 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 111.524 -2.58 . . . . 0.0 105.359 -176.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -119.11 -40.9 2.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 118.704 -1.199 . . . . 0.0 112.346 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 70.2 mttt -104.29 132.15 21.24 Favored Pre-proline 0 C--N 1.31 -1.143 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -176.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1005 ' ' PRO . . . . . 0.425 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 74.5 Cg_exo -56.05 125.32 18.71 Favored 'Trans proline' 0 CA--C 1.515 -0.427 0 C-N-CA 123.117 2.545 . . . . 0.0 111.019 170.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -94.43 -48.07 6.29 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 35.4 t -85.15 134.72 34.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.44 -1.255 . . . . 0.0 111.093 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.753 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 54.4 m95 -131.54 136.41 47.83 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 124.457 1.098 . . . . 0.0 108.48 176.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.761 HG12 ' H ' ' A' 1010 ' ' ALA . 11.2 t -147.32 -164.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 103.664 -2.717 . . . . 0.0 103.664 -176.245 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1010 ' ' ALA . . . . . 0.761 ' H ' HG12 ' A' 1009 ' ' VAL . . . -114.98 12.16 16.69 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 120.381 1.446 . . . . 0.0 111.755 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -88.08 -166.36 1.57 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -177.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.449 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 8.5 tp10 -158.74 105.96 1.84 Allowed 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -175.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.58 ' O ' ' HB2' ' A' 1016 ' ' HIS . 56.5 mtpt -111.69 151.44 28.88 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 177.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1014 ' ' MET . . . . . 0.433 ' C ' ' H ' ' A' 1016 ' ' HIS . 50.8 ttp -53.24 -37.54 62.17 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 123.881 0.738 . . . . 0.0 111.013 175.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1015 ' ' TYR . . . . . 0.547 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 97.8 m-85 -69.2 16.08 0.06 Allowed 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 177.009 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.58 ' HB2' ' O ' ' A' 1013 ' ' LYS . 0.2 OUTLIER -79.54 115.91 19.44 Favored 'General case' 0 CA--C 1.499 -1.019 0 O-C-N 121.906 -0.496 . . . . 0.0 110.981 176.309 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 1017 ' ' THR . . . . . 0.439 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 10.9 p -95.95 -27.03 15.35 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.701 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -139.15 153.82 48.0 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.693 -1.139 . . . . 0.0 111.648 -175.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -156.73 151.26 25.55 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 170.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.594 ' HD3' ' CD2' ' A' ' 935' ' ' TYR . 2.7 ptp180 -149.4 165.21 32.76 Favored 'General case' 0 C--O 1.193 -1.871 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 175.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.593 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.3 ptt180 -145.06 148.03 33.23 Favored 'General case' 0 C--N 1.285 -2.229 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.699 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.558 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 41.2 ttm180 -89.4 122.52 32.69 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.504 ' HA ' ' O ' ' A' ' 981' ' ' SER . 78.0 mt -98.27 125.68 43.46 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 103.706 -2.701 . . . . 0.0 103.706 168.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.492 HG12 ' HB2' ' A' ' 983' ' ' ASP . 2.5 m -106.5 151.16 8.57 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.069 -173.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.764 ' NE ' ' HA ' ' A' 1025 ' ' ARG . 0.5 OUTLIER -159.09 110.08 2.05 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 125.427 1.705 . . . . 0.0 112.614 169.421 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.604 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 3.2 tmmm? -78.21 146.86 34.72 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.398 0.618 . . . . 0.0 109.409 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.532 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 6.0 ptm180 -135.75 146.96 48.21 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 -171.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' A' ' 974' ' ' GLU . 34.3 ttmt -129.94 136.27 49.28 Favored 'General case' 0 C--O 1.193 -1.873 0 O-C-N 123.429 0.456 . . . . 0.0 110.573 -172.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 38.7 ttmt -85.82 -22.3 27.69 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 123.466 1.603 . . . . 0.0 107.668 -176.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 9.3 t70 56.98 12.17 1.15 Allowed 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 111.431 -2.622 . . . . 0.0 110.044 -171.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1031 ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 927' ' ' HIS . 22.6 tp 69.24 -52.1 0.6 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.635 1.974 . . . . 0.0 111.659 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 10.3 t -69.44 -10.08 56.43 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -173.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.975 HE22 ' HB3' ' A' ' 974' ' ' GLU . 76.2 mt-30 . . . . . 0 C--N 1.329 -0.317 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.255 177.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 . . . . . 0 CA--C 1.491 -1.322 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 928' ' ' THR . . . . . 0.438 ' HB ' ' HB3' ' A' 1029 ' ' LYS . 1.5 m 63.39 90.97 0.08 Allowed 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.799 -169.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 929' ' ' GLU . 0.5 OUTLIER -135.95 129.11 31.67 Favored 'General case' 0 N--CA 1.42 -1.94 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 173.158 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . 0.433 ' O ' ' HG2' ' A' 1027 ' ' ARG . 70.8 t80 -122.62 139.86 53.46 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -178.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 9.0 m -76.01 121.14 22.31 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -99.54 157.38 16.49 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 -175.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.646 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 0.0 OUTLIER -159.06 156.29 28.97 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 119.433 1.015 . . . . 0.0 111.668 -175.489 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.46 HG12 HD12 ' A' ' 967' ' ' LEU . 20.3 m -145.99 142.71 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 174.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.474 ' CG ' ' HD3' ' A' 1020 ' ' ARG . 98.5 m-85 -101.15 113.67 26.92 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 120.861 -1.149 . . . . 0.0 111.516 178.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.538 ' HB3' ' CE2' ' A' ' 953' ' ' TYR . 3.8 pt20 -81.41 137.01 35.72 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 171.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . 0.862 ' HB3' ' HB3' ' A' 1020 ' ' ARG . 0.0 OUTLIER -140.56 163.23 33.41 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -175.2 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.63 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 43.2 mt-10 -136.67 161.35 36.17 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 113.334 -1.757 . . . . 0.0 107.422 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 19.6 m -138.46 147.61 43.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 120.7 0.286 . . . . 0.0 111.143 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.527 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 16.2 ptt180 -156.07 162.47 40.28 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 123.59 0.756 . . . . 0.0 109.756 -173.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -60.33 162.43 10.86 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 171.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -67.96 78.37 0.57 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.071 1.848 . . . . 0.0 112.32 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 105.28 74.31 0.94 Allowed Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 108.533 -1.827 . . . . 0.0 108.533 -175.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -165.41 -150.1 6.11 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.236 -176.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -101.28 130.02 47.35 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.991 -0.604 . . . . 0.0 110.07 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.63 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 45.6 m95 -82.79 139.67 33.42 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 177.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -117.52 163.79 22.28 Favored Pre-proline 0 C--N 1.292 -1.932 0 N-CA-C 101.279 -3.6 . . . . 0.0 101.279 171.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.22 149.02 47.07 Favored 'Trans proline' 0 C--O 1.238 0.49 0 CA-C-N 121.456 1.556 . . . . 0.0 110.353 175.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.14 -171.07 0.1 Allowed 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.161 0.505 . . . . 0.0 110.787 177.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.26 -38.61 30.58 Favored 'General case' 0 CA--C 1.476 -1.885 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -117.94 99.01 6.63 Favored 'General case' 0 N--CA 1.397 -3.085 0 N-CA-C 103.804 -2.665 . . . . 0.0 103.804 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 27.3 m -61.5 -50.35 73.09 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 123.342 0.401 . . . . 0.0 111.365 -172.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . 0.538 ' CE2' ' HB3' ' A' ' 936' ' ' GLN . 81.4 m-85 -101.83 132.44 47.59 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 18.4 p -142.73 177.22 8.47 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 123.393 0.677 . . . . 0.0 110.835 -171.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -104.97 171.17 7.46 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 171.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.88 -37.44 52.25 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 118.971 0.805 . . . . 0.0 110.159 174.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -73.23 -10.19 59.51 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 95.07 -7.79 69.78 Favored Glycine 0 CA--C 1.5 -0.872 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.15 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -58.7 105.76 0.34 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -47.01 124.0 5.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.54 178.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -115.76 168.54 9.95 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.903 -176.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -71.6 157.0 38.75 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.882 177.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.1 m -89.08 149.9 44.1 Favored Pre-proline 0 N--CA 1.435 -1.192 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.56 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 2.8 Cg_exo -43.57 -38.51 9.0 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 125.001 3.801 . . . . 0.0 116.925 -176.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 28.4 m -74.3 -41.8 60.59 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 122.143 0.973 . . . . 0.0 109.391 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -64.57 -28.77 69.86 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.041 -1.436 . . . . 0.0 110.565 173.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.472 HD11 ' CH2' ' A' ' 980' ' ' TRP . 39.6 mt -74.08 120.17 19.29 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 121.776 0.798 . . . . 0.0 110.616 178.22 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 22.0 p -124.38 169.09 12.17 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.042 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 16.9 p -90.44 138.96 26.66 Favored Pre-proline 0 C--N 1.312 -1.054 0 C-N-CA 120.459 -0.496 . . . . 0.0 109.906 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.57 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 92.8 Cg_endo -79.2 172.38 14.81 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.912 2.408 . . . . 0.0 111.066 173.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_exo -45.88 -43.52 19.45 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 123.211 2.607 . . . . 0.0 114.329 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.949 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . -102.76 22.79 35.95 Favored Glycine 0 N--CA 1.434 -1.438 0 C-N-CA 121.478 -0.391 . . . . 0.0 113.614 -175.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.57 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 78.1 m95 -135.42 138.11 42.93 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 117.946 0.873 . . . . 0.0 110.743 172.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.597 ' HB3' ' O ' ' A' 1028 ' ' LYS . 7.3 tp10 -118.85 131.02 56.06 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 125.671 1.588 . . . . 0.0 108.315 -175.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.436 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 82.5 m95 -77.07 98.75 5.11 Favored 'General case' 0 C--N 1.306 -1.288 0 O-C-N 120.92 -1.113 . . . . 0.0 110.129 173.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -69.72 -35.15 74.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 177.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . 0.758 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 1.5 m-20 -87.22 151.43 23.17 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.383 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.65 -65.08 0.75 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -170.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -153.81 146.39 24.13 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -171.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.56 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 19.7 m95 -60.62 125.64 24.47 Favored 'General case' 0 CA--C 1.502 -0.903 0 O-C-N 124.325 1.016 . . . . 0.0 109.834 -169.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 981' ' ' SER . . . . . 0.653 ' O ' ' HA ' ' A' 1023 ' ' LEU . 18.0 m -111.95 -171.74 1.9 Allowed 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 -175.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -107.26 149.36 27.85 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 119.804 1.184 . . . . 0.0 109.224 175.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.522 ' O ' HG23 ' A' ' 988' ' ' VAL . 52.4 t0 -86.59 119.72 27.13 Favored 'General case' 0 C--N 1.317 -0.815 0 O-C-N 123.206 0.316 . . . . 0.0 110.216 -175.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 24.2 pt -120.11 13.33 6.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 122.227 1.013 . . . . 0.0 108.97 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.59 18.86 6.87 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.845 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -137.22 -176.24 4.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.401 -178.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.83 81.17 8.66 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 172.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 983' ' ' ASP . 16.5 m -134.66 162.67 38.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 114.429 -1.259 . . . . 0.0 109.555 -176.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -54.7 170.27 0.17 Allowed 'General case' 0 C--O 1.239 0.551 0 O-C-N 123.976 0.798 . . . . 0.0 110.026 170.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . 0.502 ' HB2' ' HZ1' ' A' ' 991' ' ' LYS . 48.3 mt-10 -53.04 -34.51 56.77 Favored 'General case' 0 CA--C 1.5 -0.973 0 CA-C-O 121.993 0.902 . . . . 0.0 110.538 178.185 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . 0.502 ' HZ1' ' HB2' ' A' ' 990' ' ' GLU . 26.3 mttp -103.63 11.83 35.61 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.401 -1.272 . . . . 0.0 111.607 -174.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 90.73 -13.87 64.59 Favored Glycine 0 C--N 1.331 0.285 0 CA-C-N 116.739 -0.21 . . . . 0.0 113.483 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.627 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 97.7 m95 -51.9 146.78 7.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.566 0.698 . . . . 0.0 112.47 176.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -135.68 150.46 49.59 Favored 'General case' 0 C--O 1.252 1.198 0 CA-C-O 122.24 1.019 . . . . 0.0 112.216 -177.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.826 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 50.5 t80 -80.87 93.2 6.23 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 111.792 -2.458 . . . . 0.0 112.208 -172.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . 0.606 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -118.31 93.72 0.58 Allowed Glycine 0 CA--C 1.49 -1.478 0 C-N-CA 119.44 -1.362 . . . . 0.0 111.243 177.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.529 HG23 ' HA ' ' A' 1016 ' ' HIS . 12.0 pt -103.83 148.59 8.51 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.883 0 C-N-CA 118.204 -1.399 . . . . 0.0 108.556 -178.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 11.6 t -138.72 132.21 30.4 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.355 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.3 mp -114.45 114.47 45.12 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1000 ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 31.6 Cg_exo -61.03 136.34 64.74 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 123.068 2.512 . . . . 0.0 113.113 -178.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1001 ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 9.4 Cg_endo -85.23 138.42 25.69 Favored 'Cis proline' 0 N--CA 1.449 -1.11 0 C-N-CA 122.774 -1.761 . . . . 0.0 113.898 1.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 7.9 t0 162.02 126.52 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 111.271 -2.695 . . . . 0.0 104.624 -179.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -85.19 -43.04 14.16 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.739 -168.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 84.7 mttt -127.14 141.34 40.42 Favored Pre-proline 0 C--N 1.309 -1.157 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.347 -174.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -50.26 127.88 21.24 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.617 2.211 . . . . 0.0 110.614 169.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 21.2 pttm -110.62 15.52 21.98 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.012 -0.995 . . . . 0.0 108.484 -177.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 42.6 t -146.95 137.13 23.46 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.448 -175.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.699 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 59.7 m95 -137.62 135.89 36.99 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 125.367 1.667 . . . . 0.0 107.085 175.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 96.5 t -144.95 165.74 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 -171.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -82.99 -2.16 54.47 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -175.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -112.23 122.09 46.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 119.018 0.826 . . . . 0.0 112.538 -174.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.43 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 52.0 tp10 -72.13 120.58 17.93 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 174.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.525 ' H ' ' CE1' ' A' 1016 ' ' HIS . 94.5 mttt -124.66 155.79 38.6 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.004 -178.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 52.3 ttp -53.12 -40.08 63.92 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 123.863 0.727 . . . . 0.0 112.554 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -52.49 -7.98 0.08 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.568 1.321 . . . . 0.0 114.568 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.826 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 13.5 m80 -57.85 154.8 11.46 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 122.53 1.157 . . . . 0.0 112.993 179.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -161.55 -33.41 0.05 OUTLIER 'General case' 0 C--N 1.294 -1.827 0 CA-C-N 111.295 -2.684 . . . . 0.0 106.599 -167.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 14.2 m80 -135.21 141.49 45.83 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.697 -1.592 . . . . 0.0 108.601 174.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.627 ' HG2' ' CE3' ' A' ' 993' ' ' TRP . 43.3 ttt180 -152.47 142.49 22.22 Favored 'General case' 0 CA--C 1.483 -1.598 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.862 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . 2.5 ptp180 -150.57 167.89 25.89 Favored 'General case' 0 C--N 1.294 -1.822 0 O-C-N 124.074 0.859 . . . . 0.0 109.626 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.525 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 26.5 ptt180 -148.62 151.47 35.05 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.646 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 32.5 ttm180 -90.21 129.45 36.47 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.261 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.653 ' HA ' ' O ' ' A' ' 981' ' ' SER . 84.8 mt -94.46 125.87 39.38 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 167.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.485 HG13 ' HB2' ' A' ' 983' ' ' ASP . 2.5 m -105.46 136.62 38.76 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.803 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.366 -174.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.758 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -144.24 109.75 5.2 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 124.641 1.213 . . . . 0.0 111.726 168.639 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.658 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -78.73 141.98 37.43 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -178.703 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.501 ' N ' ' HD2' ' A' 1026 ' ' LYS . 12.1 ptm180 -135.78 143.19 45.1 Favored 'General case' 0 C--O 1.201 -1.452 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -171.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.597 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.7 ttmt -125.9 138.53 53.79 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 123.606 0.566 . . . . 0.0 109.65 -175.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.66 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.7 ttmt -89.33 -22.3 22.7 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 123.285 1.517 . . . . 0.0 108.124 -178.132 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 21.6 t70 55.45 21.08 4.06 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 111.098 -2.774 . . . . 0.0 109.331 -169.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 42.8 tp 57.53 -41.54 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.849 2.059 . . . . 0.0 115.227 -174.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 9.4 t -69.15 -23.6 63.98 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 122.953 0.501 . . . . 0.0 112.32 -170.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.949 ' HB3' ' HA2' ' A' ' 972' ' ' GLY . 3.8 mt-30 . . . . . 0 C--N 1.322 -0.596 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -175.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 31.0 m-70 . . . . . 0 CA--C 1.493 -1.249 0 N-CA-C 105.37 -2.085 . . . . 0.0 105.37 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 928' ' ' THR . . . . . 0.611 ' HB ' ' HB2' ' A' 1029 ' ' LYS . 1.0 OUTLIER -143.72 120.01 10.89 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 102.132 -3.285 . . . . 0.0 102.132 168.442 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.506 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.0 OUTLIER -142.16 168.36 19.92 Favored 'General case' 0 C--N 1.272 -2.783 0 C-N-CA 118.865 -1.134 . . . . 0.0 110.797 -178.375 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . 0.627 ' O ' ' HG2' ' A' 1027 ' ' ARG . 54.7 t80 -157.19 124.7 5.31 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.589 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 17.8 m -75.42 126.85 31.84 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 118.897 0.771 . . . . 0.0 109.617 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -104.72 159.18 15.99 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 -177.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.473 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -153.42 145.01 23.31 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -174.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 12.0 p -139.5 172.89 12.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 105.365 -2.087 . . . . 0.0 105.365 178.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.553 ' HA ' ' O ' ' A' 1021 ' ' ARG . 54.8 m-85 -132.52 138.88 47.67 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 118.7 0.682 . . . . 0.0 110.248 -174.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.619 ' O ' ' HA ' ' A' 1020 ' ' ARG . 24.3 tt0 -113.77 126.21 54.97 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -176.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . 0.517 ' HA ' ' O ' ' A' 1019 ' ' ARG . 0.0 OUTLIER -124.25 141.31 52.17 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 122.127 0.965 . . . . 0.0 113.432 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.53 ' HG2' ' HA ' ' A' ' 948' ' ' PRO . 35.8 mt-10 -115.31 158.5 22.3 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 104.972 -2.232 . . . . 0.0 104.972 171.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 36.8 m -139.62 152.58 46.9 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 119.007 0.821 . . . . 0.0 109.846 -172.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.677 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 24.6 ptt180 -156.99 160.95 39.53 Favored 'General case' 0 N--CA 1.44 -0.953 0 O-C-N 124.548 1.155 . . . . 0.0 109.499 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -78.55 161.26 70.29 Favored Pre-proline 0 C--N 1.312 -1.038 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 170.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -63.36 87.09 0.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 121.374 1.383 . . . . 0.0 111.273 172.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.22 1.93 5.17 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -176.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . 0.59 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -100.21 -178.68 30.19 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 109.88 -1.288 . . . . 0.0 109.88 177.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -108.38 163.1 13.5 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 171.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.677 ' CZ3' ' HG2' ' A' ' 940' ' ' ARG . 53.5 m95 -83.87 137.61 33.59 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 117.901 0.318 . . . . 0.0 110.756 -173.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -129.78 139.1 34.66 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 170.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.53 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 6.8 Cg_endo -50.28 123.4 11.05 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.691 2.261 . . . . 0.0 112.777 -176.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -52.04 151.2 3.83 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -57.3 -45.97 83.64 Favored 'General case' 0 CA--C 1.484 -1.561 0 CA-C-N 114.799 -1.091 . . . . 0.0 108.453 172.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . 0.432 ' HB3' ' HG2' ' A' ' 960' ' ' LYS . 52.8 m-20 -96.4 77.12 2.97 Favored 'General case' 0 N--CA 1.414 -2.267 0 N-CA-C 105.113 -2.18 . . . . 0.0 105.113 175.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 3.9 m -63.77 -41.73 97.91 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.439 -168.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -108.74 137.73 46.21 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 122.02 0.914 . . . . 0.0 112.18 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 4.6 p -144.87 174.47 10.97 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 125.485 1.514 . . . . 0.0 108.257 -170.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -106.07 178.69 4.49 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 173.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.47 -28.35 13.02 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -93.62 -13.16 27.96 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.934 -0.479 . . . . 0.0 111.455 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 107.33 -2.95 34.82 Favored Glycine 0 CA--C 1.491 -1.461 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.099 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -58.07 107.33 0.46 Allowed 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . 0.432 ' HG2' ' HB3' ' A' ' 951' ' ' ASP . 1.1 tmtp? -47.03 119.64 2.66 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 124.556 1.16 . . . . 0.0 110.169 178.565 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.45 179.59 4.07 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.047 -0.978 . . . . 0.0 110.306 -175.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . 0.438 ' HB2' ' HB2' ' A' ' 966' ' ' GLU . . . -78.4 156.37 29.5 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.813 178.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 13.0 p -76.21 161.23 75.87 Favored Pre-proline 0 N--CA 1.437 -1.096 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 178.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -61.12 -18.28 57.17 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 122.716 2.278 . . . . 0.0 112.454 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 4.2 m -74.27 -48.83 26.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 174.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . 0.438 ' HB2' ' HB2' ' A' ' 962' ' ' ALA . 42.4 mt-10 -65.26 -37.31 86.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.499 -1.228 . . . . 0.0 112.389 177.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.47 111.0 2.14 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.236 0.541 . . . . 0.0 110.396 -177.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 73.0 p -107.24 165.36 11.43 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.863 -176.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.601 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 9.1 p -97.81 128.6 33.57 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.705 172.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.566 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 61.3 Cg_endo -71.11 169.0 21.66 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.488 2.125 . . . . 0.0 110.34 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -46.91 -34.78 16.96 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.125 2.55 . . . . 0.0 114.685 -178.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.538 ' O ' ' HG2' ' A' 1029 ' ' LYS . . . -101.43 8.42 56.85 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 119.943 -1.122 . . . . 0.0 112.995 -177.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.601 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 76.1 m95 -124.2 133.47 53.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.829 0.823 . . . . 0.0 110.451 179.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.539 ' HB3' ' O ' ' A' 1028 ' ' LYS . 5.5 tp10 -126.01 119.45 27.71 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 126.563 1.945 . . . . 0.0 109.569 -173.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.658 ' CE3' ' HG2' ' A' 1025 ' ' ARG . 90.2 m95 -70.35 104.56 2.73 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 121.416 -0.802 . . . . 0.0 111.716 -178.033 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -70.49 -38.55 74.37 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.563 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . 0.529 ' HB2' ' HG3' ' A' 1025 ' ' ARG . 83.5 m-20 -78.46 152.67 31.98 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.269 0.557 . . . . 0.0 111.811 -176.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -88.69 107.57 19.01 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 174.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . 57.13 173.04 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 123.37 1.557 . . . . 0.0 114.405 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.432 ' HA ' ' O ' ' A' 1024 ' ' VAL . 24.5 m95 -91.2 124.09 35.15 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 112.851 -1.977 . . . . 0.0 108.08 177.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 15.1 m -124.31 155.62 38.37 Favored 'General case' 0 C--O 1.206 -1.211 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -175.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -74.46 144.68 44.1 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 119.044 0.838 . . . . 0.0 111.206 -174.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.448 ' HB3' ' HD2' ' A' 1022 ' ' ARG . 18.0 t70 -102.67 126.16 49.66 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.633 -174.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.0 pp -114.86 26.5 3.69 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.111 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -109.25 27.27 9.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 123.489 1.614 . . . . 0.0 107.31 -178.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.651 ' HG2' ' H ' ' A' ' 987' ' ' ALA . 11.3 ttt180 -141.24 -178.58 5.66 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 -178.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.651 ' H ' ' HG2' ' A' ' 986' ' ' ARG . . . -89.0 82.0 6.75 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 119.451 1.023 . . . . 0.0 109.732 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.404 HG22 ' O ' ' A' ' 983' ' ' ASP . 28.3 m -128.41 -172.15 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 114.337 -1.301 . . . . 0.0 109.289 -178.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . 0.401 ' CG ' ' H ' ' A' ' 990' ' ' GLU . 34.2 t70 -92.9 -178.8 4.93 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 177.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . 0.401 ' H ' ' CG ' ' A' ' 989' ' ' ASP . 46.7 mt-10 -57.07 -33.45 67.27 Favored 'General case' 0 CA--C 1.494 -1.181 0 C-N-CA 123.987 0.915 . . . . 0.0 111.721 179.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -108.25 17.41 22.25 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.222 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 86.13 -23.06 10.08 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.12 -0.945 . . . . 0.0 113.588 177.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.846 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 79.0 m95 -56.25 111.68 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.695 0.759 . . . . 0.0 112.5 -177.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.692 ' HG3' ' CE3' ' A' 1008 ' ' TRP . 7.4 pt-20 -98.62 157.25 16.37 Favored 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 124.244 1.018 . . . . 0.0 109.944 -178.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.502 ' HH ' HD13 ' A' ' 997' ' ' ILE . 59.3 t80 -64.99 99.08 0.32 Allowed 'General case' 0 C--O 1.211 -0.953 0 CA-C-N 111.803 -2.453 . . . . 0.0 113.002 -174.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -120.9 114.93 2.75 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 119.462 -1.351 . . . . 0.0 112.573 172.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.502 HD13 ' HH ' ' A' ' 995' ' ' TYR . 1.6 pt -118.57 151.84 20.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 106.131 -1.803 . . . . 0.0 106.131 174.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 76.7 m -133.37 97.32 3.93 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-O 122.168 0.985 . . . . 0.0 110.589 174.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 77.0 mt -97.42 115.52 65.75 Favored Pre-proline 0 C--N 1.317 -0.845 0 CA-C-N 114.014 -1.448 . . . . 0.0 109.184 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1000 ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 27.0 Cg_exo -60.57 141.87 96.43 Favored 'Trans proline' 0 C--O 1.241 0.649 0 C-N-CA 122.82 2.347 . . . . 0.0 112.864 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1001 ' ' PRO . . . . . 0.437 ' O ' ' HB2' ' A' 1002 ' ' ASP . 9.7 Cg_endo -90.41 141.13 13.37 Favored 'Cis proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.862 -1.724 . . . . 0.0 114.365 0.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1002 ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' 1001 ' ' PRO . 7.8 t0 160.17 166.59 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 111.867 -2.424 . . . . 0.0 106.521 176.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -117.04 -33.63 4.66 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 174.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 33.8 mttm -105.88 134.12 19.88 Favored Pre-proline 0 N--CA 1.429 -1.507 0 CA-C-N 114.806 -1.088 . . . . 0.0 113.463 -171.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1005 ' ' PRO . . . . . 0.556 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 31.7 Cg_exo -66.26 126.28 15.43 Favored 'Trans proline' 0 C--N 1.329 -0.463 0 C-N-CA 122.775 2.317 . . . . 0.0 109.782 167.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -84.03 -57.39 3.21 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 122.217 1.008 . . . . 0.0 109.409 -177.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 3.7 m -87.5 136.01 33.11 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 112.742 -2.026 . . . . 0.0 111.608 -173.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.692 ' CE3' ' HG3' ' A' ' 994' ' ' GLU . 60.4 m95 -134.65 137.2 43.42 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 11.0 m -163.11 -173.31 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -175.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -97.3 97.6 9.28 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 175.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -165.27 167.37 18.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.426 -176.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.605 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.9 tp10 -148.2 101.24 3.25 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-O 122.066 0.936 . . . . 0.0 109.553 178.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 90.4 mttt -118.0 135.92 53.85 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 113.662 -1.608 . . . . 0.0 107.363 174.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 56.8 ttp -44.87 -22.77 0.1 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -177.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -68.01 -9.03 42.5 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 178.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.605 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 2.5 m80 -50.49 107.7 0.18 Allowed 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 123.754 0.821 . . . . 0.0 112.419 176.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1017 ' ' THR . . . . . 0.409 ' H ' ' HA ' ' A' ' 997' ' ' ILE . 2.6 m -103.21 -21.38 13.87 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.78 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 3.5 m170 -145.54 123.3 11.9 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.576 -172.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.846 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 17.8 mmt180 -100.36 136.36 40.37 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 170.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.619 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 41.8 ttm180 -140.25 161.97 36.39 Favored 'General case' 0 C--O 1.197 -1.674 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 178.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.6 ptt180 -159.28 159.21 33.8 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 118.068 0.395 . . . . 0.0 110.257 174.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.473 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.5 ttm180 -90.6 120.99 32.13 Favored 'General case' 0 N--CA 1.424 -1.771 0 O-C-N 123.842 0.714 . . . . 0.0 109.934 177.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1023 ' ' LEU . . . . . . . . . . . . . 65.7 mt -102.66 126.89 49.92 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 104.648 -2.352 . . . . 0.0 104.648 167.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.432 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 6.9 m -110.29 151.54 12.48 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.895 0 CA-C-O 122.032 0.92 . . . . 0.0 111.667 -175.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.658 ' HG2' ' CE3' ' A' ' 975' ' ' TRP . 0.6 OUTLIER -149.53 111.49 4.6 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 113.054 -1.884 . . . . 0.0 108.997 169.017 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.5 tmmm? -70.86 138.05 49.9 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.642 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 14.1 ptm180 -122.02 150.95 41.37 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 104.092 -2.559 . . . . 0.0 104.092 -173.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.539 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 71.3 tttt -144.8 132.07 20.63 Favored 'General case' 0 C--N 1.283 -2.31 0 O-C-N 123.265 0.353 . . . . 0.0 110.399 -167.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.611 ' HB2' ' HB ' ' A' ' 928' ' ' THR . 24.3 mtpp -88.58 -24.42 22.87 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 123.685 1.707 . . . . 0.0 108.049 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1030 ' ' ASP . . . . . 0.48 ' HB3' HG22 ' A' 1032 ' ' THR . 29.8 t0 50.21 10.25 0.05 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 110.895 -2.866 . . . . 0.0 112.742 -168.326 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1031 ' ' LEU . . . . . 0.45 ' H ' ' C ' ' A' 1029 ' ' LYS . 20.8 tp 60.15 13.68 4.01 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.053 1.741 . . . . 0.0 111.625 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1032 ' ' THR . . . . . 0.48 HG22 ' HB3' ' A' 1030 ' ' ASP . 13.5 t -125.55 7.07 7.59 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -174.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.496 ' OE1' ' HB2' ' A' ' 974' ' ' GLU . 6.0 tt0 . . . . . 0 C--N 1.315 -0.921 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.914 -177.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 65.2 m-70 . . . . . 0 CA--C 1.499 -1.008 0 CA-C-O 119.311 -0.376 . . . . 0.0 111.735 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 2.9 m 60.84 85.38 0.11 Allowed 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.962 0.887 . . . . 0.0 108.784 -167.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.841 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.6 OUTLIER -104.76 165.92 10.74 Favored 'General case' 0 C--N 1.282 -2.33 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 178.225 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . 0.566 ' O ' ' HG2' ' A' 1027 ' ' ARG . 79.2 t80 -148.45 123.56 10.13 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 -178.098 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 931' ' ' THR . . . . . . . . . . . . . 21.1 m -75.97 114.76 14.96 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 173.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -93.66 163.37 13.57 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.539 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 11.9 pt-20 -162.01 145.98 12.32 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 118.64 0.655 . . . . 0.0 110.368 -171.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 5.8 p -155.43 128.31 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.537 0.684 . . . . 0.0 111.381 172.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.643 ' HA ' ' O ' ' A' 1021 ' ' ARG . 70.1 m-85 -90.32 113.38 25.23 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.524 ' O ' ' HA ' ' A' 1020 ' ' ARG . 16.3 tt0 -79.52 128.62 33.59 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.792 171.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . 0.44 ' N ' HD21 ' A' ' 937' ' ' ASN . 0.5 OUTLIER -117.89 146.58 43.82 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 123.501 0.72 . . . . 0.0 109.907 -177.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.598 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 38.4 mt-10 -129.07 172.11 11.72 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 171.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 27.1 t -152.08 136.76 17.0 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 118.529 0.604 . . . . 0.0 110.622 -175.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.63 ' O ' ' HA ' ' A' 1017 ' ' THR . 22.4 ptt180 -136.85 159.63 41.3 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 176.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -81.21 166.92 35.56 Favored Pre-proline 0 C--N 1.308 -1.227 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 171.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . 0.442 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 15.6 Cg_exo -69.66 86.69 0.56 Allowed 'Trans proline' 0 N--CA 1.452 -0.948 0 N-CA-C 108.988 -1.197 . . . . 0.0 108.988 170.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.13 8.18 3.41 Favored Glycine 0 N--CA 1.436 -1.352 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 -173.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . 0.496 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -117.89 -179.26 17.32 Favored Glycine 0 CA--C 1.503 -0.713 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -112.02 158.28 19.74 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 119.822 1.811 . . . . 0.0 107.012 172.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.598 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 28.9 m95 -67.35 138.69 56.96 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-O 121.392 0.615 . . . . 0.0 110.798 -174.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -129.12 179.31 1.33 Allowed Pre-proline 0 C--N 1.302 -1.498 0 N-CA-C 101.412 -3.551 . . . . 0.0 101.412 174.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.9 144.48 99.57 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 CA-C-N 123.243 2.194 . . . . 0.0 111.406 177.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.94 -170.09 0.1 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.481 0.658 . . . . 0.0 110.818 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.62 -35.74 14.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 -177.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -123.28 100.15 6.7 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 104.556 -2.387 . . . . 0.0 104.556 168.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 27.6 m -69.13 -59.45 3.02 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -173.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -96.0 128.25 42.73 Favored 'General case' 0 C--N 1.313 -0.99 0 O-C-N 121.277 -0.889 . . . . 0.0 109.719 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 18.1 p -148.89 -178.05 6.14 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.705 0.764 . . . . 0.0 111.352 -168.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -108.3 168.49 9.27 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 104.314 -2.476 . . . . 0.0 104.314 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.38 -30.88 31.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 119.153 0.888 . . . . 0.0 111.114 174.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -78.54 -8.34 58.47 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 95.07 -4.75 68.02 Favored Glycine 0 CA--C 1.501 -0.799 0 C-N-CA 120.263 -0.97 . . . . 0.0 112.224 178.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -62.08 102.25 0.27 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . 0.409 ' C ' ' HD3' ' A' ' 960' ' ' LYS . 12.5 tmtt? -50.68 122.78 7.74 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.571 1.17 . . . . 0.0 109.438 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.24 -173.2 2.41 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.317 -178.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . 0.562 ' HB3' ' HB2' ' A' ' 966' ' ' GLU . . . -78.9 152.94 30.89 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 177.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.3 m -79.05 157.7 75.68 Favored Pre-proline 0 C--N 1.315 -0.892 0 N-CA-C 107.435 -1.321 . . . . 0.0 107.435 178.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.57 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 7.5 Cg_exo -49.18 -24.89 8.66 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.586 2.857 . . . . 0.0 115.653 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.8 t -80.24 -43.34 21.58 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 177.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . 0.562 ' HB2' ' HB3' ' A' ' 962' ' ' ALA . 46.2 mm-40 -64.87 -32.2 73.79 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.768 175.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.482 HD13 ' CH2' ' A' ' 980' ' ' TRP . 83.6 mt -68.59 118.55 11.76 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 175.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 10.0 p -126.14 -175.39 3.35 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.126 -171.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.647 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 25.9 p -109.99 124.94 32.2 Favored Pre-proline 0 N--CA 1.435 -1.189 0 O-C-N 121.905 -0.497 . . . . 0.0 110.457 177.344 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.6 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 98.1 Cg_endo -77.04 173.24 14.77 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 122.908 2.405 . . . . 0.0 110.713 174.034 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -41.93 -48.64 6.02 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 124.271 3.314 . . . . 0.0 115.451 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.443 ' O ' ' HA ' ' A' 1029 ' ' LYS . . . -101.38 14.01 58.21 Favored Glycine 0 N--CA 1.439 -1.102 0 C-N-CA 120.141 -1.028 . . . . 0.0 113.584 -175.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.647 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 88.5 m95 -119.95 121.4 38.91 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 118.437 1.118 . . . . 0.0 111.71 179.342 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.456 ' HB2' ' OE1' ' A' 1033 ' ' GLN . 7.5 tp10 -110.08 127.69 55.01 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 126.602 1.961 . . . . 0.0 109.585 -172.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -70.77 106.89 3.73 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.722 0.772 . . . . 0.0 112.393 174.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -72.15 -47.11 53.41 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 172.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . 0.786 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 3.6 m-20 -87.41 160.6 18.26 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.704 -1.135 . . . . 0.0 112.229 -178.551 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -91.13 -53.32 4.41 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -168.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -148.32 132.67 17.53 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -173.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.57 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 17.1 m95 -61.11 123.1 16.69 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 123.989 0.805 . . . . 0.0 109.806 -172.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 49.8 p -122.8 156.02 35.38 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -177.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . 0.477 ' HB3' ' HD2' ' A' 1021 ' ' ARG . 0.0 OUTLIER -72.47 140.84 48.49 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.334 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.506 ' HB2' HG11 ' A' 1024 ' ' VAL . 52.6 t0 -91.16 130.5 37.04 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.832 -1.077 . . . . 0.0 111.117 -171.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.1 pp -115.59 14.25 7.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.501 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . 0.585 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 3.5 t-20 -97.37 16.45 20.07 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.009 0.909 . . . . 0.0 109.146 -176.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.585 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 7.6 mpt_? -139.87 179.75 6.42 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -175.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.85 86.2 3.43 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.691 0.758 . . . . 0.0 110.768 179.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 18.2 m -125.73 -179.23 2.37 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 114.933 -1.03 . . . . 0.0 109.39 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -73.67 177.82 5.17 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -64.82 -28.14 69.36 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 118.725 0.693 . . . . 0.0 111.768 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 57.3 mttt -85.87 -57.42 3.05 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 141.08 71.79 0.03 OUTLIER Glycine 0 CA--C 1.498 -1.013 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.667 177.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -145.6 140.79 27.63 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -99.93 160.08 14.59 Favored 'General case' 0 C--O 1.252 1.235 0 CA-C-N 118.944 0.793 . . . . 0.0 109.996 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.645 ' O ' ' HA ' ' A' 1008 ' ' TRP . 21.6 t80 -83.65 99.36 10.16 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 127.412 2.285 . . . . 0.0 109.547 -176.078 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . 0.513 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -120.97 120.95 4.65 Favored Glycine 0 N--CA 1.433 -1.505 0 C-N-CA 119.005 -1.569 . . . . 0.0 110.741 175.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.523 HG23 ' HA ' ' A' 1016 ' ' HIS . 13.8 pt -127.47 143.17 41.52 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 C-N-CA 118.579 -1.248 . . . . 0.0 109.148 177.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.7 t -146.1 155.63 42.89 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 20.5 pt -116.6 107.91 45.92 Favored Pre-proline 0 C--N 1.315 -0.927 0 C-N-CA 119.931 -0.708 . . . . 0.0 110.865 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1000 ' ' PRO . . . . . 0.434 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 38.3 Cg_endo -69.13 136.6 35.11 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.497 2.131 . . . . 0.0 112.556 -178.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1001 ' ' PRO . . . . . 0.434 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 5.5 Cg_endo -87.15 150.35 38.57 Favored 'Cis proline' 0 N--CA 1.45 -1.035 0 C-N-CA 122.938 -1.692 . . . . 0.0 112.816 -1.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 25.0 t70 -165.0 -86.68 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 113.336 -1.756 . . . . 0.0 107.707 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -178.5 -81.14 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 63.3 mttm -144.19 160.42 49.06 Favored Pre-proline 0 C--N 1.317 -0.811 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1005 ' ' PRO . . . . . 0.556 ' HG2' ' HB2' ' A' 1018 ' ' HIS . 36.1 Cg_exo -58.5 144.34 97.04 Favored 'Trans proline' 0 C--O 1.241 0.675 0 C-N-CA 122.433 2.089 . . . . 0.0 110.882 169.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 39.8 mmtt -98.85 -48.18 5.01 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 -177.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 3.4 m -89.06 139.14 30.76 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 111.724 -2.489 . . . . 0.0 111.406 -173.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.645 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 61.8 m95 -135.11 132.64 38.34 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 175.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 37.1 t -142.11 170.04 12.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 -169.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -90.53 97.99 11.51 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 119.619 1.099 . . . . 0.0 108.274 172.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1011 ' ' ALA . . . . . 0.423 ' HB2' ' CD2' ' A' ' 995' ' ' TYR . . . -177.08 177.26 1.28 Allowed 'General case' 0 C--O 1.238 0.492 0 C-N-CA 122.81 0.444 . . . . 0.0 109.862 -176.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.531 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.1 OUTLIER -169.48 110.62 0.46 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.242 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 76.3 mttt -122.34 150.81 41.87 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.384 -1.28 . . . . 0.0 108.756 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1014 ' ' MET . . . . . 0.421 ' C ' ' H ' ' A' 1016 ' ' HIS . 24.2 ttt -53.43 -36.26 61.35 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1015 ' ' TYR . . . . . 0.442 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 59.7 m-85 -72.85 14.21 0.3 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.03 0.532 . . . . 0.0 111.62 -179.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.621 ' HB2' HH21 ' A' ' 940' ' ' ARG . 0.3 OUTLIER -63.45 176.38 0.84 Allowed 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 121.863 0.84 . . . . 0.0 110.12 171.032 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 1017 ' ' THR . . . . . 0.63 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.7 OUTLIER -163.41 -31.04 0.04 OUTLIER 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.006 -1.452 . . . . 0.0 108.793 -168.236 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 1018 ' ' HIS . . . . . 0.556 ' HB2' ' HG2' ' A' 1005 ' ' PRO . 59.7 m80 -145.56 155.87 43.33 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.416 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.415 ' O ' ' HA ' ' A' ' 937' ' ' ASN . 35.8 ptt180 -154.66 152.52 30.06 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 105.863 -1.903 . . . . 0.0 105.863 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.524 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 3.8 ptp180 -151.65 165.58 33.9 Favored 'General case' 0 C--O 1.195 -1.805 0 C-N-CA 118.418 -1.313 . . . . 0.0 109.837 178.188 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.643 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.3 ptt180 -149.17 145.71 27.3 Favored 'General case' 0 C--N 1.289 -2.05 0 C-N-CA 119.471 -0.891 . . . . 0.0 109.64 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.539 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.7 ttm180 -85.91 114.99 23.26 Favored 'General case' 0 N--CA 1.424 -1.749 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.443 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 65.6 mt -84.67 123.31 30.22 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 103.603 -2.74 . . . . 0.0 103.603 167.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.506 HG11 ' HB2' ' A' ' 983' ' ' ASP . 3.3 m -102.3 149.41 6.89 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.92 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -176.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.786 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -152.34 110.0 3.62 Favored 'General case' 0 C--N 1.289 -2.048 0 O-C-N 125.138 1.524 . . . . 0.0 111.542 166.558 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.455 ' HD2' ' N ' ' A' 1027 ' ' ARG . 2.7 tmmm? -84.35 146.42 27.71 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -176.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.566 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 12.2 ptm180 -142.98 179.9 6.76 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 104.643 -2.355 . . . . 0.0 104.643 -170.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.841 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 14.1 ptpt -162.56 155.58 19.83 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 118.648 0.658 . . . . 0.0 109.767 178.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.443 ' HA ' ' O ' ' A' ' 972' ' ' GLY . 33.1 ttmt -91.24 -12.56 34.86 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.166 0.984 . . . . 0.0 109.953 -172.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 33.9 t70 60.03 19.44 8.58 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.208 -1.815 . . . . 0.0 108.734 -175.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 37.3 tp 62.33 -29.46 0.08 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.865 2.066 . . . . 0.0 115.196 -179.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 13.4 t -136.41 19.87 3.14 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 119.508 1.049 . . . . 0.0 110.106 -169.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.456 ' OE1' ' HB2' ' A' ' 974' ' ' GLU . 18.5 tt0 . . . . . 0 C--N 1.323 -0.58 0 CA-C-O 121.559 0.695 . . . . 0.0 110.561 -179.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.487 -1.478 0 CA-C-O 121.309 0.576 . . . . 0.0 110.483 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 928' ' ' THR . . . . . 0.421 ' OG1' ' HB3' ' A' 1029 ' ' LYS . 0.5 OUTLIER -91.34 113.29 25.52 Favored 'General case' 0 N--CA 1.415 -2.213 0 N-CA-C 104.809 -2.293 . . . . 0.0 104.809 160.555 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.611 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.4 OUTLIER -129.28 129.62 45.14 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 176.866 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -121.64 135.14 54.99 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -179.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 26.0 m -71.16 123.06 21.3 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 177.279 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -98.54 156.53 16.74 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 104.651 -2.351 . . . . 0.0 104.651 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.763 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.1 pt-20 -154.93 159.21 40.26 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 118.209 0.459 . . . . 0.0 110.672 -170.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.436 HG12 ' CZ3' ' A' ' 980' ' ' TRP . 7.7 p -158.77 131.37 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 170.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.44 ' HA ' ' O ' ' A' 1021 ' ' ARG . 37.7 m-85 -82.3 150.19 27.38 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 122.284 1.04 . . . . 0.0 111.063 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.572 ' O ' ' HA ' ' A' 1020 ' ' ARG . 23.8 tt0 -126.12 125.42 42.49 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 -179.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . 0.983 ' HB3' ' HG2' ' A' 1020 ' ' ARG . 0.0 OUTLIER -124.1 145.68 49.11 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.787 0.804 . . . . 0.0 111.398 -178.392 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.583 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 18.8 mt-10 -139.13 153.3 47.96 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 -178.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 15.2 m -136.37 149.55 48.39 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 121.168 0.509 . . . . 0.0 111.544 -172.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.571 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 20.2 ptt180 -146.62 161.34 40.74 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 114.14 -1.391 . . . . 0.0 108.343 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -66.89 158.76 79.33 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 170.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . 0.555 ' HG3' HG22 ' A' 1017 ' ' THR . 36.9 Cg_exo -61.13 85.85 0.09 OUTLIER 'Trans proline' 0 C--O 1.237 0.458 0 CA-C-N 120.687 1.281 . . . . 0.0 110.39 172.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 110.03 73.52 0.75 Allowed Glycine 0 N--CA 1.434 -1.457 0 N-CA-C 106.74 -2.544 . . . . 0.0 106.74 -173.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -166.34 -144.89 4.25 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 119.721 -1.228 . . . . 0.0 113.65 -172.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -128.91 123.6 33.02 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.417 -0.892 . . . . 0.0 110.639 -172.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.583 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 64.3 m95 -73.84 136.44 43.48 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 -178.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -142.34 163.16 41.12 Favored Pre-proline 0 C--N 1.295 -1.763 0 N-CA-C 102.791 -3.04 . . . . 0.0 102.791 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -49.2 137.06 30.52 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.851 1.7 . . . . 0.0 113.575 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.38 -172.7 0.08 Allowed 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.349 175.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.402 ' H ' ' CD ' ' A' ' 950' ' ' GLU . 0.1 OUTLIER -84.36 -35.91 22.86 Favored 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 -178.452 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . 0.489 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 53.4 m-20 -123.03 97.45 5.44 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 170.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 25.7 m -61.16 -49.67 76.3 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -170.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -102.73 126.17 49.74 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.026 0.917 . . . . 0.0 111.783 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 10.6 p -135.16 165.59 25.05 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.702 -174.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -91.19 170.05 10.33 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 172.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.93 -29.88 22.05 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.101 0.864 . . . . 0.0 112.635 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -96.02 13.05 28.33 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 70.67 49.39 30.32 Favored Glycine 0 CA--C 1.484 -1.898 0 C-N-CA 121.061 -0.59 . . . . 0.0 111.711 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -107.73 109.43 21.02 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 103.617 -2.734 . . . . 0.0 103.617 177.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . 0.489 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 20.9 tptm -45.16 113.54 0.59 Allowed 'General case' 0 C--N 1.312 -1.027 0 O-C-N 124.6 1.188 . . . . 0.0 111.276 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.11 176.02 5.41 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.002 -176.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . 0.489 ' HB2' ' HB2' ' A' ' 966' ' ' GLU . . . -80.5 159.88 25.41 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.2 m -86.87 159.02 52.67 Favored Pre-proline 0 N--CA 1.433 -1.304 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.61 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 15.4 Cg_exo -46.57 -26.77 4.58 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 124.225 3.283 . . . . 0.0 115.608 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.9 t -71.93 -49.22 39.46 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . 0.489 ' HB2' ' HB2' ' A' ' 962' ' ' ALA . 1.5 mp0 -64.56 -33.15 75.25 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.15 0.5 . . . . 0.0 110.181 176.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 73.5 mt -64.89 110.96 2.61 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.978 0.894 . . . . 0.0 109.591 178.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.09 179.21 5.88 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.141 -173.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.506 ' HB3' ' NE1' ' A' ' 975' ' ' TRP . 25.0 p -94.74 136.87 22.65 Favored Pre-proline 0 C--N 1.321 -0.632 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.974 -176.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.561 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 44.7 Cg_endo -84.78 167.66 11.24 Favored 'Trans proline' 0 C--O 1.241 0.641 0 C-N-CA 122.977 2.452 . . . . 0.0 110.731 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -67.01 103.96 0.79 Allowed 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 121.607 1.538 . . . . 0.0 110.289 175.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.502 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 124.59 -2.23 8.74 Favored Glycine 0 N--CA 1.438 -1.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.92 -177.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.561 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 94.5 m95 -133.98 130.75 38.08 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 122.035 0.921 . . . . 0.0 111.255 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -117.24 131.41 56.85 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 126.586 1.954 . . . . 0.0 109.602 -170.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.574 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 91.9 m95 -83.95 156.74 22.18 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.571 177.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -140.11 -36.36 0.49 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.183 -178.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -68.15 146.52 53.35 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.507 178.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.55 -43.63 80.22 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -177.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.73 168.51 12.43 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -176.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.61 ' CD1' ' HB3' ' A' ' 964' ' ' PRO . 45.2 m95 -70.07 118.37 12.81 Favored 'General case' 0 C--N 1.309 -1.159 0 O-C-N 124.435 1.085 . . . . 0.0 108.446 -179.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 981' ' ' SER . . . . . 0.65 ' O ' ' HA ' ' A' 1023 ' ' LEU . 21.0 m -110.3 -161.0 0.73 Allowed 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 104.853 -2.277 . . . . 0.0 104.853 -173.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -119.75 153.06 36.24 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 121.669 2.031 . . . . 0.0 109.697 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.521 ' HB2' ' HD2' ' A' 1022 ' ' ARG . 20.8 t70 -83.28 114.95 21.75 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.719 0.771 . . . . 0.0 111.063 -173.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.429 ' HA ' HG22 ' A' ' 988' ' ' VAL . 23.4 pt -107.1 -157.89 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.649 176.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 10.1 t30 49.79 44.01 24.85 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.923 1.344 . . . . 0.0 108.589 -172.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.46 ' HG2' ' H ' ' A' ' 987' ' ' ALA . 52.4 ttt85 -153.43 -179.71 8.01 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 -172.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.46 ' H ' ' HG2' ' A' ' 986' ' ' ARG . . . -87.95 69.82 9.42 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.832 -1.174 . . . . 0.0 107.832 176.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.454 ' CG1' ' HD3' ' A' ' 986' ' ' ARG . 24.1 m -122.79 150.66 26.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.67 -1.15 . . . . 0.0 113.154 -173.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . 0.424 ' HB3' ' HB2' ' A' ' 993' ' ' TRP . 23.8 t70 -55.25 171.68 0.16 Allowed 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 113.271 -1.786 . . . . 0.0 110.751 168.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.53 -34.01 47.89 Favored 'General case' 0 CA--C 1.499 -0.991 0 C-N-CA 123.669 0.788 . . . . 0.0 111.304 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . 0.518 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 71.3 mmtt -106.46 16.92 24.07 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.347 -174.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 93.69 -11.1 71.79 Favored Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.586 173.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.615 ' CG ' ' HD3' ' A' 1019 ' ' ARG . 97.1 m95 -59.93 153.31 21.45 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -137.49 152.38 49.47 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-N 115.238 -0.892 . . . . 0.0 112.252 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.703 ' HD2' ' HB ' ' A' 1009 ' ' VAL . 0.3 OUTLIER -62.32 99.85 0.15 Allowed 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 113.429 -1.714 . . . . 0.0 111.853 -178.267 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . 0.493 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -117.91 84.36 0.37 Allowed Glycine 0 CA--C 1.49 -1.497 0 C-N-CA 118.964 -1.589 . . . . 0.0 111.829 172.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.742 ' O ' ' HA ' ' A' 1005 ' ' PRO . 2.3 tt -92.4 131.79 38.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 O-C-N 121.581 -0.953 . . . . 0.0 109.806 -176.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 29.4 m -131.23 110.93 11.48 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 61.0 mt -117.81 119.46 33.87 Favored Pre-proline 0 C--N 1.314 -0.975 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.489 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -58.53 144.62 96.88 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 122.816 2.344 . . . . 0.0 112.145 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -90.86 127.22 6.48 Favored 'Cis proline' 0 N--CA 1.445 -1.341 0 C-N-CA 123.279 -1.55 . . . . 0.0 112.805 -1.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 49.3 t0 156.8 141.7 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 110.878 -2.874 . . . . 0.0 105.84 -176.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.0 p80 -125.43 41.95 3.4 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 122.997 1.38 . . . . 0.0 108.7 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 59.1 mttp -138.5 139.42 24.7 Favored Pre-proline 0 N--CA 1.434 -1.257 0 CA-C-N 112.915 -1.948 . . . . 0.0 107.441 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1005 ' ' PRO . . . . . 0.742 ' HA ' ' O ' ' A' ' 997' ' ' ILE . 81.5 Cg_exo -57.23 170.38 1.66 Allowed 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.234 1.956 . . . . 0.0 113.081 167.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -110.16 -46.33 3.46 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.85 -173.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 13.4 t -160.81 147.23 15.09 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -174.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1008 ' ' TRP . . . . . . . . . . . . . 42.8 m95 -112.83 124.33 52.36 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.703 ' HB ' ' HD2' ' A' ' 995' ' ' TYR . 46.3 t -143.88 161.62 15.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 -169.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -93.34 -1.2 56.21 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.835 0.35 . . . . 0.0 111.483 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1011 ' ' ALA . . . . . 0.468 ' H ' HG12 ' A' 1009 ' ' VAL . . . -101.08 116.5 32.99 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.158 0.504 . . . . 0.0 111.045 -175.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.4 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 42.9 tp10 -71.36 114.99 10.0 Favored 'General case' 0 N--CA 1.439 -1.025 0 CA-C-O 122.226 1.012 . . . . 0.0 111.033 177.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.462 ' H ' ' CE1' ' A' 1016 ' ' HIS . 66.4 mttm -120.59 147.92 44.57 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 113.985 -1.461 . . . . 0.0 108.51 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 54.8 ttp -51.13 -37.43 46.08 Favored 'General case' 0 C--N 1.307 -1.28 0 O-C-N 124.091 0.869 . . . . 0.0 112.799 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -55.11 -12.14 0.84 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.694 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 26.5 m80 -58.19 109.76 0.82 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.071 0.463 . . . . 0.0 111.833 175.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1017 ' ' THR . . . . . 0.555 HG22 ' HG3' ' A' ' 942' ' ' PRO . 0.0 OUTLIER -97.63 -31.34 12.34 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 123.268 1.508 . . . . 0.0 109.319 175.62 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 1018 ' ' HIS . . . . . 0.493 ' HB2' ' O ' ' A' ' 996' ' ' GLY . 30.4 m170 -136.41 155.93 49.33 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 113.774 -1.557 . . . . 0.0 108.162 -176.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.615 ' HD3' ' CG ' ' A' ' 993' ' ' TRP . 11.3 ttm180 -153.08 139.37 18.47 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 177.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.983 ' HG2' ' HB3' ' A' ' 937' ' ' ASN . 95.9 mtt180 -134.05 166.02 23.7 Favored 'General case' 0 CA--C 1.481 -1.69 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -177.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.565 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 24.5 ptt180 -155.74 153.47 29.94 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 124.23 0.956 . . . . 0.0 108.616 168.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.763 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 34.4 ttm180 -86.52 120.75 28.18 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 176.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.65 ' HA ' ' O ' ' A' ' 981' ' ' SER . 77.6 mt -86.71 129.45 34.87 Favored 'General case' 0 N--CA 1.423 -1.791 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 169.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.447 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 14.1 m -108.3 135.26 47.61 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 CA-C-O 121.419 0.628 . . . . 0.0 112.397 -172.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.449 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.3 tpt180 -142.98 97.63 3.13 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 170.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.557 ' HD3' ' HB2' ' A' ' 929' ' ' GLU . 0.0 OUTLIER -74.65 152.79 39.15 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 -179.607 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.574 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 8.1 ptm180 -142.18 166.58 24.31 Favored 'General case' 0 CA--C 1.496 -1.098 0 N-CA-C 106.255 -1.757 . . . . 0.0 106.255 -171.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.611 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 13.6 ptpt -155.19 152.74 29.74 Favored 'General case' 0 C--O 1.196 -1.727 0 CA-C-O 121.042 0.449 . . . . 0.0 110.842 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 36.9 ttmt -91.39 -21.28 21.07 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 -178.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 14.3 t70 46.97 27.53 0.74 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 111.175 -2.738 . . . . 0.0 110.411 -169.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 34.8 tp 70.82 -47.52 0.65 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.332 1.853 . . . . 0.0 114.005 177.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 11.3 t -90.55 14.82 12.13 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -170.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 . . . . . 0 C--O 1.216 -0.692 0 O-C-N 121.237 -0.914 . . . . 0.0 110.833 175.467 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . 0.259 0.6 OUTLIER . . . . . 0 CA--C 1.492 -1.277 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.66 122.91 35.55 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 163.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.448 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.1 OUTLIER -139.19 137.86 36.4 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 170.758 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -136.19 140.62 43.71 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.639 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 28.0 m -72.2 129.65 38.95 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 118.673 0.67 . . . . 0.0 112.108 178.257 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -100.19 160.56 14.23 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 105.989 -1.856 . . . . 0.0 105.989 177.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -158.94 145.24 16.84 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.323 0.582 . . . . 0.0 110.961 -171.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.521 HG13 ' HG3' ' A' ' 964' ' ' PRO . 14.6 p -141.02 171.47 12.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 177.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -127.89 143.13 51.11 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -176.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.678 ' O ' ' HA ' ' A' 1020 ' ' ARG . 16.9 tt0 -117.65 118.21 31.49 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.397 179.265 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -95.89 126.17 40.96 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 124.365 1.041 . . . . 0.0 111.288 -178.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.51 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 47.8 mt-10 -121.27 154.38 36.42 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 169.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 33.8 m -144.84 158.19 43.89 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.566 -0.853 . . . . 0.0 110.727 -173.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.497 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 28.7 ptt180 -151.64 159.58 43.98 Favored 'General case' 0 N--CA 1.427 -1.598 0 O-C-N 124.57 1.169 . . . . 0.0 108.612 178.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -76.51 166.85 41.68 Favored Pre-proline 0 C--N 1.309 -1.185 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.73 74.36 1.28 Allowed 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 121.359 1.373 . . . . 0.0 111.212 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 139.86 8.14 0.94 Allowed Glycine 0 CA--C 1.528 0.86 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 -176.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . 0.47 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -101.43 -166.33 27.54 Favored Glycine 0 C--N 1.336 0.538 0 N-CA-C 111.071 -0.811 . . . . 0.0 111.071 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -125.61 159.9 31.0 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.578 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 45.5 m95 -73.53 129.76 38.65 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 122.127 0.965 . . . . 0.0 110.304 -175.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -146.39 138.45 13.55 Favored Pre-proline 0 C--N 1.287 -2.15 0 N-CA-C 103.627 -2.731 . . . . 0.0 103.627 172.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -49.87 124.6 12.78 Favored 'Trans proline' 0 C--O 1.239 0.548 0 C-N-CA 123.148 2.565 . . . . 0.0 114.733 -169.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -52.44 -177.49 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.231 169.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -102.61 -0.08 32.49 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 115.883 -2.327 . . . . 0.0 109.215 -163.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . 0.507 ' HB3' ' HG3' ' A' ' 960' ' ' LYS . 20.3 m-20 -132.63 82.92 2.03 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 103.018 -2.956 . . . . 0.0 103.018 169.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.0 m -69.31 -37.04 77.57 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.342 -167.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -109.12 131.01 55.48 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.531 0.681 . . . . 0.0 112.204 -176.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 42.5 p -145.54 178.81 7.85 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.842 -169.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -99.19 171.5 7.97 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 176.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.01 -31.88 31.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 118.335 0.516 . . . . 0.0 111.231 174.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -81.21 -15.23 56.28 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.065 0.46 . . . . 0.0 112.037 177.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 101.64 -4.32 53.76 Favored Glycine 0 CA--C 1.497 -1.064 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.458 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.87 102.5 0.08 Allowed 'General case' 0 CA--C 1.503 -0.829 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . 0.507 ' HG3' ' HB3' ' A' ' 951' ' ' ASP . 5.3 tmmm? -51.65 130.69 28.86 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 124.432 1.082 . . . . 0.0 109.571 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -130.54 175.73 8.75 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.014 -0.993 . . . . 0.0 109.484 -173.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -64.18 144.44 57.12 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 176.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.0 m -68.91 159.42 82.72 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -178.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.563 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 51.8 Cg_exo -52.65 -21.66 15.21 Favored 'Trans proline' 0 N--CA 1.48 0.733 0 C-N-CA 123.865 3.043 . . . . 0.0 114.705 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 5.2 p -70.94 -53.45 14.93 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -68.84 -24.8 64.4 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.297 176.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.518 HD11 ' HA ' ' A' ' 964' ' ' PRO . 37.3 mt -63.56 111.37 2.33 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.206 1.003 . . . . 0.0 108.68 175.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 2.7 p -130.08 169.52 15.2 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.85 -171.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 15.8 p -87.15 143.07 34.17 Favored Pre-proline 0 C--N 1.313 -0.985 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.981 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 973' ' ' TRP . 96.8 Cg_endo -75.09 175.61 11.01 Favored 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 122.703 2.269 . . . . 0.0 110.017 174.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.61 -45.4 41.31 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.928 1.752 . . . . 0.0 114.272 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . . . . . . . . . . . -76.56 -45.4 13.72 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.073 -1.06 . . . . 0.0 112.779 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.561 ' HB2' ' HG2' ' A' ' 970' ' ' PRO . 97.5 m95 -76.82 145.15 38.63 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 -179.356 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.515 ' HB3' ' O ' ' A' 1028 ' ' LYS . 4.6 tp10 -125.59 149.78 48.08 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 -179.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.59 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 94.6 m95 -86.07 156.33 20.45 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 120.495 -1.378 . . . . 0.0 111.594 172.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -120.42 -44.98 2.45 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . 0.562 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.0 OUTLIER -78.75 157.14 28.56 Favored 'General case' 0 CA--C 1.499 -1.018 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.914 -176.629 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -88.62 110.05 20.61 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.863 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . 0.507 ' C ' ' HD3' ' A' 1025 ' ' ARG . . . 57.51 176.77 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 O-C-N 125.223 1.577 . . . . 0.0 113.71 174.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.563 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 36.9 m95 -89.53 120.66 31.02 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 113.905 -1.498 . . . . 0.0 107.291 176.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 36.7 m -125.64 145.28 50.22 Favored 'General case' 0 C--N 1.295 -1.77 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 -176.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -73.21 135.03 44.52 Favored 'General case' 0 C--N 1.301 -1.536 0 CA-C-O 121.691 0.757 . . . . 0.0 110.044 -174.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -85.72 133.36 34.01 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 114.195 -1.366 . . . . 0.0 111.608 -170.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.555 ' HA ' HG21 ' A' ' 988' ' ' VAL . 1.8 pp -114.22 21.85 6.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.024 177.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -104.39 30.5 5.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.856 0.836 . . . . 0.0 108.798 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.518 ' HB2' HG12 ' A' ' 988' ' ' VAL . 78.1 mtp180 -136.84 -179.52 5.75 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 -178.282 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -81.34 84.17 6.71 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 171.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.555 HG21 ' HA ' ' A' ' 984' ' ' ILE . 11.9 m -115.5 -178.78 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 122.485 1.136 . . . . 0.0 113.928 -173.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . 0.514 ' HB3' ' H ' ' A' ' 993' ' ' TRP . 3.7 t70 -74.15 179.12 4.62 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 112.727 -2.033 . . . . 0.0 108.67 178.094 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.49 -31.56 69.47 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 118.768 0.713 . . . . 0.0 111.967 178.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -102.06 -44.65 5.4 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.169 -174.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 139.19 75.37 0.05 OUTLIER Glycine 0 CA--C 1.489 -1.534 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.899 176.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.556 ' HA ' ' HB3' ' A' 1021 ' ' ARG . 72.2 m95 -139.45 179.68 6.41 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.53 ' HG3' ' CE3' ' A' 1008 ' ' TRP . 6.9 pt-20 -143.15 153.54 42.97 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 122.285 1.04 . . . . 0.0 110.917 -177.308 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.763 ' O ' ' HA ' ' A' 1008 ' ' TRP . 9.6 t80 -81.99 104.44 12.35 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 112.777 -2.011 . . . . 0.0 112.272 -173.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . 0.451 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -128.78 116.8 2.32 Favored Glycine 0 C--O 1.216 -0.995 0 C-N-CA 118.478 -1.82 . . . . 0.0 112.667 172.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.804 HD11 ' HE1' ' A' 1015 ' ' TYR . 0.5 OUTLIER -109.18 149.61 12.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 O-C-N 120.349 -1.677 . . . . 0.0 109.461 -179.157 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 33.1 m -138.27 115.86 11.33 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 174.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.407 ' HA ' ' HD3' ' A' 1000 ' ' PRO . 2.6 mp -100.42 108.13 51.44 Favored Pre-proline 0 C--N 1.305 -1.326 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 177.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1000 ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 999' ' ' ILE . 16.2 Cg_exo -68.32 150.3 76.1 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.519 2.146 . . . . 0.0 113.057 -175.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -89.33 148.33 23.77 Favored 'Cis proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.474 -1.886 . . . . 0.0 112.474 -2.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 13.4 t70 -164.05 -89.16 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.419 -1.718 . . . . 0.0 109.032 177.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 159.32 -76.85 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.0 1.32 . . . . 0.0 109.925 -177.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 90.8 mttt -126.42 150.59 70.82 Favored Pre-proline 0 N--CA 1.447 -0.589 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.049 -172.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -63.85 147.07 92.33 Favored 'Trans proline' 0 C--O 1.239 0.571 0 C-N-CA 123.555 2.837 . . . . 0.0 110.425 170.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -93.89 -50.73 5.2 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 20.7 m -102.06 152.15 21.31 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 112.774 -2.012 . . . . 0.0 112.543 -172.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.763 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 67.3 m95 -135.22 137.09 42.28 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.214 -1.357 . . . . 0.0 107.929 -178.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.519 ' N ' ' HB3' ' A' ' 995' ' ' TYR . 20.9 t -136.63 -109.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.864 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 -175.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -167.44 -31.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 118.65 0.659 . . . . 0.0 110.939 -171.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -72.16 -169.44 0.5 Allowed 'General case' 0 C--O 1.237 0.433 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.452 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.2 tp10 -150.0 105.95 3.45 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.528 -172.336 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.402 ' O ' ' HB2' ' A' 1016 ' ' HIS . 87.4 mttt -115.0 139.15 50.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.761 -1.108 . . . . 0.0 109.456 176.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1014 ' ' MET . . . . . 0.418 ' HA ' ' NH2' ' A' ' 940' ' ' ARG . 24.4 ttt -45.92 -32.56 2.76 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1015 ' ' TYR . . . . . 0.804 ' HE1' HD11 ' A' ' 997' ' ' ILE . 40.5 p90 -74.79 5.27 5.16 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 118.794 -1.162 . . . . 0.0 111.366 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.578 ' HB3' ' CH2' ' A' ' 946' ' ' TRP . 0.6 OUTLIER -60.02 118.35 6.18 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.535 171.282 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 21.1 p -110.5 -13.04 14.31 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.081 174.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 27.0 m80 -140.5 147.52 39.69 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 122.653 1.216 . . . . 0.0 113.265 -174.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -151.47 144.87 24.8 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 176.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.678 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 98.0 mtt180 -138.27 168.79 19.0 Favored 'General case' 0 CA--C 1.466 -2.252 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -179.137 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.556 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 30.3 ptt180 -154.16 153.64 32.15 Favored 'General case' 0 C--N 1.284 -2.281 0 O-C-N 124.677 1.235 . . . . 0.0 108.007 168.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.446 ' HG2' HG12 ' A' 1024 ' ' VAL . 41.8 ttm180 -91.51 115.65 28.22 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 123.558 0.536 . . . . 0.0 109.837 179.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.515 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 81.3 mt -90.12 125.19 35.35 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 169.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.474 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 17.6 m -112.83 153.45 14.42 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.866 0 CA-C-O 121.776 0.798 . . . . 0.0 111.33 -174.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.523 ' HG3' ' HB2' ' A' ' 977' ' ' ASP . 31.3 ttp180 -158.83 110.28 2.14 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-N 112.798 -2.001 . . . . 0.0 109.691 168.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.639 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.7 tmmm? -76.0 149.52 37.58 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -178.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.59 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 7.4 ptm180 -136.17 139.41 42.83 Favored 'General case' 0 C--O 1.204 -1.336 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -169.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.515 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 30.2 ttmt -125.74 135.83 52.5 Favored 'General case' 0 C--N 1.283 -2.283 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.078 -173.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.573 ' C ' ' H ' ' A' 1031 ' ' LEU . 35.3 ttmt -88.34 -21.02 24.59 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 123.571 1.653 . . . . 0.0 107.781 -177.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 3.2 t70 53.65 -2.92 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 111.135 -2.757 . . . . 0.0 114.127 -170.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1031 ' ' LEU . . . . . 0.573 ' H ' ' C ' ' A' 1029 ' ' LYS . 15.9 tp 61.68 16.31 7.66 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 125.905 1.682 . . . . 0.0 111.305 178.078 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 13.5 t -123.09 3.45 9.31 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -179.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 13.9 tt0 . . . . . 0 N--CA 1.438 -1.038 0 CA-C-N 113.852 -1.522 . . . . 0.0 107.141 -178.966 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . 0.507 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 20.1 m-70 . . . . . 0 CA--C 1.5 -0.975 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -161.92 116.79 1.94 Allowed 'General case' 0 N--CA 1.413 -2.312 0 N-CA-C 102.267 -3.234 . . . . 0.0 102.267 172.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -142.29 138.65 31.48 Favored 'General case' 0 C--N 1.282 -2.337 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 175.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . 0.409 ' O ' ' HG2' ' A' 1027 ' ' ARG . 84.4 t80 -131.13 139.55 49.83 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.538 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 33.3 m -78.75 123.0 26.73 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -99.79 159.72 14.85 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 -173.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -154.51 156.25 36.33 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 119.589 -0.845 . . . . 0.0 111.492 -171.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . 0.51 ' O ' ' HA ' ' A' 1022 ' ' ARG . 14.2 p -150.37 177.4 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 N-CA-C 106.768 -1.568 . . . . 0.0 106.768 175.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' 1021 ' ' ARG . 78.7 m-85 -138.28 151.22 47.4 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.405 ' O ' ' HA ' ' A' 1020 ' ' ARG . 28.0 tt0 -120.34 124.83 46.51 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 -177.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -117.79 149.71 40.34 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.528 0.68 . . . . 0.0 111.849 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.608 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 38.9 mt-10 -144.0 159.33 42.78 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 125.306 1.442 . . . . 0.0 107.44 175.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 46.1 m -142.3 142.63 32.56 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.452 0.644 . . . . 0.0 111.777 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.47 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 17.8 ptt180 -141.78 161.07 38.86 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -176.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -67.68 152.67 96.09 Favored Pre-proline 0 C--N 1.311 -1.103 0 N-CA-C 105.291 -2.114 . . . . 0.0 105.291 170.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . 0.533 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 40.8 Cg_exo -60.59 90.37 0.09 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.636 1.558 . . . . 0.0 112.131 176.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 101.44 68.58 0.83 Allowed Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -157.98 -123.15 0.72 Allowed Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.176 -1.012 . . . . 0.0 111.106 -175.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -145.98 131.03 18.28 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.77 -0.715 . . . . 0.0 109.928 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.608 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 51.2 m95 -72.35 141.3 48.79 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.942 0.877 . . . . 0.0 109.448 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -125.02 149.66 64.07 Favored Pre-proline 0 C--N 1.289 -2.032 0 N-CA-C 101.955 -3.35 . . . . 0.0 101.955 175.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.517 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 31.8 Cg_exo -56.39 152.01 41.85 Favored 'Trans proline' 0 C--N 1.323 -0.787 0 C-N-CA 121.394 1.396 . . . . 0.0 111.697 -177.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -70.07 -171.55 0.45 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.121 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -105.98 -18.92 13.89 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -119.18 85.82 2.44 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 103.635 -2.728 . . . . 0.0 103.635 169.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 9.6 m -56.62 -54.0 51.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.032 -173.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 70.5 m-85 -105.73 134.22 49.2 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-O 121.666 0.746 . . . . 0.0 111.106 177.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 15.5 p -143.9 171.63 13.97 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.628 -171.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . 0.673 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 20.7 t0 -107.64 -176.23 3.01 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 106.187 -1.783 . . . . 0.0 106.187 178.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.05 -35.56 25.53 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -175.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -105.9 10.42 32.44 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 100.14 -1.9 56.41 Favored Glycine 0 CA--C 1.497 -1.091 0 C-N-CA 119.36 -1.4 . . . . 0.0 112.457 177.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . 0.673 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 23.9 t70 -51.48 101.95 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 O-C-N 124.791 0.936 . . . . 0.0 109.165 173.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -56.53 123.64 15.48 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.559 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -120.95 -179.88 4.16 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.817 -175.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -75.98 154.87 35.52 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 175.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 6.1 m -83.29 150.42 60.63 Favored Pre-proline 0 N--CA 1.431 -1.389 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.694 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 50.7 Cg_exo -42.71 -33.75 3.12 Favored 'Trans proline' 0 N--CA 1.48 0.686 0 C-N-CA 124.841 3.694 . . . . 0.0 117.324 -174.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 15.5 t -79.05 -43.62 23.85 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -66.8 -25.72 66.59 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.0 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.5 HD12 ' CH2' ' A' ' 980' ' ' TRP . 7.0 mt -66.3 110.43 3.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.398 0.618 . . . . 0.0 110.904 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.3 p -105.5 154.01 20.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.251 0.548 . . . . 0.0 112.211 -176.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 8.1 p -90.43 153.71 46.24 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.143 179.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.563 ' HG2' ' HB2' ' A' ' 973' ' ' TRP . 89.7 Cg_endo -77.58 168.89 21.89 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.05 1.833 . . . . 0.0 110.118 173.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -65.03 -9.75 22.84 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.111 1.874 . . . . 0.0 113.74 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.607 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -115.05 17.45 17.24 Favored Glycine 0 C--O 1.221 -0.665 0 C-N-CA 121.331 -0.462 . . . . 0.0 112.6 178.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.563 ' HB2' ' HG2' ' A' ' 970' ' ' PRO . 75.6 m95 -137.31 134.9 36.59 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-O 122.066 0.936 . . . . 0.0 110.133 175.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.65 ' HB3' ' O ' ' A' 1028 ' ' LYS . 8.7 tp10 -116.92 133.49 55.95 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-N 113.609 -1.632 . . . . 0.0 109.573 -169.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.654 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 65.9 m95 -82.39 100.26 9.9 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.422 -0.911 . . . . 0.0 109.911 174.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -74.44 -40.14 62.14 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.61 138.3 58.46 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 114.057 -1.428 . . . . 0.0 112.081 -177.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -52.39 -60.3 3.39 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 124.115 0.884 . . . . 0.0 111.953 176.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.5 154.72 8.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.99 -171.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.694 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 28.3 m95 -65.33 117.22 7.55 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -178.119 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 19.8 m -120.98 151.75 39.36 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 -173.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -73.52 133.17 43.54 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 119.055 0.843 . . . . 0.0 110.434 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . 0.435 ' HB2' HG12 ' A' 1024 ' ' VAL . 45.0 t0 -82.35 122.45 28.0 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.123 -172.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 31.2 pt -114.03 8.36 7.77 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.314 -177.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -93.38 33.27 1.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.809 0.814 . . . . 0.0 109.064 -175.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . 0.626 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 53.6 mtp180 -143.58 -176.25 4.89 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -176.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -84.79 78.65 9.84 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 172.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.414 HG21 ' O ' ' A' ' 983' ' ' ASP . 17.3 m -138.71 161.42 30.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.624 -175.154 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -55.58 169.34 0.32 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.293 1.037 . . . . 0.0 110.914 172.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -54.76 -33.6 61.49 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.479 0.657 . . . . 0.0 110.176 178.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . 0.496 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 86.4 mttt -98.38 9.07 43.94 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 115.092 -0.958 . . . . 0.0 112.106 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.68 -11.81 71.11 Favored Glycine 0 C--O 1.227 -0.314 0 N-CA-C 111.674 -0.57 . . . . 0.0 111.674 175.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . 0.662 ' HB3' ' CD ' ' A' 1019 ' ' ARG . 59.6 m95 -54.16 138.97 36.92 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.536 -0.832 . . . . 0.0 112.91 178.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' 1020 ' ' ARG . 31.2 mt-10 -113.48 155.56 25.12 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.437 0.637 . . . . 0.0 111.462 -177.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.628 ' O ' ' HA ' ' A' 1008 ' ' TRP . 15.1 t80 -77.46 100.53 6.05 Favored 'General case' 0 C--O 1.209 -1.074 0 C-N-CA 127.08 2.152 . . . . 0.0 111.329 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -126.59 97.84 0.5 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 119.056 -1.545 . . . . 0.0 113.218 173.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.594 HG22 ' HD2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -97.75 146.7 7.41 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 O-C-N 120.628 -1.513 . . . . 0.0 107.179 178.869 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 25.0 m -115.12 79.03 1.22 Allowed 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.719 0.771 . . . . 0.0 109.418 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.482 ' HA ' ' HD3' ' A' 1000 ' ' PRO . 2.0 pp -72.98 125.46 91.07 Favored Pre-proline 0 N--CA 1.447 -0.586 0 CA-C-N 114.592 -1.186 . . . . 0.0 111.846 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1000 ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 999' ' ' ILE . 2.7 Cg_exo -71.31 143.34 43.3 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.401 2.067 . . . . 0.0 114.183 -177.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1001 ' ' PRO . . . . . 0.444 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.9 Cg_endo -97.27 137.31 3.94 Favored 'Cis proline' 0 N--CA 1.444 -1.384 0 C-N-CA 122.973 -1.678 . . . . 0.0 112.873 -3.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 3.9 t70 -177.18 177.92 1.17 Allowed 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 112.312 -2.222 . . . . 0.0 106.507 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 10.7 m170 -119.61 -43.51 2.58 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 82.1 mttt -125.15 150.6 67.42 Favored Pre-proline 0 C--N 1.307 -1.249 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.128 -174.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1005 ' ' PRO . . . . . 0.509 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 77.0 Cg_exo -57.7 124.6 16.42 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.335 2.023 . . . . 0.0 110.305 171.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 41.5 pttt -112.14 11.18 20.32 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 121.918 0.866 . . . . 0.0 109.726 -177.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 46.8 t -148.85 140.98 23.94 Favored 'General case' 0 N--CA 1.431 -1.386 0 CA-C-N 114.611 -1.177 . . . . 0.0 107.933 -176.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.628 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 47.1 m95 -138.76 141.82 38.83 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.229 0.956 . . . . 0.0 108.836 -178.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.82 HG11 ' H ' ' A' 1010 ' ' ALA . 21.5 t -152.14 -165.08 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 102.933 -2.988 . . . . 0.0 102.933 -176.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1010 ' ' ALA . . . . . 0.82 ' H ' HG11 ' A' 1009 ' ' VAL . . . -101.67 -32.92 10.09 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 120.112 1.324 . . . . 0.0 112.554 -179.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -68.64 122.81 19.29 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -167.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.52 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 3.0 tp10 -70.98 117.91 13.08 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 171.127 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.416 ' HD3' ' HE2' ' A' ' 995' ' ' TYR . 56.5 mtpt -115.34 151.95 33.69 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 173.093 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 25.6 ttt -49.48 -44.6 46.04 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 124.442 1.089 . . . . 0.0 111.677 174.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1015 ' ' TYR . . . . . 0.533 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 88.4 m-85 -65.32 7.44 0.21 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.594 ' HD2' HG22 ' A' ' 997' ' ' ILE . 6.2 m170 -66.79 114.16 5.45 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 121.86 0.838 . . . . 0.0 112.366 176.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.31 -35.19 11.32 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-N 112.852 -1.976 . . . . 0.0 108.156 177.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 25.6 m170 -136.31 154.29 50.91 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.104 -174.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1019 ' ' ARG . . . . . 0.662 ' CD ' ' HB3' ' A' ' 993' ' ' TRP . 9.1 ttm180 -160.44 147.16 15.64 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.405 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 2.2 ptm180 -151.06 154.73 37.56 Favored 'General case' 0 C--O 1.196 -1.743 0 C-N-CA 119.516 -0.874 . . . . 0.0 110.676 -177.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.566 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 23.2 ptt180 -135.25 149.29 49.82 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.563 -0.855 . . . . 0.0 111.428 -176.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.626 ' NH1' ' HD2' ' A' ' 986' ' ' ARG . 34.7 ttm180 -87.95 129.55 35.21 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 123.2 0.313 . . . . 0.0 110.512 178.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.461 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 61.6 mt -103.96 129.25 51.5 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 167.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.565 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 6.2 m -107.11 141.57 22.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.877 -174.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.536 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 9.9 tpt180 -137.46 106.11 5.87 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.164 170.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.0 tmmm? -72.5 135.85 45.77 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.654 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.2 ptm180 -131.56 134.43 46.07 Favored 'General case' 0 C--O 1.204 -1.333 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -172.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.65 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.1 ttmt -125.03 137.88 54.22 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 -173.058 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.607 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.9 ttmt -91.13 -17.74 25.65 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 124.053 1.882 . . . . 0.0 106.978 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1030 ' ' ASP . . . . . 0.435 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 15.6 t70 60.99 -0.41 0.32 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 111.347 -2.66 . . . . 0.0 111.624 -171.381 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1031 ' ' LEU . . . . . 0.565 ' H ' ' C ' ' A' 1029 ' ' LYS . 29.6 tp 72.58 -2.68 2.57 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 127.02 2.128 . . . . 0.0 112.56 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 10.3 t -119.62 -1.8 10.56 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -177.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.455 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 26.5 tt0 . . . . . 0 N--CA 1.431 -1.395 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.438 -178.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 927' ' ' HIS . . . . . 0.428 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 3.1 m-70 . . . . . 0 CA--C 1.482 -1.667 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.48 131.25 55.0 Favored 'General case' 0 N--CA 1.413 -2.291 0 N-CA-C 105.85 -1.908 . . . . 0.0 105.85 160.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 929' ' ' GLU . . . . . 0.735 ' HG3' ' HZ3' ' A' 1026 ' ' LYS . 0.9 OUTLIER -143.81 147.56 34.3 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.348 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -140.89 143.89 34.94 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 176.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 931' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 24.8 m -75.32 130.53 39.2 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 120.769 0.319 . . . . 0.0 111.068 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -106.08 158.08 17.07 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 933' ' ' GLU . . . . . 0.894 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 10.6 pt-20 -149.46 156.54 42.16 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 118.54 0.609 . . . . 0.0 110.385 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 7.2 p -153.2 130.4 2.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-O 121.255 0.55 . . . . 0.0 109.944 170.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 935' ' ' TYR . . . . . 0.617 ' HA ' ' O ' ' A' 1021 ' ' ARG . 62.0 m-85 -80.34 147.09 31.24 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -176.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 936' ' ' GLN . . . . . 0.665 ' O ' ' HA ' ' A' 1020 ' ' ARG . 32.9 tt0 -116.27 111.66 20.47 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -110.56 142.19 42.72 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.811 0.815 . . . . 0.0 112.328 -172.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.585 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 49.3 mt-10 -141.78 162.11 36.28 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 113.806 -1.543 . . . . 0.0 107.196 173.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 939' ' ' SER . . . . . 0.668 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 25.4 p -150.23 157.72 43.39 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 121.7 0.762 . . . . 0.0 111.995 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 940' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 30.9 ptt180 -149.95 158.56 44.29 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 113.459 -1.7 . . . . 0.0 108.029 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -76.56 166.51 44.33 Favored Pre-proline 0 C--N 1.308 -1.212 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 168.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -65.75 90.74 0.24 Allowed 'Trans proline' 0 N--CA 1.449 -1.104 0 N-CA-C 108.576 -1.356 . . . . 0.0 108.576 168.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.39 -8.45 5.93 Favored Glycine 0 N--CA 1.435 -1.424 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -172.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 944' ' ' GLY . . . . . 0.533 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -103.44 -177.8 26.14 Favored Glycine 0 C--N 1.341 0.809 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 -178.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -118.89 163.21 17.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 120.795 2.297 . . . . 0.0 106.969 172.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 946' ' ' TRP . . . . . 0.585 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 42.3 m95 -64.45 135.65 56.29 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.955 0.883 . . . . 0.0 112.656 -172.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -138.84 171.82 7.56 Favored Pre-proline 0 C--N 1.309 -1.173 0 N-CA-C 103.394 -2.817 . . . . 0.0 103.394 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -52.21 124.07 14.06 Favored 'Trans proline' 0 C--O 1.234 0.322 0 CA-C-N 121.806 1.681 . . . . 0.0 110.76 176.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 949' ' ' ALA . . . . . 0.668 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -51.88 -68.43 0.17 Allowed 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -174.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.455 ' CG ' ' H ' ' A' ' 951' ' ' ASP . 7.2 pt-20 -168.18 -50.59 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 104.793 -2.299 . . . . 0.0 104.793 -172.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 951' ' ' ASP . . . . . 0.455 ' H ' ' CG ' ' A' ' 950' ' ' GLU . 23.2 m-20 -132.48 125.94 31.82 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 104.216 -2.513 . . . . 0.0 104.216 171.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 20.0 m -65.7 -58.64 5.23 Favored 'General case' 0 C--N 1.313 -1.002 0 O-C-N 123.329 0.393 . . . . 0.0 111.698 -174.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 953' ' ' TYR . . . . . 0.489 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 76.4 m-85 -102.25 132.21 48.33 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.381 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 69.9 p -142.23 177.78 8.01 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.817 0.817 . . . . 0.0 110.829 -172.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -100.68 171.47 7.68 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 105.291 -2.115 . . . . 0.0 105.291 174.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.12 -36.18 39.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.468 0.576 . . . . 0.0 111.5 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -75.81 -39.98 55.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.219 0.533 . . . . 0.0 110.66 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 133.51 -6.79 4.94 Favored Glycine 0 CA--C 1.493 -1.287 0 C-N-CA 120.499 -0.857 . . . . 0.0 112.053 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -58.37 105.28 0.27 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 176.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 960' ' ' LYS . . . . . 0.567 ' HZ3' ' HB3' ' A' ' 960' ' ' LYS . 7.0 ttpm? -50.84 128.24 20.5 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.718 0.771 . . . . 0.0 111.525 176.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -115.39 -172.4 2.14 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.361 -1.29 . . . . 0.0 108.089 -177.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -82.0 159.05 23.61 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.62 152.24 72.35 Favored Pre-proline 0 N--CA 1.433 -1.286 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 177.262 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 964' ' ' PRO . . . . . 0.548 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 6.1 Cg_exo -45.5 -35.41 12.24 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 124.441 3.427 . . . . 0.0 114.917 -178.353 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 19.5 m -75.26 -46.87 30.9 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -69.0 -5.09 19.6 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.905 0.882 . . . . 0.0 112.414 174.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 967' ' ' LEU . . . . . 0.452 HD12 ' CH2' ' A' ' 980' ' ' TRP . 13.9 mt -90.85 114.7 27.18 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.947 0.403 . . . . 0.0 110.271 -178.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 34.5 p -117.26 172.95 6.96 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.21 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 969' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 6.2 p -95.6 141.43 23.18 Favored Pre-proline 0 C--N 1.319 -0.719 0 CA-C-O 120.938 0.399 . . . . 0.0 111.375 -178.38 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 970' ' ' PRO . . . . . 0.549 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 42.0 Cg_endo -84.55 170.34 10.4 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.368 2.712 . . . . 0.0 112.716 -178.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -64.36 102.7 0.4 Allowed 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 122.05 1.833 . . . . 0.0 110.415 174.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 972' ' ' GLY . . . . . 0.642 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 126.13 -7.12 7.67 Favored Glycine 0 N--CA 1.433 -1.507 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 973' ' ' TRP . . . . . 0.549 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.2 m95 -135.62 138.19 42.66 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 122.246 1.022 . . . . 0.0 111.395 -177.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 974' ' ' GLU . . . . . 0.501 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 9.4 tp10 -129.53 145.6 51.44 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 126.55 1.94 . . . . 0.0 108.932 -171.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 975' ' ' TRP . . . . . 0.67 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 89.2 m95 -84.73 153.85 22.79 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.826 0.822 . . . . 0.0 112.03 174.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 976' ' ' GLU . . . . . 0.717 ' HB2' ' HD2' ' A' 1028 ' ' LYS . 40.3 tt0 -129.01 -37.27 1.71 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.215 177.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -74.54 151.99 39.4 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.022 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.24 -30.2 18.68 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -165.4 141.34 5.32 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.524 0.602 . . . . 0.0 111.749 -173.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 980' ' ' TRP . . . . . 0.554 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 36.2 m95 -63.21 123.88 19.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.055 -0.975 . . . . 0.0 108.537 -178.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 981' ' ' SER . . . . . 0.727 ' O ' ' HA ' ' A' 1023 ' ' LEU . 15.0 m -116.29 -165.51 1.06 Allowed 'General case' 0 C--O 1.203 -1.36 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 -175.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -119.69 148.22 43.65 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 120.604 1.547 . . . . 0.0 110.624 177.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -96.19 116.14 28.53 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.078 0.466 . . . . 0.0 109.83 -174.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.576 ' HA ' HG21 ' A' ' 988' ' ' VAL . 26.9 pt -106.26 15.83 6.98 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.452 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -96.7 38.41 1.22 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.259 1.028 . . . . 0.0 108.8 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 40.4 mtt180 -140.82 -176.74 4.78 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 -175.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.01 85.73 6.68 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 171.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 988' ' ' VAL . . . . . 0.576 HG21 ' HA ' ' A' ' 984' ' ' ILE . 23.0 m -135.83 150.79 28.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.967 -176.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 989' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' 1011 ' ' ALA . 21.2 t70 -52.81 169.09 0.1 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.823 171.203 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -55.32 -34.08 63.89 Favored 'General case' 0 CA--C 1.507 -0.701 0 C-N-CA 123.369 0.668 . . . . 0.0 111.869 178.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -95.97 11.73 32.92 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.51 -177.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 69.62 77.72 0.41 Allowed Glycine 0 N--CA 1.432 -1.581 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.687 -179.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -147.0 129.11 15.58 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 994' ' ' GLU . . . . . 0.509 ' HB2' ' HB3' ' A' 1008 ' ' TRP . 3.7 pt-20 -103.24 154.02 19.78 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 177.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 995' ' ' TYR . . . . . 0.857 ' HB3' ' HA ' ' A' 1011 ' ' ALA . 0.5 OUTLIER -110.02 127.8 55.03 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.502 -172.47 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 996' ' ' GLY . . . . . 0.457 ' HA2' ' O ' ' A' 1007 ' ' SER . . . -127.29 141.21 12.45 Favored Glycine 0 N--CA 1.422 -2.297 0 CA-C-N 113.95 -1.477 . . . . 0.0 109.731 176.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 997' ' ' ILE . . . . . 0.611 HG21 ' HA ' ' A' 1016 ' ' HIS . 1.0 OUTLIER -121.41 138.7 50.91 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 C-N-CA 122.387 0.275 . . . . 0.0 110.507 -179.808 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.1 t -145.01 150.26 36.57 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.4 mp -108.11 100.64 37.66 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 176.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1000 ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 48.9 Cg_endo -70.5 134.27 26.05 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.343 2.028 . . . . 0.0 113.42 -175.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1001 ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.7 Cg_endo -94.81 150.04 10.41 Favored 'Cis proline' 0 N--CA 1.445 -1.339 0 C-N-CA 122.919 -1.701 . . . . 0.0 113.572 -1.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 27.9 t70 -149.43 -86.49 0.08 Allowed 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 112.964 -1.925 . . . . 0.0 107.164 176.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1003 ' ' HIS . . . . . 0.417 ' HB2' ' H ' ' A' 1004 ' ' LYS . 31.9 m-70 -158.87 -82.81 0.05 OUTLIER 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 170.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1004 ' ' LYS . . . . . 0.417 ' H ' ' HB2' ' A' 1003 ' ' HIS . 63.6 mttp -150.92 160.76 31.64 Favored Pre-proline 0 N--CA 1.439 -1.015 0 CA-C-N 113.937 -1.483 . . . . 0.0 109.073 177.426 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -56.28 143.61 85.02 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.801 2.334 . . . . 0.0 111.052 168.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -124.75 12.21 8.51 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 122.321 1.058 . . . . 0.0 108.174 -175.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1007 ' ' SER . . . . . 0.457 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 33.2 t -135.96 126.28 26.58 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 114.173 -1.376 . . . . 0.0 107.755 -173.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1008 ' ' TRP . . . . . 0.61 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 55.2 m95 -136.74 132.54 34.97 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 124.211 0.944 . . . . 0.0 108.489 -178.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.654 HG11 ' H ' ' A' 1010 ' ' ALA . 3.8 t -151.18 -178.08 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 -171.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1010 ' ' ALA . . . . . 0.654 ' H ' HG11 ' A' 1009 ' ' VAL . . . -65.53 109.71 2.45 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 119.016 0.825 . . . . 0.0 109.64 175.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1011 ' ' ALA . . . . . 0.857 ' HA ' ' HB3' ' A' ' 995' ' ' TYR . . . -52.73 108.53 0.32 Allowed 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 124.069 0.948 . . . . 0.0 112.234 -178.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1012 ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' A' 1013 ' ' LYS . 13.1 pt-20 -128.6 -48.29 1.27 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 178.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1013 ' ' LYS . . . . . 0.443 ' N ' ' HG3' ' A' 1012 ' ' GLU . 15.4 ptmt -78.06 147.56 34.68 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -168.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 24.7 ttt -62.49 -40.72 97.6 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 175.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -68.62 2.92 2.11 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -175.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1016 ' ' HIS . . . . . 0.655 ' CG ' ' HB2' ' A' ' 995' ' ' TYR 0.315 14.2 p-80 -82.84 128.13 34.12 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 116.0 -2.28 . . . . 0.0 111.202 174.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 73.7 p -101.42 -11.51 19.31 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.245 -166.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -139.95 143.69 36.68 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -176.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -142.5 152.58 42.82 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 175.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1020 ' ' ARG . . . . . 0.665 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 2.2 ptp180 -155.32 167.51 30.13 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 175.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1021 ' ' ARG . . . . . 0.617 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 27.7 ptt180 -150.15 153.56 36.55 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.061 175.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1022 ' ' ARG . . . . . 0.894 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 26.7 ttm180 -86.65 115.19 23.95 Favored 'General case' 0 N--CA 1.427 -1.596 0 O-C-N 123.864 0.727 . . . . 0.0 109.479 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1023 ' ' LEU . . . . . 0.727 ' HA ' ' O ' ' A' ' 981' ' ' SER . 76.1 mt -85.94 127.32 34.59 Favored 'General case' 0 N--CA 1.421 -1.88 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 169.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1024 ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 10.2 m -104.08 133.36 48.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.491 -173.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1025 ' ' ARG . . . . . 0.536 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.9 tpt180 -141.04 102.52 4.27 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.247 171.296 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1026 ' ' LYS . . . . . 0.735 ' HZ3' ' HG3' ' A' ' 929' ' ' GLU . 0.5 OUTLIER -76.23 145.54 39.67 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 -179.043 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 1027 ' ' ARG . . . . . 0.67 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 5.9 ptm180 -136.39 157.84 45.85 Favored 'General case' 0 C--O 1.208 -1.092 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 -171.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1028 ' ' LYS . . . . . 0.717 ' HD2' ' HB2' ' A' ' 976' ' ' GLU . 21.2 ptmt -141.91 151.34 42.55 Favored 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -174.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1029 ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.6 ttmt -89.49 -20.33 23.98 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-O 123.304 1.526 . . . . 0.0 106.955 177.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1030 ' ' ASP . . . . . 0.429 ' HB2' ' HE2' ' A' 1028 ' ' LYS . 33.9 t70 54.93 -0.49 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 111.402 -2.635 . . . . 0.0 113.101 -172.29 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1031 ' ' LEU . . . . . 0.563 ' H ' ' C ' ' A' 1029 ' ' LYS . 12.2 tp 66.35 6.11 4.11 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 126.489 1.916 . . . . 0.0 110.582 -178.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 18.1 p -105.83 -8.19 17.87 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-O 121.947 0.879 . . . . 0.0 109.42 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1033 ' ' GLN . . . . . 0.501 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 0.8 OUTLIER . . . . . 0 C--N 1.323 -0.573 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.265 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 49.2 mm . . . . . 0 C--O 1.236 0.347 0 CA-C-O 121.474 0.654 . . . . 0.0 109.794 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -139.47 154.2 71.36 Favored Pre-proline 0 C--N 1.32 -0.686 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 172.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -86.13 20.88 1.16 Allowed 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.227 1.951 . . . . 0.0 113.859 -177.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -107.73 -38.78 5.77 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.207 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 13.2 t -113.15 156.6 22.93 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 173.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -90.0 96.91 10.89 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -73.53 86.83 1.59 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -146.69 -60.62 0.3 Allowed 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.477 -1.238 . . . . 0.0 107.781 173.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -65.23 92.96 0.15 Allowed Glycine 0 CA--C 1.499 -0.949 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . 0.263 95.6 m-70 -179.19 -46.13 0.01 OUTLIER 'General case' 0 CA--C 1.479 -1.755 0 N-CA-C 104.918 -2.253 . . . . 0.0 104.918 -170.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 928' ' ' THR . . . . . 0.523 HG23 ' HH2' ' A' ' 973' ' ' TRP . 1.5 m 62.76 89.41 0.09 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 125.301 1.625 . . . . 0.0 108.196 -171.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.535 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.5 OUTLIER -128.69 128.87 44.94 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 106.816 -1.549 . . . . 0.0 106.816 174.754 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . 0.463 ' O ' ' HG2' ' A' 1027 ' ' ARG . 87.2 t80 -121.78 136.3 54.93 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 121.495 -0.753 . . . . 0.0 109.058 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 23.4 m -69.57 120.21 15.01 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 176.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -94.98 146.81 23.99 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.745 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.3 pt-20 -152.86 158.08 41.65 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 118.436 0.562 . . . . 0.0 111.229 -169.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 3.7 p -160.53 129.37 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.408 0.623 . . . . 0.0 111.137 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.639 ' HA ' ' O ' ' A' 1021 ' ' ARG . 50.5 m-85 -88.94 112.66 23.59 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.786 -176.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -85.81 142.8 28.67 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . 1.051 ' HB3' ' HB3' ' A' 1020 ' ' ARG . 0.0 OUTLIER -144.44 162.22 37.07 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -178.329 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.604 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 44.8 mt-10 -131.18 162.2 30.48 Favored 'General case' 0 C--O 1.246 0.91 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 16.6 t -135.16 146.25 48.57 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.203 176.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.533 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 18.1 ptt180 -152.58 162.42 41.25 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -176.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -67.49 152.58 96.08 Favored Pre-proline 0 C--N 1.31 -1.141 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 171.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -56.89 94.42 0.06 OUTLIER 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 122.1 1.866 . . . . 0.0 112.98 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 94.07 65.44 1.03 Allowed Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 108.071 -2.012 . . . . 0.0 108.071 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -159.33 -156.4 8.06 Favored Glycine 0 N--CA 1.435 -1.418 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.349 -173.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -105.27 125.17 50.69 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.321 -0.94 . . . . 0.0 110.04 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.604 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 56.5 m95 -80.14 147.89 31.18 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-O 121.619 0.724 . . . . 0.0 109.9 -177.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -128.66 171.33 8.81 Favored Pre-proline 0 C--N 1.298 -1.667 0 N-CA-C 103.475 -2.787 . . . . 0.0 103.475 174.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -59.17 135.97 69.56 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 CA-C-N 121.245 1.48 . . . . 0.0 109.801 175.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -58.9 174.06 0.38 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.976 0.893 . . . . 0.0 112.338 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -69.63 -38.47 77.2 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.189 -1.368 . . . . 0.0 107.494 -178.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -122.4 104.23 9.26 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 104.64 -2.356 . . . . 0.0 104.64 170.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 17.5 m -68.02 -52.84 30.9 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -172.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -97.58 125.2 42.17 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.175 173.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 13.0 p -140.9 173.28 11.64 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.681 -171.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -94.68 167.07 11.69 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 171.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.0 -28.84 18.4 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.765 0.711 . . . . 0.0 112.2 177.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -82.05 -39.76 23.01 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.22 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 139.86 -10.75 3.12 Favored Glycine 0 CA--C 1.498 -0.991 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.888 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -60.51 109.23 0.96 Allowed 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 121.193 0.52 . . . . 0.0 110.494 177.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . 0.427 ' HD3' ' N ' ' A' ' 961' ' ' ALA . 9.5 tmtt? -47.52 126.57 10.04 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.581 -1.645 . . . . 0.0 110.698 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.427 ' N ' ' HD3' ' A' ' 960' ' ' LYS . . . -122.74 173.57 7.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.731 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -69.08 160.87 30.21 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.874 0.369 . . . . 0.0 110.337 178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.95 153.95 41.88 Favored Pre-proline 0 N--CA 1.435 -1.199 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -177.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.54 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.4 Cg_exo -47.18 -33.16 15.18 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 124.51 3.473 . . . . 0.0 115.866 -178.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.2 p -71.22 -45.0 64.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.879 0.847 . . . . 0.0 110.182 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -64.47 -27.43 68.98 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.42 -1.263 . . . . 0.0 110.285 175.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 81.2 mt -74.36 110.66 8.82 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 122.072 0.939 . . . . 0.0 110.11 176.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.3 p -129.01 165.11 21.79 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.99 -172.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 12.0 p -81.09 128.2 71.69 Favored Pre-proline 0 N--CA 1.441 -0.916 0 CA-C-O 121.239 0.542 . . . . 0.0 110.638 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.597 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 58.8 Cg_endo -82.27 165.73 16.57 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.562 2.174 . . . . 0.0 109.722 175.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -59.23 112.19 1.15 Allowed 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 121.551 1.501 . . . . 0.0 110.112 173.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.456 ' HA3' HG21 ' A' 1034 ' ' THR . . . 114.04 -4.18 23.97 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.83 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.597 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 92.9 m95 -126.18 132.9 51.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 122.225 1.012 . . . . 0.0 111.793 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.662 ' HB2' HE22 ' A' 1033 ' ' GLN . 8.1 tp10 -112.22 129.45 56.26 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 112.797 -2.001 . . . . 0.0 108.162 -175.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.507 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 94.1 m95 -70.85 138.81 50.58 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.644 -1.222 . . . . 0.0 111.129 172.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . 0.602 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 9.8 tp10 -100.88 -47.59 4.74 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.003 -0.999 . . . . 0.0 108.543 -177.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . 0.578 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.8 m-20 -85.88 161.09 19.23 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.155 -177.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -93.17 108.97 20.47 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.377 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . 0.507 ' C ' ' HD3' ' A' 1025 ' ' ARG . . . 55.49 178.05 0.03 OUTLIER 'General case' 0 C--O 1.234 0.254 0 CA-C-O 122.72 1.248 . . . . 0.0 113.491 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.56 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 51.9 m95 -88.09 118.45 27.67 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 113.606 -1.634 . . . . 0.0 108.066 177.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 981' ' ' SER . . . . . 0.649 ' O ' ' HA ' ' A' 1023 ' ' LEU . 34.7 m -110.2 -165.05 0.97 Allowed 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 -177.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -112.89 145.41 40.75 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 121.242 1.837 . . . . 0.0 109.432 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.457 ' HB2' HG13 ' A' 1024 ' ' VAL . 55.3 t0 -86.56 120.15 27.57 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -175.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.3 pp -116.24 15.45 7.72 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.349 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -99.12 30.04 3.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 123.036 1.398 . . . . 0.0 108.257 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.494 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 70.3 mtp85 -138.68 174.05 10.94 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.584 -177.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -80.74 79.62 7.35 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 171.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.581 HG12 ' HG2' ' A' ' 994' ' ' GLU . 25.7 m -135.84 161.09 38.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.97 -175.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.34 168.65 0.34 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.633 0.583 . . . . 0.0 110.553 171.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -54.73 -34.66 62.77 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-O 120.903 0.383 . . . . 0.0 111.314 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -101.03 7.36 43.47 Favored 'General case' 0 N--CA 1.427 -1.618 0 C-N-CA 119.004 -1.079 . . . . 0.0 111.469 -178.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 100.87 -20.8 46.36 Favored Glycine 0 C--O 1.224 -0.494 0 CA-C-N 116.122 -0.49 . . . . 0.0 113.803 173.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 83.1 m95 -54.19 121.7 8.72 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.581 ' HG2' HG12 ' A' ' 988' ' ' VAL . 22.6 mt-10 -99.37 153.63 18.83 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.039 177.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.725 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 27.6 t80 -79.01 94.27 5.26 Favored 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 126.783 2.033 . . . . 0.0 111.918 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -110.17 96.53 0.94 Allowed Glycine 0 N--CA 1.435 -1.423 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 177.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.512 HD13 ' HB3' ' A' 1015 ' ' TYR . 1.1 tt -98.42 130.1 47.73 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.194 0 O-C-N 122.139 -0.624 . . . . 0.0 110.197 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 7.1 m -108.12 85.45 2.12 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.989 -178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 16.2 pt -78.68 121.28 83.37 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.21 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -69.94 135.67 30.62 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.05 1.833 . . . . 0.0 111.373 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -92.63 144.84 11.2 Favored 'Cis proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.23 -1.571 . . . . 0.0 114.331 -0.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 22.7 t0 163.33 155.64 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 112.176 -2.284 . . . . 0.0 105.994 177.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -99.55 -34.92 10.05 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.022 0.439 . . . . 0.0 110.339 -175.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1004 ' ' LYS . . . . . 0.513 ' H ' ' HD2' ' A' 1004 ' ' LYS . 0.0 OUTLIER -123.55 154.0 66.26 Favored Pre-proline 0 C--N 1.317 -0.829 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.172 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -58.49 127.75 25.83 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.25 2.634 . . . . 0.0 110.291 163.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 20.5 pttm -117.88 13.32 14.02 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.196 0.998 . . . . 0.0 109.608 178.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 29.9 t -143.54 136.1 27.24 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 113.908 -1.496 . . . . 0.0 107.766 -178.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.592 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 62.9 m95 -134.09 140.15 46.42 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 124.478 1.111 . . . . 0.0 108.966 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 92.8 t -140.51 157.77 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -83.03 8.76 11.88 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -121.23 134.78 55.2 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 121.278 -0.888 . . . . 0.0 111.603 -175.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.678 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.7 tp10 -69.56 105.1 2.54 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.52 ' H ' ' CE1' ' A' 1016 ' ' HIS . 95.0 mttt -109.26 147.15 33.08 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.743 -1.571 . . . . 0.0 108.47 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 26.5 ptt? -56.27 -36.09 68.19 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -178.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1015 ' ' TYR . . . . . 0.512 ' HB3' HD13 ' A' ' 997' ' ' ILE . 58.9 m-85 -60.93 -4.27 0.97 Allowed 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.725 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 2.6 m80 -54.67 108.03 0.35 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.63 -25.44 16.77 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 123.585 1.659 . . . . 0.0 106.912 173.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -141.71 150.73 42.22 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 111.865 -2.425 . . . . 0.0 109.466 -177.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.5 ' HB3' ' CD2' ' A' 1016 ' ' HIS . 35.2 ptt180 -151.87 141.77 22.03 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 171.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 1.051 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . 4.9 ptp180 -149.63 161.88 41.31 Favored 'General case' 0 CA--C 1.481 -1.687 0 C-N-CA 118.532 -1.267 . . . . 0.0 109.977 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.639 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.9 ptt180 -148.0 149.39 32.05 Favored 'General case' 0 C--N 1.298 -1.673 0 C-N-CA 119.431 -0.907 . . . . 0.0 110.969 -177.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.745 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 37.2 ttm180 -83.83 115.09 22.08 Favored 'General case' 0 N--CA 1.423 -1.806 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.455 -177.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.649 ' HA ' ' O ' ' A' ' 981' ' ' SER . 72.4 mt -80.44 129.66 34.66 Favored 'General case' 0 N--CA 1.425 -1.718 0 N-CA-C 105.179 -2.156 . . . . 0.0 105.179 166.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.457 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.6 m -111.83 133.63 56.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 CA-C-O 121.733 0.778 . . . . 0.0 112.721 -174.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.529 ' HG3' ' HB2' ' A' ' 977' ' ' ASP . 14.6 ttp180 -150.26 101.66 3.01 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 112.926 -1.943 . . . . 0.0 109.373 166.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.602 ' HE2' ' HG2' ' A' ' 976' ' ' GLU . 0.0 OUTLIER -79.43 154.21 29.11 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 -178.29 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.507 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 7.5 ptm180 -136.4 165.75 25.07 Favored 'General case' 0 CA--C 1.488 -1.432 0 N-CA-C 105.076 -2.194 . . . . 0.0 105.076 -170.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 30.4 ttmt -149.9 142.6 24.6 Favored 'General case' 0 C--N 1.281 -2.403 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 -172.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1029 ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -91.37 -13.2 32.89 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 123.568 1.651 . . . . 0.0 107.581 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 25.0 t0 52.69 23.35 2.64 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 111.454 -2.612 . . . . 0.0 110.225 -173.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 25.4 tp 66.38 -47.32 0.43 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.224 2.21 . . . . 0.0 113.284 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 14.6 t -79.02 -21.7 46.56 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -171.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.662 HE22 ' HB2' ' A' ' 974' ' ' GLU . 43.2 mt-30 -64.3 -59.36 4.48 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -175.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1034 ' ' THR . . . . . 0.456 HG21 ' HA3' ' A' ' 972' ' ' GLY . 0.7 OUTLIER -110.19 80.53 1.32 Allowed 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.758 0.789 . . . . 0.0 110.281 169.395 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -104.59 -34.02 8.33 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.006 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 50.6 m -112.09 146.88 37.2 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.413 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 28.9 m -116.49 152.88 33.17 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.6 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 29.9 m -70.56 109.81 5.06 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -88.9 113.35 24.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.282 0.563 . . . . 0.0 111.116 -177.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 . . . . . 0 C--N 1.316 -0.859 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 177.656 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . 0.507 HD12 ' H1 ' ' A' ' 918' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.531 0 CA-C-O 121.521 0.677 . . . . 0.0 109.825 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.42 139.41 89.39 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.833 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . 0.446 ' HB3' ' HB3' ' A' ' 923' ' ' ALA . 45.6 Cg_exo -40.73 102.74 0.04 OUTLIER 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 124.809 3.673 . . . . 0.0 112.846 178.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -49.06 -60.99 2.31 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 111.72 -2.491 . . . . 0.0 112.576 -174.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 15.4 t -112.34 -24.18 9.93 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.309 -177.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . 0.446 ' HB3' ' HB3' ' A' ' 920' ' ' PRO . . . -69.6 132.86 46.87 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 178.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -87.96 93.05 9.35 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -109.27 -75.66 0.63 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.076 0.465 . . . . 0.0 111.697 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -123.79 47.8 1.0 Allowed Glycine 0 CA--C 1.49 -1.529 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.533 ' HB2' ' OE1' ' A' ' 929' ' ' GLU . 79.7 m-70 -94.02 -28.99 15.45 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.116 -0.542 . . . . 0.0 110.254 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 928' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' A' 1029 ' ' LYS . 4.7 m 64.19 87.89 0.11 Allowed 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -167.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.689 ' HB3' ' HD3' ' A' 1028 ' ' LYS . 0.8 OUTLIER -121.67 168.02 12.26 Favored 'General case' 0 C--N 1.27 -2.863 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . 0.527 ' O ' ' HG2' ' A' 1027 ' ' ARG . 81.6 t80 -149.51 124.74 10.14 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -176.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 931' ' ' THR . . . . . . . . . . . . . 70.0 m -78.52 113.83 16.9 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 174.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -92.47 163.3 13.89 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 105.715 -1.958 . . . . 0.0 105.715 -174.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.59 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -164.28 142.31 7.01 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 120.265 -0.574 . . . . 0.0 109.791 -172.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.406 HG11 HD12 ' A' ' 967' ' ' LEU . 34.1 m -143.29 126.5 13.31 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 175.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.584 ' HA ' ' O ' ' A' 1021 ' ' ARG . 29.9 m-85 -84.18 149.47 26.13 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.67 -0.644 . . . . 0.0 110.164 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.534 ' O ' ' HA ' ' A' 1020 ' ' ARG . 13.3 tt0 -119.91 121.22 38.55 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -109.28 146.34 34.45 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.15 0.976 . . . . 0.0 112.666 -174.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.554 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 39.6 mt-10 -138.34 160.56 39.18 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 112.909 -1.95 . . . . 0.0 106.54 170.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 15.4 m -145.39 151.48 38.33 Favored 'General case' 0 C--N 1.311 -1.065 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -176.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.576 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 26.9 ptt180 -146.13 160.7 41.57 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.298 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -75.62 163.55 66.52 Favored Pre-proline 0 C--N 1.315 -0.928 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 169.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -68.5 89.22 0.41 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 CA-C-N 120.357 1.163 . . . . 0.0 109.993 172.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 129.41 -1.05 6.04 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 110.262 -1.135 . . . . 0.0 110.262 -174.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . 0.576 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -100.99 -171.93 28.77 Favored Glycine 0 CA--C 1.502 -0.749 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 177.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -122.5 154.84 37.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 119.204 1.502 . . . . 0.0 107.094 172.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.557 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 24.8 m95 -61.72 135.73 57.72 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.709 0.766 . . . . 0.0 112.302 -173.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -135.56 167.27 23.11 Favored Pre-proline 0 C--N 1.307 -1.256 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -49.16 128.42 19.71 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.496 2.13 . . . . 0.0 112.931 -179.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -74.32 -162.31 0.15 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.543 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -89.7 -52.92 4.75 Favored 'General case' 0 CA--C 1.483 -1.603 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -109.17 92.06 3.9 Favored 'General case' 0 N--CA 1.411 -2.382 0 N-CA-C 104.983 -2.229 . . . . 0.0 104.983 -176.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 10.4 m -57.97 -58.06 10.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.672 -172.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 89.1 m-85 -104.97 136.68 43.98 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.062 -0.655 . . . . 0.0 111.37 178.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 3.0 p -149.66 -178.08 6.24 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.039 0.936 . . . . 0.0 112.333 -168.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . 0.47 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 6.5 t70 -108.95 164.94 11.96 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 173.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -54.4 -29.16 48.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 119.379 0.99 . . . . 0.0 111.494 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -82.41 -8.37 59.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 177.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 100.61 -3.7 56.31 Favored Glycine 0 CA--C 1.501 -0.833 0 C-N-CA 119.918 -1.134 . . . . 0.0 112.133 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . 0.47 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 30.6 t70 -59.41 99.15 0.05 Allowed 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 175.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -52.56 129.69 29.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.226 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.11 171.34 8.17 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.666 -176.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -74.53 160.62 30.67 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.1 m -85.67 151.83 56.12 Favored Pre-proline 0 N--CA 1.423 -1.792 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.462 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 2.8 Cg_endo -47.52 -29.89 11.09 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 125.119 3.879 . . . . 0.0 117.729 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 51.1 m -88.23 -35.61 17.21 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 118.98 0.809 . . . . 0.0 109.55 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -65.4 -25.94 67.77 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.009 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.474 HD11 ' CH2' ' A' ' 980' ' ' TRP . 32.9 mt -74.75 122.4 23.22 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.685 0.794 . . . . 0.0 110.351 176.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 24.0 p -124.77 169.53 11.91 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.368 -174.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.565 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 25.6 p -92.7 133.74 28.85 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.26 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.57 ' HG2' ' HB2' ' A' ' 973' ' ' TRP . 93.6 Cg_endo -75.79 170.52 20.01 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.328 2.018 . . . . 0.0 110.835 176.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -56.67 -19.93 32.54 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.201 2.601 . . . . 0.0 115.227 -176.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.668 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . -116.07 14.98 16.19 Favored Glycine 0 N--CA 1.439 -1.103 0 C-N-CA 120.474 -0.869 . . . . 0.0 112.708 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.57 ' HB2' ' HG2' ' A' ' 970' ' ' PRO . 96.4 m95 -129.13 127.78 42.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 118.014 0.907 . . . . 0.0 110.793 178.471 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.424 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 8.9 tp10 -106.4 118.18 35.97 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.616 2.366 . . . . 0.0 108.528 -173.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.637 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 42.8 m95 -69.55 105.12 2.55 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.107 -1.037 . . . . 0.0 111.135 176.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -71.15 -51.09 26.93 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 174.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -74.43 144.84 44.11 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.774 -172.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.63 -36.53 68.04 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -178.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -166.8 150.27 6.84 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.96 0.41 . . . . 0.0 110.806 -174.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.56 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 35.1 m95 -64.68 120.24 12.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 981' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' 1023 ' ' LEU . 19.9 m -115.6 -172.28 2.12 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -174.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -109.88 143.78 39.3 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 120.472 1.487 . . . . 0.0 109.695 -177.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.478 ' HB3' ' HD2' ' A' 1022 ' ' ARG . 17.2 t70 -106.16 131.54 53.29 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.365 -171.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.2 pp -109.33 29.63 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.631 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -106.4 30.51 5.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.952 1.358 . . . . 0.0 107.742 -174.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -138.95 -177.1 4.73 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -178.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -86.79 77.68 9.23 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 173.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.502 HG11 ' HB3' ' A' ' 994' ' ' GLU . 30.3 m -137.1 156.67 34.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.529 -172.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -55.02 165.94 0.59 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.792 -1.094 . . . . 0.0 110.995 170.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -52.88 -25.25 11.09 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 123.582 0.753 . . . . 0.0 112.871 176.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . 0.41 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 95.4 mttt -106.77 13.03 28.42 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.812 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.32 -13.23 66.97 Favored Glycine 0 C--O 1.224 -0.473 0 CA-C-N 115.967 -0.56 . . . . 0.0 113.383 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.47 ' HE3' ' HG2' ' A' 1019 ' ' ARG . 79.4 m95 -59.31 115.38 3.19 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.502 ' HB3' HG11 ' A' ' 988' ' ' VAL . 4.5 pt-20 -105.41 159.25 16.06 Favored 'General case' 0 C--O 1.257 1.451 0 CA-C-O 121.992 0.901 . . . . 0.0 112.543 176.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.791 ' HA ' ' HE2' ' A' 1016 ' ' HIS . 57.1 t80 -83.08 103.0 12.18 Favored 'General case' 0 C--O 1.209 -1.068 0 C-N-CA 128.019 2.528 . . . . 0.0 113.714 -172.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -127.23 137.99 10.24 Favored Glycine 0 N--CA 1.439 -1.152 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 172.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' 1005 ' ' PRO . 0.6 OUTLIER -133.44 149.65 31.41 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 177.13 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 28.8 m -127.82 103.77 7.46 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 121.203 0.525 . . . . 0.0 109.832 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 18.0 pt -95.51 114.18 63.37 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.37 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1000 ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 33.0 Cg_endo -65.87 138.16 51.98 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 122.518 2.145 . . . . 0.0 112.931 -177.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1001 ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 6.6 Cg_endo -89.92 138.53 12.77 Favored 'Cis proline' 0 N--CA 1.45 -1.071 0 C-N-CA 123.143 -1.607 . . . . 0.0 113.883 -1.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 30.9 t0 165.16 151.19 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 111.604 -2.544 . . . . 0.0 104.664 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -112.22 -35.91 5.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 120.631 1.559 . . . . 0.0 110.588 -175.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -96.84 142.33 24.38 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-O 120.934 0.397 . . . . 0.0 111.772 -178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1005 ' ' PRO . . . . . 0.504 ' HA ' ' O ' ' A' ' 997' ' ' ILE . 77.5 Cg_exo -62.66 123.21 11.94 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 N-CA-C 107.405 -1.806 . . . . 0.0 107.405 162.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 34.3 mttm -75.5 -12.61 60.27 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.199 0.523 . . . . 0.0 111.783 -175.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 39.3 t -150.07 151.74 33.69 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 -165.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.707 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 59.4 m95 -138.41 131.95 30.65 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 125.457 1.723 . . . . 0.0 107.254 174.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.431 HG11 ' H ' ' A' 1010 ' ' ALA . 21.3 t -150.18 170.56 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -171.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1010 ' ' ALA . . . . . 0.431 ' H ' HG11 ' A' 1009 ' ' VAL . . . -94.37 95.22 8.74 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 176.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -169.26 172.51 7.24 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.905 -175.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.642 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.2 OUTLIER -150.7 97.68 2.52 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 122.69 1.233 . . . . 0.0 109.238 176.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.586 ' HD3' ' CE1' ' A' ' 995' ' ' TYR . 57.7 mtpt -115.87 144.25 44.29 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 112.869 -1.969 . . . . 0.0 110.084 -176.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 55.5 ttp -46.27 -35.11 4.97 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 124.887 1.275 . . . . 0.0 113.875 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -62.34 -13.0 24.27 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.812 0.339 . . . . 0.0 111.178 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.791 ' HE2' ' HA ' ' A' ' 995' ' ' TYR . 0.4 OUTLIER -48.94 106.14 0.1 Allowed 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.0 177.253 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -18.57 13.91 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.15 175.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -139.73 147.17 40.5 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.169 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.47 ' HG2' ' HE3' ' A' ' 993' ' ' TRP . 50.3 ttp180 -147.58 147.63 30.27 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.579 ' HG2' ' CZ3' ' A' 1008 ' ' TRP . 3.6 ptp180 -155.44 167.78 29.26 Favored 'General case' 0 C--O 1.201 -1.471 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.935 176.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.584 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 28.1 ptt180 -149.93 156.31 41.51 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 123.713 0.633 . . . . 0.0 109.753 177.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.59 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 34.5 ttm180 -88.69 128.25 35.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 117.794 0.27 . . . . 0.0 110.612 177.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' A' ' 981' ' ' SER . 87.2 mt -101.67 128.28 48.04 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 106.924 -1.509 . . . . 0.0 106.924 168.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.491 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 4.5 m -107.44 139.1 30.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.14 0 CA-C-O 121.543 0.687 . . . . 0.0 111.93 -174.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.5 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.1 tpt180 -135.61 104.41 5.79 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.1 171.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.702 ' HE2' ' HE3' ' A' 1028 ' ' LYS . 0.9 OUTLIER -72.4 136.76 46.15 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.046 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.637 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.4 ptm180 -138.03 144.46 41.05 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -172.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.702 ' HE3' ' HE2' ' A' 1026 ' ' LYS . 30.4 mmtp -108.61 150.3 27.71 Favored 'General case' 0 CA--C 1.468 -2.2 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.822 -175.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 35.1 ttmt -99.26 -16.46 18.5 Favored 'General case' 0 C--N 1.275 -2.656 0 N-CA-C 103.996 -2.594 . . . . 0.0 103.996 161.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1030 ' ' ASP . . . . . 0.479 ' C ' ' H ' ' A' 1032 ' ' THR . 8.6 t70 49.27 16.1 0.14 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 111.217 -2.72 . . . . 0.0 111.376 -174.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 29.5 tp 55.74 -37.58 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 127.864 2.465 . . . . 0.0 113.247 -172.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1032 ' ' THR . . . . . 0.479 ' H ' ' C ' ' A' 1030 ' ' ASP . 9.0 t -74.79 -14.08 60.66 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.405 1.082 . . . . 0.0 112.878 -178.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.668 ' HB3' ' HA2' ' A' ' 972' ' ' GLY . 11.5 mm-40 -59.45 -43.7 93.1 Favored 'General case' 0 N--CA 1.483 1.179 0 CA-C-N 118.999 0.818 . . . . 0.0 109.908 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 30.7 p -84.69 106.0 15.9 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.013 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -137.34 100.01 4.13 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 18.9 m -72.1 102.15 2.94 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.149 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 49.5 m -72.09 160.84 31.79 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.228 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 9.2 t -146.04 140.03 26.51 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -117.3 -50.25 2.56 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.136 0.493 . . . . 0.0 110.108 -178.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 . . . . . 0 N--CA 1.438 -1.074 0 CA-C-O 118.534 -0.746 . . . . 0.0 109.157 -176.915 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . 0.44 HD13 ' N ' ' A' ' 919' ' ' ASP . 2.8 pp . . . . . 0 N--CA 1.477 0.908 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . 0.452 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 28.9 t70 -80.96 127.5 74.42 Favored Pre-proline 0 C--O 1.238 0.477 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 19.0 Cg_exo -65.05 169.85 11.35 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.88 2.387 . . . . 0.0 113.211 -173.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -108.79 -169.54 1.51 Allowed 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.789 -176.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 75.0 m -55.6 120.22 6.89 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.285 0.564 . . . . 0.0 111.84 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -119.67 166.63 12.94 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -102.94 135.3 44.87 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.42 -0.912 . . . . 0.0 112.729 -174.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -132.52 28.37 4.32 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 174.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 100.92 63.35 0.78 Allowed Glycine 0 N--CA 1.439 -1.166 0 CA-C-N 115.064 -0.971 . . . . 0.0 112.23 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -132.31 152.73 51.26 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 174.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.16 124.01 47.01 Favored 'General case' 0 N--CA 1.415 -2.223 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 163.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.487 ' HB2' ' HE3' ' A' 1026 ' ' LYS . 0.1 OUTLIER -141.67 133.0 26.56 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 171.194 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . 0.414 ' O ' ' HG2' ' A' 1027 ' ' ARG . 73.2 t80 -128.36 135.65 49.85 Favored 'General case' 0 C--N 1.295 -1.771 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 -176.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 34.0 m -77.5 124.45 27.92 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -105.06 159.4 15.86 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 105.153 -2.166 . . . . 0.0 105.153 -173.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.745 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 11.9 pt-20 -151.1 152.55 33.55 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.105 -175.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.601 ' O ' ' HA ' ' A' 1022 ' ' ARG . 8.6 p -137.03 178.63 4.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 N-CA-C 106.438 -1.689 . . . . 0.0 106.438 176.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.535 ' HA ' ' O ' ' A' 1021 ' ' ARG . 49.8 m-85 -142.79 113.11 7.23 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 118.755 0.707 . . . . 0.0 110.761 -174.354 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.581 ' O ' ' HA ' ' A' 1020 ' ' ARG . 31.3 tt0 -79.3 127.42 32.04 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.944 0.778 . . . . 0.0 110.046 173.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . 0.438 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 33.5 m-80 -118.53 152.41 36.02 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.62 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 43.5 mt-10 -140.86 162.11 36.21 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 171.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 24.7 p -137.62 142.37 41.23 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.544 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 15.0 ptt180 -151.63 160.05 43.8 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 123.779 0.832 . . . . 0.0 108.92 -178.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -66.29 161.23 59.33 Favored Pre-proline 0 C--N 1.311 -1.087 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 171.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.64 97.76 0.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 121.554 1.503 . . . . 0.0 111.396 175.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 89.27 62.56 1.34 Allowed Glycine 0 N--CA 1.441 -0.983 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 -178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -156.25 -159.65 9.54 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 121.096 -0.573 . . . . 0.0 111.929 -175.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -103.24 133.08 48.92 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 123.989 0.464 . . . . 0.0 110.263 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.62 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 42.2 m95 -80.78 147.41 30.5 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-O 121.3 0.571 . . . . 0.0 109.876 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -127.56 151.29 74.91 Favored Pre-proline 0 C--N 1.296 -1.758 0 N-CA-C 103.018 -2.956 . . . . 0.0 103.018 170.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -49.35 140.15 27.3 Favored 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 122.426 2.084 . . . . 0.0 111.66 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.64 -178.17 0.38 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.435 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -89.73 -40.11 12.72 Favored 'General case' 0 CA--C 1.473 -1.995 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -120.18 88.15 2.88 Favored 'General case' 0 N--CA 1.399 -3.023 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 31.8 m -64.64 -57.79 8.09 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.715 -1.13 . . . . 0.0 112.384 -170.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -92.77 129.27 38.74 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.725 0.774 . . . . 0.0 111.436 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 954' ' ' THR . . . . . 0.552 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 12.9 p -149.61 178.44 8.84 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.133 -169.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -99.27 172.99 7.0 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 105.567 -2.012 . . . . 0.0 105.567 173.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -53.07 -31.55 42.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.931 0.787 . . . . 0.0 111.437 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -84.16 -7.78 59.27 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.588 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . 0.552 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 74.76 56.52 4.9 Favored Glycine 0 CA--C 1.49 -1.525 0 C-N-CA 120.194 -1.003 . . . . 0.0 111.27 -174.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -105.17 109.66 21.73 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.499 -3.149 . . . . 0.0 102.499 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -46.58 115.95 1.18 Allowed 'General case' 0 C--N 1.319 -0.748 0 O-C-N 124.481 1.113 . . . . 0.0 111.164 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -122.42 -177.26 3.57 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.858 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . 0.535 ' HB2' ' HB2' ' A' ' 966' ' ' GLU . . . -80.52 161.62 24.74 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 176.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.0 m -80.69 159.94 68.01 Favored Pre-proline 0 C--N 1.314 -0.95 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.689 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 41.7 Cg_exo -46.38 -33.8 13.16 Favored 'Trans proline' 0 N--CA 1.478 0.56 0 C-N-CA 123.674 2.916 . . . . 0.0 115.047 -178.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 2.5 p -72.57 -47.51 47.49 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.507 0.67 . . . . 0.0 110.086 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . 0.535 ' HB2' ' HB2' ' A' ' 962' ' ' ALA . 40.0 mt-10 -64.84 -32.86 74.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.112 -1.403 . . . . 0.0 110.488 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.501 HD13 ' CH2' ' A' ' 980' ' ' TRP . 14.5 mt -60.9 110.41 1.33 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.923 0.868 . . . . 0.0 111.175 178.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 18.7 p -104.64 164.35 11.82 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.282 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 14.2 p -97.98 136.04 21.22 Favored Pre-proline 0 N--CA 1.442 -0.835 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.421 175.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.567 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 77.8 Cg_endo -71.76 175.57 9.44 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 123.683 2.922 . . . . 0.0 110.492 177.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.53 -46.59 30.76 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.643 2.228 . . . . 0.0 114.011 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.567 ' HA2' ' HB ' ' A' 1034 ' ' THR . . . -72.11 -51.96 12.58 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.732 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.567 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 96.6 m95 -72.01 144.31 48.86 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -177.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.529 ' HB3' ' O ' ' A' 1028 ' ' LYS . 2.6 tp10 -133.47 156.51 47.6 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 113.297 -1.774 . . . . 0.0 106.455 -177.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.48 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 82.6 m95 -89.56 152.11 21.59 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.616 -0.678 . . . . 0.0 110.703 172.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -131.1 -33.78 1.5 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.54 0.686 . . . . 0.0 109.396 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . 0.454 ' HB3' ' HD2' ' A' 1025 ' ' ARG . 8.2 t0 -71.44 151.49 43.95 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.83 -47.49 74.84 Favored 'General case' 0 C--N 1.318 -0.788 0 O-C-N 123.527 0.517 . . . . 0.0 111.253 -176.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -164.72 171.97 13.64 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -174.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.689 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 31.6 m95 -84.86 87.13 7.31 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.884 0.849 . . . . 0.0 109.14 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 3.2 m -93.45 145.43 24.5 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.715 -1.129 . . . . 0.0 108.575 -176.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . 0.44 ' HA ' ' O ' ' A' 1022 ' ' ARG . 3.5 p90 -73.39 136.03 44.31 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 121.919 0.866 . . . . 0.0 110.722 -176.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.562 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 4.4 t70 -82.92 141.02 32.49 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 113.668 -1.606 . . . . 0.0 111.746 -172.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.5 pp -132.29 5.63 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.442 176.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . 0.565 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 17.1 m120 -92.31 18.91 7.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.042 0.449 . . . . 0.0 111.845 -175.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.565 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 8.2 mpt_? -143.87 -178.27 5.84 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 106.344 -1.725 . . . . 0.0 106.344 -178.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.15 83.73 2.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 118.71 0.687 . . . . 0.0 112.008 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 15.8 m -143.65 157.63 16.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 C-N-CA 124.666 1.186 . . . . 0.0 107.966 178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -55.22 173.01 0.11 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.599 0.36 . . . . 0.0 110.765 175.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.59 -31.4 72.61 Favored 'General case' 0 CA--C 1.492 -1.265 0 O-C-N 121.282 -0.886 . . . . 0.0 110.422 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . 0.422 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 24.4 mtmm -92.6 0.3 57.41 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.038 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.7 -21.16 41.58 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 112.257 -0.337 . . . . 0.0 112.257 175.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.422 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 81.6 m95 -50.6 124.96 11.89 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -99.1 157.63 16.22 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.871 -1.059 . . . . 0.0 109.287 176.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.728 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 86.5 t80 -82.63 86.38 6.84 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 113.366 -1.743 . . . . 0.0 109.096 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . 0.466 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -109.66 84.04 0.35 Allowed Glycine 0 CA--C 1.49 -1.484 0 C-N-CA 120.137 -1.03 . . . . 0.0 111.369 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.459 HD13 HD11 ' A' ' 999' ' ' ILE . 0.4 OUTLIER -92.16 131.92 37.93 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 CA-C-O 121.696 0.76 . . . . 0.0 110.722 -176.37 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 998' ' ' THR . . . . . 0.467 ' HG1' ' HG3' ' A' 1005 ' ' PRO . 4.0 m -132.07 121.88 24.54 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.459 HD11 HD13 ' A' ' 997' ' ' ILE . 59.3 mt -115.24 98.25 50.08 Favored Pre-proline 0 C--N 1.316 -0.859 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -175.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -62.27 132.23 37.82 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.403 2.069 . . . . 0.0 113.405 -176.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -79.46 143.92 70.26 Favored 'Cis proline' 0 CA--C 1.51 -0.698 0 C-N-CA 123.117 -1.618 . . . . 0.0 112.293 -1.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 5.8 t0 -147.2 -174.8 4.61 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 113.764 -1.562 . . . . 0.0 107.883 -173.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -116.16 -61.77 1.68 Allowed 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -160.52 157.85 24.5 Favored Pre-proline 0 C--N 1.315 -0.901 0 N-CA-C 101.907 -3.368 . . . . 0.0 101.907 -177.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1005 ' ' PRO . . . . . 0.467 ' HG3' ' HG1' ' A' ' 998' ' ' THR . 53.7 Cg_exo -59.12 121.11 9.39 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 CA-C-N 122.172 1.811 . . . . 0.0 109.864 174.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 60.6 mttt -66.04 -29.02 69.3 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -177.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.0 t -145.29 140.65 27.94 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 114.438 -1.256 . . . . 0.0 109.286 -165.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.53 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 63.8 m95 -126.12 138.66 53.7 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 125.213 1.57 . . . . 0.0 107.322 176.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.567 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 34.5 t -139.87 166.83 20.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 -176.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1010 ' ' ALA . . . . . 0.492 ' H ' HG11 ' A' 1009 ' ' VAL . . . -92.98 24.41 3.71 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -171.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -135.85 137.28 41.33 Favored 'General case' 0 C--N 1.315 -0.917 0 O-C-N 121.39 -0.819 . . . . 0.0 111.06 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.611 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.3 OUTLIER -92.57 132.41 36.87 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 175.851 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 96.2 mttt -152.53 176.83 11.28 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 -171.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1014 ' ' MET . . . . . 0.404 ' SD ' ' N ' ' A' 1014 ' ' MET . 0.0 OUTLIER -82.56 6.39 17.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.67 0.747 . . . . 0.0 111.008 -178.002 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -90.99 7.92 37.92 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 122.481 1.134 . . . . 0.0 108.243 175.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.728 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 20.7 m80 -88.12 172.29 9.62 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 114.168 -1.378 . . . . 0.0 111.812 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -158.0 -35.77 0.07 Allowed 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 112.3 -2.227 . . . . 0.0 106.266 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1018 ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 996' ' ' GLY . 35.1 m170 -132.08 151.65 51.65 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 170.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 34.4 ptt180 -149.05 148.44 29.72 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 173.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.581 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.7 ptp180 -151.34 152.18 32.79 Favored 'General case' 0 CA--C 1.482 -1.657 0 C-N-CA 117.672 -1.611 . . . . 0.0 110.804 176.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.535 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 25.0 ptt180 -128.08 142.83 51.09 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.624 -177.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.745 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 32.8 ttm180 -78.43 123.32 26.9 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 114.243 -1.344 . . . . 0.0 110.27 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1023 ' ' LEU . . . . . . . . . . . . . 17.5 mt -103.88 129.85 51.42 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 103.978 -2.601 . . . . 0.0 103.978 168.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.448 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 17.0 m -105.87 133.68 49.56 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 O-C-N 123.63 0.582 . . . . 0.0 111.316 -172.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.454 ' HD2' ' HB3' ' A' ' 977' ' ' ASP . 13.4 tpt180 -135.52 103.98 5.66 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 172.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.6 OUTLIER -70.39 138.36 51.24 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.843 -1.54 . . . . 0.0 106.843 177.9 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.48 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 15.0 ptm180 -131.21 143.36 50.53 Favored 'General case' 0 CA--C 1.488 -1.439 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 -173.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.529 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 28.7 ttmt -132.77 134.35 44.6 Favored 'General case' 0 C--N 1.281 -2.371 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -175.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.613 ' C ' ' H ' ' A' 1031 ' ' LEU . 36.3 ttmt -84.17 -22.19 31.06 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 122.795 1.284 . . . . 0.0 107.815 -177.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 34.3 t70 65.6 -33.53 0.17 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 127.928 2.491 . . . . 0.0 112.566 -173.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.613 ' H ' ' C ' ' A' 1029 ' ' LYS . 21.9 tp 87.55 9.92 0.15 Allowed 'General case' 0 C--N 1.309 -1.16 0 C-N-CA 128.698 2.799 . . . . 0.0 109.718 174.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 4.4 m -112.69 -8.93 13.76 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -87.03 -37.12 17.77 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 113.534 -1.666 . . . . 0.0 109.654 -174.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1034 ' ' THR . . . . . 0.567 ' HB ' ' HA2' ' A' ' 972' ' ' GLY . 13.7 t -96.41 131.26 43.16 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 175.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -88.23 104.19 16.49 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 22.9 p -78.89 -18.29 54.15 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.37 0.605 . . . . 0.0 110.631 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 70.9 m -98.45 97.84 9.12 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.838 175.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 25.6 p -100.9 127.89 47.18 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.087 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -130.01 -28.67 2.15 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.43 -175.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 . . . . . 0 N--CA 1.445 -0.693 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -177.565 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . 0.478 HD13 ' H2 ' ' A' ' 918' ' ' ILE . 3.7 mp . . . . . 0 N--CA 1.471 0.605 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -112.94 149.93 42.06 Favored Pre-proline 0 C--N 1.314 -0.948 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -62.72 -28.63 76.57 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.738 2.959 . . . . 0.0 113.152 177.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -56.66 -41.37 77.12 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 123.641 0.776 . . . . 0.0 112.175 -175.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 7.5 t -107.02 153.51 22.48 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -92.62 85.24 5.21 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -111.65 -55.21 2.53 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.583 -173.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . 68.76 -70.82 0.13 Allowed 'General case' 0 C--N 1.327 -0.383 0 O-C-N 124.197 0.935 . . . . 0.0 111.803 -176.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -157.13 57.49 0.37 Allowed Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.47 -177.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.51 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 25.2 m-70 -138.24 174.34 10.66 Favored 'General case' 0 CA--C 1.503 -0.864 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 174.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.65 122.03 45.21 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 160.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.706 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.0 OUTLIER -108.66 175.45 5.46 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.197 175.1 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . 0.726 ' O ' ' HG2' ' A' 1027 ' ' ARG . 85.3 t80 -159.82 119.49 2.91 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 176.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 931' ' ' THR . . . . . . . . . . . . . 27.9 m -73.14 123.26 23.26 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 171.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . 0.646 ' HB2' ' HD2' ' A' 1027 ' ' ARG . 8.5 t70 -100.33 155.86 17.56 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -155.51 147.96 23.91 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.507 -171.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.445 HG12 ' HG3' ' A' ' 964' ' ' PRO . 8.1 p -144.48 -179.53 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 N-CA-C 105.589 -2.004 . . . . 0.0 105.589 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.504 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 67.8 m-85 -136.69 150.81 48.67 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -178.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.556 ' O ' ' HA ' ' A' 1020 ' ' ARG . 7.3 tt0 -122.93 122.36 38.39 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . 0.511 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 29.4 m-80 -113.11 142.57 45.6 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 122.32 1.057 . . . . 0.0 112.833 -173.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 35.7 mt-10 -135.63 161.93 34.15 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 112.672 -2.058 . . . . 0.0 105.664 171.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 939' ' ' SER . . . . . 0.496 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 34.9 p -149.56 158.97 44.66 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 118.65 0.659 . . . . 0.0 112.404 -175.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.492 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 37.5 ptt180 -156.77 159.52 38.37 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.731 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -75.94 165.26 54.59 Favored Pre-proline 0 C--N 1.311 -1.095 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 168.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -62.68 84.61 0.11 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 121.424 1.416 . . . . 0.0 110.643 171.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 132.49 -2.2 4.93 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -175.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . 0.492 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -96.42 -172.33 35.11 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 108.048 -2.021 . . . . 0.0 108.048 177.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -127.57 161.58 28.48 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 120.112 1.956 . . . . 0.0 105.803 170.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.642 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 54.6 m95 -64.07 134.8 55.62 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 122.282 1.039 . . . . 0.0 113.463 -169.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -136.27 175.62 3.41 Favored Pre-proline 0 C--N 1.309 -1.171 0 N-CA-C 104.391 -2.448 . . . . 0.0 104.391 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.86 126.92 24.14 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.707 1.605 . . . . 0.0 111.814 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . 0.496 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -80.84 15.01 1.92 Allowed 'General case' 0 C--O 1.239 0.532 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -178.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 78.37 -62.19 0.35 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 125.293 1.437 . . . . 0.0 108.623 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.83 83.77 2.79 Favored 'General case' 0 N--CA 1.417 -2.098 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.3 m -72.26 -58.72 3.18 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.694 -171.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . 0.504 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 88.3 m-85 -97.88 123.93 42.07 Favored 'General case' 0 C--N 1.309 -1.196 0 C-N-CA 119.053 -1.059 . . . . 0.0 110.095 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 954' ' ' THR . . . . . 0.447 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 76.5 p -136.35 171.41 14.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.359 -170.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -95.75 176.93 5.95 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 105.685 -1.969 . . . . 0.0 105.685 175.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.64 -24.42 5.54 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 178.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . 0.698 HD22 ' HB2' ' A' ' 959' ' ' ASP . 4.1 p-10 -96.66 -4.03 41.64 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.655 -0.653 . . . . 0.0 111.35 178.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . 0.447 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 93.53 -1.49 69.21 Favored Glycine 0 CA--C 1.499 -0.96 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.165 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . 0.698 ' HB2' HD22 ' A' ' 957' ' ' ASN . 7.0 t70 -57.55 104.73 0.19 Allowed 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -51.94 133.62 32.28 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.876 0.846 . . . . 0.0 110.908 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -128.63 -173.94 3.1 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.767 -1.106 . . . . 0.0 108.991 -176.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . 0.46 ' HB2' ' HB3' ' A' ' 966' ' ' GLU . . . -75.99 157.81 32.64 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 176.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.5 m -77.52 156.96 80.65 Favored Pre-proline 0 N--CA 1.441 -0.92 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.632 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 52.4 Cg_exo -51.31 -20.12 7.68 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.457 2.772 . . . . 0.0 114.614 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.3 p -70.81 -57.8 4.27 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . 0.46 ' HB3' ' HB2' ' A' ' 962' ' ' ALA . 35.2 tt0 -69.09 -27.83 65.96 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.229 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.506 HD11 ' HA ' ' A' ' 964' ' ' PRO . 31.6 mt -59.81 110.75 1.23 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 24.3 p -116.34 177.54 4.65 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.688 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 9.0 p -101.64 143.19 26.1 Favored Pre-proline 0 C--N 1.307 -1.28 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.676 178.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.566 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 97.4 Cg_endo -74.56 -179.37 4.77 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.029 2.486 . . . . 0.0 109.418 172.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.35 -51.78 9.75 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.922 1.748 . . . . 0.0 114.457 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.491 ' HA2' ' HB ' ' A' 1034 ' ' THR . . . -74.31 -46.24 21.47 Favored Glycine 0 N--CA 1.442 -0.961 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.992 -177.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.566 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 99.2 m95 -69.23 130.43 42.62 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.895 ' HB2' HE21 ' A' 1033 ' ' GLN . 6.5 tp10 -118.66 143.42 46.84 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 126.499 1.92 . . . . 0.0 109.748 -173.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -88.55 152.64 21.72 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.551 0.691 . . . . 0.0 111.446 173.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -137.86 -36.61 0.61 Allowed 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.673 177.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . 0.672 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.4 m-20 -77.62 149.66 34.73 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -174.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -54.81 -51.58 65.37 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 124.782 1.301 . . . . 0.0 113.186 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -168.77 167.76 10.95 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-O 120.877 0.37 . . . . 0.0 110.321 -175.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.632 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 33.5 m95 -74.72 114.71 13.47 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 177.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 2.6 p -123.95 149.23 46.18 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -172.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . 0.575 ' HA ' ' O ' ' A' 1022 ' ' ARG . 1.0 OUTLIER -74.21 129.54 38.01 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.577 0.703 . . . . 0.0 111.28 -172.797 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -87.75 135.26 33.45 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.806 -170.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 26.3 pt -115.68 24.79 4.62 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.985 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . 0.607 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 25.3 t-20 -101.44 15.64 28.18 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.783 0.802 . . . . 0.0 110.369 -175.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.607 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 8.7 mpt_? -138.24 -176.74 4.55 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 -174.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -78.01 75.63 4.54 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.953 0.883 . . . . 0.0 109.443 176.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 27.6 m -141.53 152.21 19.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.111 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -55.32 169.37 0.28 Allowed 'General case' 0 C--N 1.323 -0.567 0 O-C-N 123.89 0.744 . . . . 0.0 111.113 173.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -52.58 -32.24 40.17 Favored 'General case' 0 CA--C 1.493 -1.25 0 CA-C-O 121.65 0.738 . . . . 0.0 111.751 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . 0.412 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 70.9 mmtt -104.2 15.17 28.95 Favored 'General case' 0 N--CA 1.417 -2.085 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.95 -176.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 89.48 -15.81 57.76 Favored Glycine 0 C--O 1.226 -0.399 0 CA-C-N 115.587 -0.733 . . . . 0.0 113.028 174.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.684 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 82.0 m95 -58.78 109.53 0.83 Allowed 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -177.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.91 160.27 14.51 Favored 'General case' 0 C--O 1.254 1.301 0 C-N-CA 123.756 0.823 . . . . 0.0 110.952 173.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.662 ' HE1' ' HB ' ' A' ' 997' ' ' ILE . 0.3 OUTLIER -75.7 102.77 5.51 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 125.435 1.494 . . . . 0.0 112.09 -172.454 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . 0.406 ' HA2' ' HB3' ' A' 1005 ' ' PRO . . . -107.72 88.8 0.55 Allowed Glycine 0 CA--C 1.492 -1.405 0 C-N-CA 119.051 -1.547 . . . . 0.0 112.261 173.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.662 ' HB ' ' HE1' ' A' ' 995' ' ' TYR . 2.5 tt -97.24 127.64 49.28 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.082 0 O-C-N 121.341 -1.093 . . . . 0.0 110.198 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 998' ' ' THR . . . . . 0.409 ' HG1' ' HG3' ' A' 1005 ' ' PRO . 20.7 m -118.42 82.9 1.92 Allowed 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 23.3 pt -104.4 130.81 22.63 Favored Pre-proline 0 C--N 1.316 -0.88 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.291 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.54 145.29 87.15 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.703 2.269 . . . . 0.0 112.754 -178.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1001 ' ' PRO . . . . . 0.426 ' O ' ' HB2' ' A' 1002 ' ' ASP . 7.9 Cg_endo -91.26 135.55 9.03 Favored 'Cis proline' 0 N--CA 1.446 -1.323 0 C-N-CA 123.024 -1.657 . . . . 0.0 112.844 -2.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1002 ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' 1001 ' ' PRO . 3.7 t70 158.69 170.37 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 111.523 -2.581 . . . . 0.0 105.822 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -149.81 33.97 0.68 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 118.646 0.657 . . . . 0.0 109.943 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 90.1 mttt -159.92 127.96 2.85 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.671 -176.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1005 ' ' PRO . . . . . 0.688 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 32.8 Cg_exo -68.56 124.26 11.39 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 121.521 1.481 . . . . 0.0 109.984 172.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 45.8 pttt -123.35 8.16 9.06 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -174.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.3 t -138.83 116.48 11.4 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.688 ' CZ2' ' HB2' ' A' 1005 ' ' PRO . 62.0 m95 -121.96 134.49 54.83 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.939 -171.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 15.4 m -156.29 178.08 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 -175.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -94.98 104.64 16.52 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 175.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -169.71 176.38 4.91 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.255 0.347 . . . . 0.0 110.34 -176.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.652 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 10.2 tp10 -163.13 104.4 0.99 Allowed 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 122.221 1.01 . . . . 0.0 108.608 176.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.495 ' H ' ' ND1' ' A' 1016 ' ' HIS . 73.0 mttt -135.62 157.45 46.85 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 113.667 -1.606 . . . . 0.0 109.263 -176.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 49.0 ttp -48.26 -41.64 28.31 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 125.137 1.375 . . . . 0.0 114.339 -177.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -59.23 -16.16 19.39 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.652 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 7.6 m80 -53.53 100.01 0.03 OUTLIER 'General case' 0 CA--C 1.511 -0.542 0 O-C-N 123.635 0.585 . . . . 0.0 111.345 172.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1017 ' ' THR . . . . . 0.491 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.0 OUTLIER -96.88 -22.72 16.72 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 122.845 1.307 . . . . 0.0 108.178 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 14.3 m170 -139.68 157.89 45.03 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 113.437 -1.711 . . . . 0.0 108.237 -178.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.684 ' HG2' ' CE3' ' A' ' 993' ' ' TRP . 44.8 ttp180 -157.82 148.44 20.85 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.556 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 5.4 ptp180 -152.1 166.34 31.96 Favored 'General case' 0 CA--C 1.487 -1.478 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.643 178.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 33.6 ptt180 -145.45 150.02 35.76 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.747 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.575 ' O ' ' HA ' ' A' ' 982' ' ' TYR . 41.4 ttm180 -87.22 120.91 28.99 Favored 'General case' 0 N--CA 1.437 -1.112 0 O-C-N 123.212 0.32 . . . . 0.0 110.758 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 86.1 mt -97.61 124.38 41.88 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 170.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.554 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 16.4 m -109.45 141.88 23.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 CA-C-O 121.823 0.82 . . . . 0.0 111.512 -175.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.526 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.4 tpt180 -134.45 104.78 6.25 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 113.662 -1.608 . . . . 0.0 107.936 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.672 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -75.19 146.62 41.09 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -178.35 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.726 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 13.1 ptm180 -147.35 171.37 15.55 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -170.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.706 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 15.5 ptpt -158.58 152.4 23.5 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 178.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.578 ' C ' ' H ' ' A' 1031 ' ' LEU . 38.1 ttmt -84.23 -10.72 57.45 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 122.812 1.291 . . . . 0.0 107.682 -176.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1030 ' ' ASP . . . . . 0.442 ' HB3' ' HB2' ' A' 1033 ' ' GLN . 32.0 t70 72.23 -20.47 0.25 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 112.011 -2.359 . . . . 0.0 112.717 178.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.578 ' H ' ' C ' ' A' 1029 ' ' LYS . 19.7 tp 78.17 -12.86 1.02 Allowed 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 127.78 2.432 . . . . 0.0 112.202 177.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 6.7 t -135.36 9.58 3.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 122.167 0.984 . . . . 0.0 108.822 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.895 HE21 ' HB2' ' A' ' 974' ' ' GLU . 3.1 tp-100 -69.22 -61.97 1.57 Allowed 'General case' 0 N--CA 1.438 -1.067 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 174.599 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1034 ' ' THR . . . . . 0.491 ' HB ' ' HA2' ' A' ' 972' ' ' GLY . 6.5 t -84.62 75.9 10.25 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-O 122.885 1.326 . . . . 0.0 108.071 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -83.04 -19.83 36.16 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.704 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 58.8 m -79.33 117.25 20.15 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 175.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 40.4 m -92.36 130.58 38.01 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 14.6 t -77.88 -17.28 57.51 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 121.063 0.458 . . . . 0.0 110.44 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -108.53 174.88 5.68 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 21.8 ttt180 . . . . . 0 C--N 1.318 -0.775 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -179.393 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . 0.618 HD11 ' H2 ' ' A' ' 918' ' ' ILE . 3.3 mp . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 69.63 131.74 0.04 OUTLIER Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 124.016 0.926 . . . . 0.0 111.396 -178.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -65.12 -22.09 62.06 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.149 1.899 . . . . 0.0 111.06 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -65.03 -32.54 74.31 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.192 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 32.6 m -89.32 78.95 7.14 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 176.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -85.26 -19.37 31.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.052 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . 0.462 ' HA ' ' CD2' ' A' ' 927' ' ' HIS . 28.7 t70 -115.99 118.52 33.16 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.434 -178.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -113.36 12.66 18.86 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.001 175.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 120.86 52.89 0.24 Allowed Glycine 0 N--CA 1.442 -0.932 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.256 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.481 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 9.6 m-70 -105.86 -152.31 0.47 Allowed 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 173.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.5 m -166.18 115.54 0.95 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 101.404 -3.554 . . . . 0.0 101.404 169.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.53 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 1.4 pm0 -142.92 136.04 28.2 Favored 'General case' 0 C--N 1.286 -2.193 0 CA-C-N 119.684 1.129 . . . . 0.0 109.005 177.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . 0.447 ' O ' ' HG2' ' A' 1027 ' ' ARG . 79.2 t80 -137.64 137.75 38.76 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -177.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.604 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 17.1 m -76.3 133.65 39.97 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.345 0.117 . . . . 0.0 110.995 178.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -111.08 163.82 13.47 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.515 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 10.6 pt-20 -151.24 150.74 30.94 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -173.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.515 ' O ' ' HA ' ' A' 1022 ' ' ARG . 7.1 p -138.82 175.39 8.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 N-CA-C 106.191 -1.781 . . . . 0.0 106.191 175.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.679 ' HA ' ' O ' ' A' 1021 ' ' ARG . 68.2 m-85 -139.43 146.47 40.14 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -175.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.714 ' O ' ' HA ' ' A' 1020 ' ' ARG . 30.0 tt0 -121.59 120.33 34.5 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -174.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . 0.541 ' HA ' ' O ' ' A' 1019 ' ' ARG . 26.2 m-80 -109.14 140.43 42.74 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.361 1.077 . . . . 0.0 112.891 -172.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.575 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 66.1 mt-10 -133.83 158.68 42.78 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 104.345 -2.465 . . . . 0.0 104.345 170.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 17.4 m -142.56 151.8 41.94 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 119.017 0.826 . . . . 0.0 111.48 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.659 ' O ' ' HA ' ' A' 1017 ' ' THR . 32.1 ptt180 -148.98 159.52 44.14 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.568 178.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -79.68 164.46 53.37 Favored Pre-proline 0 C--N 1.302 -1.499 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 171.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -64.04 91.44 0.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 121.123 1.215 . . . . 0.0 109.909 172.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 123.95 0.53 9.0 Favored Glycine 0 N--CA 1.44 -1.065 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 -175.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . 0.542 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -101.26 -175.08 28.82 Favored Glycine 0 CA--C 1.505 -0.586 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 178.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -119.37 166.7 12.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.977 1.889 . . . . 0.0 105.989 169.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.575 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 40.8 m95 -71.72 138.73 48.72 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-O 122.146 0.974 . . . . 0.0 112.408 -171.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -129.16 174.32 4.69 Favored Pre-proline 0 C--N 1.307 -1.251 0 N-CA-C 103.736 -2.691 . . . . 0.0 103.736 175.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -56.74 133.29 57.06 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 CA-C-N 121.364 1.523 . . . . 0.0 111.335 174.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.86 -170.88 0.12 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.681 0.753 . . . . 0.0 112.456 177.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.51 -36.82 13.51 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -178.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -120.43 105.65 11.07 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 104.912 -2.255 . . . . 0.0 104.912 169.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.1 m -66.62 -64.3 0.88 Allowed 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.101 -176.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . 0.577 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 73.4 m-85 -93.02 135.56 34.08 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 118.834 -1.146 . . . . 0.0 110.446 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 77.0 p -147.2 -177.27 5.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -174.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -103.29 -178.05 3.55 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 170.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.59 -26.08 12.44 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 176.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -87.52 -51.33 5.97 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 121.907 -0.496 . . . . 0.0 110.869 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 146.05 -7.63 1.43 Allowed Glycine 0 CA--C 1.493 -1.344 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.741 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.96 108.64 1.25 Allowed 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 175.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 961' ' ' ALA . 50.7 tttm -47.19 119.94 2.88 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.598 1.186 . . . . 0.0 110.526 178.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.46 ' O ' ' HG2' ' A' ' 960' ' ' LYS . . . -90.2 175.4 7.15 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . 0.414 ' HB2' ' CB ' ' A' ' 966' ' ' GLU . . . -72.44 -52.82 14.2 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.148 -1.021 . . . . 0.0 112.683 -175.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 57.1 p 138.48 156.53 0.0 OUTLIER Pre-proline 0 C--N 1.309 -1.191 0 C-N-CA 126.913 2.085 . . . . 0.0 109.919 -171.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.475 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 4.8 Cg_endo -58.92 -26.34 80.68 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 121.879 1.719 . . . . 0.0 112.291 172.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 50.7 m -74.19 -53.31 10.1 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 175.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . 0.414 ' CB ' ' HB2' ' A' ' 962' ' ' ALA . 33.3 mt-10 -75.42 5.26 6.0 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.79 111.94 23.9 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 172.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 18.7 p -110.74 174.31 5.92 Favored 'General case' 0 C--N 1.296 -1.761 0 CA-C-O 121.221 0.534 . . . . 0.0 111.491 -174.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.403 ' HA ' ' NH2' ' A' 1027 ' ' ARG . 16.1 p -108.73 128.85 24.77 Favored Pre-proline 0 N--CA 1.436 -1.152 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 173.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 73.5 Cg_endo -73.49 166.02 30.93 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.995 2.464 . . . . 0.0 110.337 177.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -49.64 -30.75 22.91 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.111 2.54 . . . . 0.0 114.13 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.683 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -107.31 23.17 27.54 Favored Glycine 0 N--CA 1.437 -1.235 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.577 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.602 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 75.7 m95 -135.74 132.84 37.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 117.629 0.714 . . . . 0.0 110.335 172.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.612 ' HB3' ' O ' ' A' 1028 ' ' LYS . 3.9 tp10 -111.54 142.15 44.2 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.531 ' CE3' ' HG2' ' A' 1025 ' ' ARG . 75.7 m95 -76.3 138.56 40.6 Favored 'General case' 0 C--N 1.298 -1.663 0 C-N-CA 118.014 -1.474 . . . . 0.0 111.106 170.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . 0.453 ' CG ' ' HB3' ' A' 1026 ' ' LYS . 4.2 pt-20 -108.92 -34.66 6.57 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . 0.402 ' HB3' ' HG3' ' A' 1025 ' ' ARG . 5.5 t0 -87.16 159.39 18.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 175.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -89.58 -31.99 17.33 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.647 -172.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -157.14 170.28 22.86 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 -174.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.556 ' HA ' ' O ' ' A' 1024 ' ' VAL . 23.6 m95 -94.73 110.07 21.96 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 175.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 50.0 m -124.57 158.94 31.8 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -178.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . 0.45 ' HA ' ' O ' ' A' 1022 ' ' ARG . 6.6 p90 -74.65 144.82 43.65 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -167.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -95.53 120.95 36.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.217 -176.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.432 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.6 pp -105.62 9.4 9.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.907 -177.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -94.46 39.68 1.09 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.793 1.282 . . . . 0.0 107.921 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.417 HH21 ' CD ' ' A' ' 994' ' ' GLU . 57.6 mtp85 -145.47 176.88 9.26 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -175.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -77.86 85.5 4.12 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 174.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.453 ' HB ' ' HA2' ' A' ' 992' ' ' GLY . 20.5 m -127.08 -173.34 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.933 -178.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -96.7 -174.15 2.93 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -66.22 -34.01 77.06 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.42 0.628 . . . . 0.0 109.404 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -91.31 6.12 46.55 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.124 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . 0.453 ' HA2' ' HB ' ' A' ' 988' ' ' VAL . . . 67.35 80.34 0.2 Allowed Glycine 0 C--O 1.215 -1.089 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -179.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.508 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 98.2 m95 -151.98 145.25 24.69 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.45 ' HB2' ' HB3' ' A' 1008 ' ' TRP . 4.9 pt-20 -119.4 157.29 28.5 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 122.33 1.062 . . . . 0.0 113.83 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.73 ' O ' ' HA ' ' A' 1008 ' ' TRP . 6.8 t80 -74.21 101.84 4.11 Favored 'General case' 0 C--O 1.209 -1.067 0 C-N-CA 128.686 2.795 . . . . 0.0 112.689 -173.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . 0.405 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -119.82 111.7 2.07 Favored Glycine 0 N--CA 1.434 -1.479 0 C-N-CA 119.63 -1.271 . . . . 0.0 111.299 173.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.557 HG22 ' HA ' ' A' 1016 ' ' HIS . 10.3 pt -121.54 145.12 28.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 175.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 13.6 t -139.04 140.39 38.09 Favored 'General case' 0 N--CA 1.425 -1.711 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 176.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.464 ' O ' HD13 ' A' ' 999' ' ' ILE . 2.3 pp -107.38 130.23 23.14 Favored Pre-proline 0 C--N 1.306 -1.306 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.087 -179.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1000 ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 55.9 Cg_endo -71.69 139.98 34.88 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.345 2.03 . . . . 0.0 112.815 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1001 ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 5.7 Cg_endo -92.85 156.63 19.99 Favored 'Cis proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.747 -1.772 . . . . 0.0 112.028 -3.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1002 ' ' ASP . . . . . 0.422 ' HB3' ' H ' ' A' 1003 ' ' HIS . 12.3 t70 -168.77 -93.98 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.001 175.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1003 ' ' HIS . . . . . 0.422 ' H ' ' HB3' ' A' 1002 ' ' ASP . 0.0 OUTLIER 167.83 -75.64 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.5 0 C-N-CA 125.057 1.343 . . . . 0.0 109.335 -177.377 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -129.14 141.06 40.48 Favored Pre-proline 0 C--N 1.317 -0.823 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -171.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1005 ' ' PRO . . . . . 0.417 ' HG2' ' CB ' ' A' 1018 ' ' HIS . 80.4 Cg_exo -54.45 143.66 65.72 Favored 'Trans proline' 0 CA--C 1.511 -0.628 0 C-N-CA 123.326 2.684 . . . . 0.0 110.3 167.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 43.9 mmtt -106.16 -45.23 4.37 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 -176.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 14.4 m -97.35 144.69 26.86 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 112.624 -2.08 . . . . 0.0 111.359 -169.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.73 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 66.0 m95 -135.22 136.09 41.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.797 1.239 . . . . 0.0 107.862 -178.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.45 HG13 ' N ' ' A' 1010 ' ' ALA . 57.4 t -146.77 173.39 2.64 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.745 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -172.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1010 ' ' ALA . . . . . 0.45 ' N ' HG13 ' A' 1009 ' ' VAL . . . -78.91 -18.79 53.26 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -177.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -92.9 107.68 19.41 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -169.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.421 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 18.2 tp10 -72.19 121.59 19.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.914 0.864 . . . . 0.0 109.78 171.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.472 ' H ' ' ND1' ' A' 1016 ' ' HIS . 28.6 mtpp -124.09 152.85 42.24 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.811 -174.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1014 ' ' MET . . . . . 0.412 ' C ' ' H ' ' A' 1016 ' ' HIS . 51.6 ttp -57.34 -37.99 73.41 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 124.212 0.945 . . . . 0.0 112.4 178.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -72.55 19.76 0.08 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.727 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.9 OUTLIER -69.77 175.07 4.52 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-O 122.174 0.987 . . . . 0.0 112.473 174.914 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1017 ' ' THR . . . . . 0.659 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.7 OUTLIER -158.52 -35.44 0.07 Allowed 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 113.307 -1.77 . . . . 0.0 109.102 -172.924 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1018 ' ' HIS . . . . . 0.417 ' CB ' ' HG2' ' A' 1005 ' ' PRO . 0.2 OUTLIER -138.58 147.48 43.05 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.72 -178.675 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.541 ' O ' ' HA ' ' A' ' 937' ' ' ASN . 40.3 ttp180 -145.91 143.7 29.72 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 177.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.714 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.6 ptp180 -150.88 165.92 32.14 Favored 'General case' 0 C--O 1.2 -1.502 0 O-C-N 123.881 0.738 . . . . 0.0 109.362 176.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.679 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.1 ptt180 -144.59 148.55 34.51 Favored 'General case' 0 C--N 1.295 -1.788 0 O-C-N 123.613 0.57 . . . . 0.0 110.693 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.515 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 37.2 ttm180 -84.48 119.48 25.2 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 123.924 0.765 . . . . 0.0 110.254 178.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1023 ' ' LEU . . . . . . . . . . . . . 69.4 mt -97.99 126.64 43.49 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 168.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.556 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 11.1 m -104.75 143.55 16.02 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.656 0 CA-C-O 121.01 0.433 . . . . 0.0 111.716 -174.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.531 ' HG2' ' CE3' ' A' ' 975' ' ' TRP . 0.5 OUTLIER -148.09 113.66 5.66 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.133 167.797 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.604 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.5 tmtp? -77.56 154.09 32.71 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 177.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 11.4 ptm180 -142.37 153.21 43.6 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 -176.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.612 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 36.3 ttmt -142.08 136.64 30.34 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 -172.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.683 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.0 ttmt -90.23 -24.65 20.9 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 123.057 1.408 . . . . 0.0 107.586 -177.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1030 ' ' ASP . . . . . 0.481 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 16.2 t0 54.7 12.33 0.55 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 112.23 -2.259 . . . . 0.0 111.043 -170.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.403 ' H ' ' C ' ' A' 1029 ' ' LYS . 19.0 tp 66.71 -42.18 0.4 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.339 2.256 . . . . 0.0 112.229 -176.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 14.9 p -97.61 30.49 2.91 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -175.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.539 ' CD ' ' HB2' ' A' ' 974' ' ' GLU . 4.3 mm100 -58.16 -49.41 77.12 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.304 173.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 8.0 t -138.9 83.19 1.94 Allowed 'General case' 0 N--CA 1.434 -1.24 0 CA-C-O 122.74 1.257 . . . . 0.0 110.568 177.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -107.49 125.4 51.22 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.654 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 21.6 p -126.64 14.34 7.55 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.337 0.589 . . . . 0.0 111.089 -178.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 20.4 m -81.77 129.09 34.61 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 89.2 m -74.83 119.62 19.26 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -73.71 90.51 1.84 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.003 -176.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 . . . . . 0 C--N 1.318 -0.768 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 174.545 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 33.4 pt . . . . . 0 N--CA 1.475 0.785 0 CA-C-O 121.21 0.528 . . . . 0.0 109.647 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 19.8 t70 -130.74 120.6 18.68 Favored Pre-proline 0 C--O 1.243 0.747 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.599 -176.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 19.1 Cg_exo -69.74 116.54 4.6 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.32 2.68 . . . . 0.0 110.898 176.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -55.45 121.41 8.94 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.457 -178.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 37.0 p 56.86 108.4 0.01 OUTLIER 'General case' 0 C--O 1.237 0.402 0 C-N-CA 125.717 1.607 . . . . 0.0 112.821 -174.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -78.24 -36.8 46.51 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -124.55 99.99 6.44 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.594 175.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -90.6 5.99 45.64 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.168 176.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 120.44 49.07 0.3 Allowed Glycine 0 CA--C 1.499 -0.942 0 C-N-CA 121.249 -0.5 . . . . 0.0 111.913 -178.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.434 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 16.8 m-70 -100.53 -153.12 0.44 Allowed 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 175.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.64 120.75 5.27 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 101.71 -3.441 . . . . 0.0 101.71 165.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.498 ' HG3' ' CE ' ' A' 1026 ' ' LYS . 0.5 OUTLIER -145.27 150.26 36.34 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 176.18 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . 0.548 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.1 t80 -143.21 140.13 30.58 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 175.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 27.8 m -77.91 127.78 32.91 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.789 -0.764 . . . . 0.0 109.886 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -96.55 149.34 21.87 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 104.627 -2.361 . . . . 0.0 104.627 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -150.03 151.49 33.36 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 118.694 0.679 . . . . 0.0 110.721 -172.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.417 ' O ' ' HA ' ' A' 1022 ' ' ARG . 9.8 p -147.8 -178.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 N-CA-C 105.026 -2.213 . . . . 0.0 105.026 176.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.549 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 77.0 m-85 -141.13 151.12 43.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.64 ' O ' ' HA ' ' A' 1020 ' ' ARG . 32.6 tt0 -119.74 113.47 20.68 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 -174.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -105.0 147.13 28.13 Favored 'General case' 0 C--N 1.313 -1.012 0 O-C-N 123.679 0.612 . . . . 0.0 110.684 -176.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.62 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 41.7 mt-10 -142.88 159.43 42.24 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 170.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 939' ' ' SER . . . . . 0.657 ' HB3' ' CD2' ' A' 1018 ' ' HIS . 12.8 p -141.7 145.81 35.32 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.448 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 22.9 ptt180 -148.36 161.44 41.56 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 124.59 1.156 . . . . 0.0 107.949 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -67.28 158.21 82.61 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 172.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.96 88.95 0.07 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 121.656 1.571 . . . . 0.0 111.16 174.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 103.07 71.06 0.86 Allowed Glycine 0 N--CA 1.43 -1.712 0 N-CA-C 108.153 -1.979 . . . . 0.0 108.153 -175.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.04 -146.75 4.81 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.731 -174.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -129.79 132.23 46.46 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 124.475 1.11 . . . . 0.0 110.311 -176.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.62 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 40.9 m95 -76.13 151.91 36.86 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 121.792 0.806 . . . . 0.0 112.052 -173.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -143.79 153.13 57.36 Favored Pre-proline 0 C--N 1.307 -1.271 0 N-CA-C 103.807 -2.664 . . . . 0.0 103.807 176.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -49.2 126.26 15.14 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.667 2.244 . . . . 0.0 112.626 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -75.61 23.87 0.12 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -171.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 79.3 -61.03 0.34 Allowed 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.738 1.615 . . . . 0.0 109.196 177.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -100.88 73.74 1.58 Allowed 'General case' 0 N--CA 1.415 -2.199 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 25.4 m -63.1 -60.42 3.46 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.414 -173.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . 0.549 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 68.4 m-85 -93.49 123.28 36.69 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 119.661 -0.816 . . . . 0.0 111.265 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 15.6 p -142.66 173.88 11.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 113.962 -1.472 . . . . 0.0 110.702 -170.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . 0.45 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 13.0 t70 -92.42 170.07 10.06 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 104.854 -2.276 . . . . 0.0 104.854 170.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.99 -30.89 27.03 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 118.591 0.632 . . . . 0.0 111.526 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -91.44 8.44 36.32 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 89.35 -7.49 81.9 Favored Glycine 0 CA--C 1.503 -0.718 0 C-N-CA 120.14 -1.029 . . . . 0.0 114.033 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . 0.45 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 20.3 t70 -52.89 101.76 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 172.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -54.9 125.86 22.01 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.885 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -125.76 175.86 7.33 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.741 -177.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . 0.542 ' HB3' ' HB2' ' A' ' 966' ' ' GLU . . . -70.38 160.23 32.7 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 7.2 m -89.23 159.93 43.79 Favored Pre-proline 0 N--CA 1.427 -1.624 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -179.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.608 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.4 Cg_exo -47.66 -28.94 10.02 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.184 3.256 . . . . 0.0 116.771 -174.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 25.0 m -76.32 -43.17 42.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 119.041 0.837 . . . . 0.0 109.79 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 962' ' ' ALA . 35.5 mt-10 -64.9 -30.08 71.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.056 176.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.437 HD11 ' CH2' ' A' ' 980' ' ' TRP . 77.5 mt -72.34 114.42 10.44 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.909 176.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 41.6 p -121.34 170.33 9.72 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.622 -175.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 5.1 p -87.16 141.52 32.99 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 121.076 0.465 . . . . 0.0 111.356 178.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.563 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 27.8 Cg_endo -87.49 166.4 7.73 Favored 'Trans proline' 0 C--O 1.242 0.713 0 C-N-CA 122.437 2.092 . . . . 0.0 111.256 176.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.23 108.56 0.99 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 121.617 1.545 . . . . 0.0 110.292 173.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.679 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 115.53 5.67 18.45 Favored Glycine 0 N--CA 1.44 -1.057 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.874 -176.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.563 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 93.7 m95 -138.98 136.56 35.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 117.784 0.792 . . . . 0.0 111.937 178.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.504 ' HB3' ' O ' ' A' 1028 ' ' LYS . 4.8 tp10 -116.19 134.05 55.35 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 125.635 1.574 . . . . 0.0 107.706 -174.027 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.664 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 81.0 m95 -79.66 104.74 10.46 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 118.885 -1.126 . . . . 0.0 109.528 173.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . 0.476 ' CD ' ' HZ1' ' A' 1028 ' ' LYS . 43.5 tt0 -75.84 -42.61 49.16 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 177.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.83 143.0 55.98 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.74 -38.21 73.51 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -175.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.03 152.19 7.47 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 120.593 0.235 . . . . 0.0 110.392 -173.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.625 ' HA ' ' O ' ' A' 1024 ' ' VAL . 40.4 m95 -65.5 113.83 4.44 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 1.5 p -122.65 159.78 27.17 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -171.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 17.1 p90 -74.38 141.18 45.14 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 119.515 1.052 . . . . 0.0 111.205 -174.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.409 ' HB3' ' HB3' ' A' 1022 ' ' ARG . 7.8 t70 -81.56 120.8 25.51 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.701 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 12.6 pt -126.37 42.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -110.59 6.35 21.78 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 113.882 -1.508 . . . . 0.0 107.665 -172.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.524 ' HD3' ' NH1' ' A' 1022 ' ' ARG . 52.2 mtm180 -136.06 -176.25 4.25 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.534 -171.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.27 80.5 3.04 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.996 174.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.482 HG13 ' NH2' ' A' ' 986' ' ' ARG . 22.1 m -135.7 162.04 37.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.016 -174.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -56.13 173.48 0.16 Allowed 'General case' 0 N--CA 1.468 0.466 0 O-C-N 124.526 1.142 . . . . 0.0 111.207 172.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -53.28 -35.57 60.22 Favored 'General case' 0 CA--C 1.493 -1.246 0 C-N-CA 123.689 0.796 . . . . 0.0 111.671 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . 0.449 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 75.6 mmtt -106.46 12.91 29.13 Favored 'General case' 0 N--CA 1.417 -2.101 0 C-N-CA 118.878 -1.129 . . . . 0.0 111.805 -175.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 92.84 -11.46 72.05 Favored Glycine 0 CA--C 1.504 -0.648 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 174.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.51 ' CD2' ' HD2' ' A' 1019 ' ' ARG . 83.1 m95 -54.37 133.29 45.28 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 122.272 1.034 . . . . 0.0 111.848 177.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.673 ' HG2' ' O ' ' A' 1020 ' ' ARG . 5.5 pt-20 -117.82 152.04 36.14 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.579 -1.192 . . . . 0.0 109.864 -178.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.719 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 43.2 t80 -69.4 90.99 0.54 Allowed 'General case' 0 C--O 1.201 -1.451 0 CA-C-N 112.43 -2.168 . . . . 0.0 110.862 -175.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . 0.596 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -114.18 79.91 0.28 Allowed Glycine 0 N--CA 1.436 -1.361 0 C-N-CA 118.952 -1.594 . . . . 0.0 111.874 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -92.88 149.56 4.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 C-N-CA 117.123 -1.831 . . . . 0.0 108.355 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 36.9 m -124.71 98.02 5.54 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.758 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 22.2 pt -74.55 130.32 82.05 Favored Pre-proline 0 C--N 1.319 -0.728 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.479 176.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.51 141.56 42.5 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.914 2.409 . . . . 0.0 113.071 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1001 ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' A' 1002 ' ' ASP . 7.4 Cg_endo -91.29 149.84 18.27 Favored 'Cis proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.406 -1.497 . . . . 0.0 111.534 -2.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1002 ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' 1001 ' ' PRO . 2.6 t70 163.69 160.55 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.987 0 O-C-N 124.972 1.42 . . . . 0.0 107.509 -177.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -134.61 33.88 3.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.314 0.578 . . . . 0.0 109.7 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1004 ' ' LYS . . . . . 0.52 ' HB2' ' HZ2' ' A' 1006 ' ' LYS . 88.3 mttt -158.82 123.54 2.22 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.807 -174.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1005 ' ' PRO . . . . . 0.445 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 33.4 Cg_exo -71.51 133.11 21.75 Favored 'Trans proline' 0 C--O 1.239 0.543 0 C-N-CA 122.278 1.985 . . . . 0.0 110.476 168.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1006 ' ' LYS . . . . . 0.52 ' HZ2' ' HB2' ' A' 1004 ' ' LYS . 54.2 mmtt -94.27 -49.61 5.64 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.141 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 10.3 t -92.08 148.94 21.79 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.243 -177.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.672 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 58.0 m95 -138.37 137.54 37.41 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 176.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.573 ' N ' ' HB3' ' A' ' 995' ' ' TYR . 33.0 t -144.42 169.78 8.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -172.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1010 ' ' ALA . . . . . 0.421 ' N ' HG12 ' A' 1009 ' ' VAL . . . -79.65 -12.96 59.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -179.217 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -91.81 109.42 20.74 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -174.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.535 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 1.0 OUTLIER -81.85 105.11 12.71 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 172.88 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.493 ' H ' ' CE1' ' A' 1016 ' ' HIS . 61.3 mtpt -107.83 161.92 14.47 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.246 -1.343 . . . . 0.0 112.123 -176.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1014 ' ' MET . . . . . 0.452 ' C ' ' H ' ' A' 1016 ' ' HIS . 57.0 ttp -55.15 -44.53 75.21 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.245 -0.889 . . . . 0.0 113.158 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -72.73 18.09 0.1 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.719 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.8 OUTLIER -67.24 114.48 6.0 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.668 172.258 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1017 ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.0 OUTLIER -93.11 -25.27 17.96 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 122.8 1.286 . . . . 0.0 108.173 176.239 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1018 ' ' HIS . . . . . 0.657 ' CD2' ' HB3' ' A' ' 939' ' ' SER . 46.2 m80 -141.75 150.5 41.85 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.879 -1.509 . . . . 0.0 109.937 178.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.51 ' HD2' ' CD2' ' A' ' 993' ' ' TRP . 31.2 ptt180 -141.94 148.84 39.31 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 171.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.673 ' O ' ' HG2' ' A' ' 994' ' ' GLU . 37.7 ttp180 -152.61 165.51 34.97 Favored 'General case' 0 C--N 1.283 -2.283 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.476 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 29.0 ptt180 -155.35 159.26 39.8 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 178.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.524 ' NH1' ' HD3' ' A' ' 986' ' ' ARG . 38.6 ttm180 -86.46 132.81 33.84 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.554 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 45.6 mt -102.35 129.34 48.77 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 104.663 -2.347 . . . . 0.0 104.663 166.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.625 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 20.1 m -109.64 141.92 23.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.495 -171.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.486 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.9 tpt180 -141.12 98.52 3.39 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 114.048 -1.433 . . . . 0.0 107.945 172.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.498 ' CE ' ' HG3' ' A' ' 929' ' ' GLU . 0.3 OUTLIER -71.62 134.76 46.59 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 -177.55 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.664 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.3 ptm180 -128.68 143.15 50.87 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -172.375 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.504 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.0 ttmt -137.89 139.28 39.76 Favored 'General case' 0 C--N 1.283 -2.307 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -172.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.679 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 32.4 ttmt -91.49 -17.52 25.57 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 123.737 1.732 . . . . 0.0 107.561 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1030 ' ' ASP . . . . . 0.451 ' C ' ' H ' ' A' 1032 ' ' THR . 21.5 t70 53.02 8.99 0.11 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 111.37 -2.65 . . . . 0.0 112.48 -169.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.431 ' H ' ' C ' ' A' 1029 ' ' LYS . 22.9 tp 69.4 -33.46 0.25 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.207 1.803 . . . . 0.0 111.75 -176.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1032 ' ' THR . . . . . 0.451 ' H ' ' C ' ' A' 1030 ' ' ASP . 12.6 t -79.03 -3.48 45.36 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -175.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -77.73 -24.95 48.98 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.84 -0.744 . . . . 0.0 111.012 177.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 8.8 t 175.77 148.83 0.1 Allowed 'General case' 0 C--O 1.238 0.471 0 O-C-N 123.939 0.775 . . . . 0.0 109.69 178.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -88.47 -61.0 1.81 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.536 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 7.1 m -141.88 16.57 2.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.744 0.307 . . . . 0.0 111.041 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 16.9 m -118.89 169.95 9.43 Favored 'General case' 0 C--N 1.319 -0.719 0 O-C-N 121.783 -0.573 . . . . 0.0 111.507 -175.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 11.4 p -96.17 139.35 32.46 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 174.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -84.44 9.3 13.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.696 0.76 . . . . 0.0 110.988 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 . . . . . 0 N--CA 1.441 -0.905 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.318 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 69.5 mt . . . . . 0 N--CA 1.469 0.495 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . 0.45 ' HA ' ' HB3' ' A' ' 923' ' ' ALA . 19.2 m-20 66.48 96.11 0.05 OUTLIER Pre-proline 0 N--CA 1.471 0.58 0 C-N-CA 123.984 0.914 . . . . 0.0 112.087 -177.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -63.88 -59.5 0.2 Allowed 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 121.894 1.729 . . . . 0.0 108.724 173.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -123.44 -53.76 1.79 Allowed 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 169.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 11.7 p -145.9 108.06 4.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.687 175.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' A' ' 919' ' ' ASP . . . -85.64 -29.07 24.34 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -110.81 139.17 46.35 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.18 -1.373 . . . . 0.0 109.332 173.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -124.91 11.62 8.36 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.483 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . 0.42 ' O ' HD22 ' A' 1031 ' ' LEU . . . 121.14 44.45 0.4 Allowed Glycine 0 CA--C 1.492 -1.379 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.781 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.451 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 13.6 m-70 -115.29 -150.9 0.47 Allowed 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 172.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.15 108.99 1.94 Allowed 'General case' 0 N--CA 1.412 -2.35 0 N-CA-C 101.428 -3.545 . . . . 0.0 101.428 169.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.465 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.3 OUTLIER -137.39 144.57 42.52 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 178.233 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . 0.482 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.8 t80 -137.39 138.06 39.48 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 105.888 -1.893 . . . . 0.0 105.888 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.567 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 26.9 m -74.08 129.98 38.9 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 176.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . 0.502 ' HB2' ' HD2' ' A' 1027 ' ' ARG . 4.6 t70 -102.34 156.26 17.7 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.509 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.0 pt-20 -150.53 153.64 36.16 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.155 0.502 . . . . 0.0 111.324 -172.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' 1022 ' ' ARG . 9.4 p -146.53 179.01 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 N-CA-C 106.182 -1.784 . . . . 0.0 106.182 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.518 ' HA ' ' O ' ' A' 1021 ' ' ARG . 28.3 m-85 -144.07 113.95 7.25 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 119.653 1.115 . . . . 0.0 111.297 -174.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -81.36 132.78 35.35 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 123.57 0.544 . . . . 0.0 110.211 172.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . 0.471 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 27.6 m-80 -121.55 155.85 34.13 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 124.385 1.074 . . . . 0.0 113.116 -176.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.616 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 42.4 mt-10 -142.29 152.82 43.36 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 105.252 -2.129 . . . . 0.0 105.252 169.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 34.5 m -128.59 144.83 51.23 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 123.488 0.492 . . . . 0.0 111.018 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.492 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 20.7 ptt180 -149.92 161.75 41.68 Favored 'General case' 0 N--CA 1.433 -1.299 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -176.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -66.18 163.15 40.97 Favored Pre-proline 0 C--N 1.312 -1.023 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 172.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -66.64 90.41 0.28 Allowed 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 121.32 1.347 . . . . 0.0 111.271 177.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 97.15 72.19 1.09 Allowed Glycine 0 N--CA 1.434 -1.444 0 N-CA-C 107.88 -2.088 . . . . 0.0 107.88 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.67 -152.57 6.94 Favored Glycine 0 N--CA 1.44 -1.061 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.769 -174.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -108.38 136.29 48.27 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.377 -0.912 . . . . 0.0 109.54 -177.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.628 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 44.8 m95 -85.29 145.81 27.35 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-O 121.782 0.801 . . . . 0.0 109.486 -178.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -127.53 169.11 13.08 Favored Pre-proline 0 C--N 1.298 -1.665 0 N-CA-C 104.232 -2.507 . . . . 0.0 104.232 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -57.68 124.24 15.59 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 121.497 1.464 . . . . 0.0 109.599 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.04 10.7 0.05 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -174.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 79.4 -51.39 0.42 Allowed 'General case' 0 CA--C 1.481 -1.691 0 C-N-CA 124.533 1.133 . . . . 0.0 109.577 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -113.22 94.57 4.94 Favored 'General case' 0 N--CA 1.402 -2.84 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.1 m -72.89 -56.94 4.47 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.216 -173.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -94.92 122.4 37.53 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-O 122.164 0.983 . . . . 0.0 111.694 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 77.4 p -137.77 173.09 12.01 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.503 -173.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -95.85 172.63 7.9 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 171.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.96 -32.37 45.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 119.286 0.948 . . . . 0.0 110.843 174.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -80.39 -2.33 45.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.606 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 89.52 -9.12 78.23 Favored Glycine 0 CA--C 1.496 -1.108 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.843 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -51.8 103.44 0.06 Allowed 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 124.532 0.784 . . . . 0.0 110.733 175.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -51.86 121.91 7.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.444 -1.253 . . . . 0.0 108.472 177.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -123.32 -172.95 2.62 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.177 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -82.97 162.15 21.56 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 963' ' ' SER . . . . . 0.46 ' HB3' ' HD2' ' A' ' 964' ' ' PRO . 3.8 m -88.61 157.63 49.33 Favored Pre-proline 0 N--CA 1.43 -1.429 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.653 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 6.9 Cg_exo -43.03 -32.46 2.8 Favored 'Trans proline' 0 CA--C 1.542 0.884 1 C-N-CA 125.607 4.204 . . . . 0.0 117.901 -174.81 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 19.9 m -86.64 -35.25 19.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 122.194 0.997 . . . . 0.0 108.951 -176.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -72.96 -12.14 60.83 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.31 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 28.2 mt -89.35 110.36 21.17 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 21.1 p -114.25 -172.01 2.02 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.921 -174.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.588 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 15.4 p -114.96 129.49 25.01 Favored Pre-proline 0 C--N 1.317 -0.825 0 O-C-N 121.96 -0.463 . . . . 0.0 111.172 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.569 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 72.8 Cg_endo -70.69 169.82 19.19 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 123.213 2.609 . . . . 0.0 110.826 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -48.09 -33.56 21.28 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.887 2.391 . . . . 0.0 113.659 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.64 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -110.61 34.01 5.61 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-O 119.233 -0.76 . . . . 0.0 113.76 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.588 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 61.0 m95 -146.24 141.13 27.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.922 0.861 . . . . 0.0 110.878 169.192 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.593 ' HB3' ' O ' ' A' 1028 ' ' LYS . 7.5 tp10 -125.56 147.83 49.13 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 -176.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.453 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 63.6 m95 -75.91 143.54 41.62 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 122.237 1.018 . . . . 0.0 112.875 175.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . 0.592 ' HG2' ' HB3' ' A' 1028 ' ' LYS . 2.4 mm-40 -109.41 -44.38 3.91 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.564 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -91.51 159.13 16.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.137 -170.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.22 -52.81 60.73 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.067 0.947 . . . . 0.0 112.889 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -162.92 160.27 24.68 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 -173.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.653 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 23.8 m95 -75.38 116.8 16.48 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 20.8 m -125.15 159.91 30.37 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 -175.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -74.98 134.86 41.39 Favored 'General case' 0 C--N 1.298 -1.634 0 C-N-CA 119.34 -0.944 . . . . 0.0 110.629 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.467 ' HB2' HG11 ' A' 1024 ' ' VAL . 39.7 t0 -82.01 124.78 30.09 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.36 -176.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.0 pp -121.89 11.97 5.87 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 121.71 0.767 . . . . 0.0 110.516 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -87.54 23.26 1.97 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.396 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 37.8 mtp-105 -146.47 -176.82 5.33 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.151 -174.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.38 83.72 7.39 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.467 HG21 ' O ' ' A' ' 983' ' ' ASP . 27.6 m -135.37 160.49 40.22 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.745 -178.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -55.3 169.11 0.29 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.102 0.561 . . . . 0.0 110.006 169.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -59.62 -33.03 70.97 Favored 'General case' 0 CA--C 1.503 -0.842 0 O-C-N 122.012 -0.43 . . . . 0.0 111.64 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -95.36 4.15 53.68 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 119.851 -0.74 . . . . 0.0 111.046 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.07 -21.79 40.42 Favored Glycine 0 C--O 1.223 -0.571 0 CA-C-N 116.575 -0.284 . . . . 0.0 112.827 175.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.507 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 81.8 m95 -50.92 121.88 6.65 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.449 ' HG2' HG13 ' A' ' 988' ' ' VAL . 19.2 mt-10 -98.96 149.45 22.96 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.556 0.694 . . . . 0.0 110.185 177.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.695 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 55.5 t80 -76.5 87.06 3.22 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 126.304 1.842 . . . . 0.0 109.963 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . 0.604 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -112.86 91.44 0.59 Allowed Glycine 0 CA--C 1.485 -1.81 0 C-N-CA 119.966 -1.111 . . . . 0.0 110.359 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.525 HG21 ' HA ' ' A' 1016 ' ' HIS . 9.5 pt -104.48 151.14 7.07 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.521 -175.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.6 t -137.42 135.85 37.29 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 172.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 62.7 mt -117.44 106.21 47.05 Favored Pre-proline 0 C--N 1.313 -0.995 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.94 137.74 69.29 Favored 'Trans proline' 0 C--O 1.241 0.634 0 C-N-CA 122.618 2.212 . . . . 0.0 112.873 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -82.9 141.85 44.76 Favored 'Cis proline' 0 N--CA 1.45 -1.06 0 C-N-CA 122.756 -1.768 . . . . 0.0 113.336 0.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 28.8 t70 -158.36 -98.62 0.03 OUTLIER 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 112.634 -2.076 . . . . 0.0 108.626 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1003 ' ' HIS . . . . . 0.479 ' HD2' ' HB2' ' A' 1004 ' ' LYS . 2.5 p-80 164.08 -45.78 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.719 1.262 . . . . 0.0 113.189 175.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1004 ' ' LYS . . . . . 0.479 ' HB2' ' HD2' ' A' 1003 ' ' HIS . 52.9 mttp -164.86 141.58 4.91 Favored Pre-proline 0 CA--C 1.51 -0.579 0 N-CA-C 106.033 -1.839 . . . . 0.0 106.033 -169.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -50.16 122.33 9.09 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 121.246 1.297 . . . . 0.0 111.409 173.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 37.6 pttt -107.2 5.5 27.78 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.784 -175.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1007 ' ' SER . . . . . 0.448 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 44.7 t -141.63 138.47 32.57 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -176.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.671 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 49.1 m95 -135.39 135.55 40.73 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.53 ' HB ' ' HB3' ' A' ' 995' ' ' TYR . 81.6 t -143.27 166.37 14.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -172.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -88.63 10.05 21.97 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -122.18 130.97 53.7 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 119.091 0.859 . . . . 0.0 112.927 -175.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.58 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 19.1 tp10 -79.09 112.67 16.52 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 122.064 0.935 . . . . 0.0 108.876 175.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.47 ' H ' ' CE1' ' A' 1016 ' ' HIS . 45.0 mttp -125.11 158.91 32.7 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.929 -1.487 . . . . 0.0 110.7 -175.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 45.0 ttp -53.95 -43.74 70.1 Favored 'General case' 0 C--N 1.311 -1.094 0 O-C-N 124.241 0.963 . . . . 0.0 112.952 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -49.7 -11.19 0.05 Allowed 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 175.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.695 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 16.8 m80 -58.93 154.4 15.38 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.86 1.314 . . . . 0.0 112.007 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -160.31 -34.45 0.05 Allowed 'General case' 0 C--N 1.286 -2.161 0 CA-C-N 111.141 -2.754 . . . . 0.0 105.765 -168.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.97 153.0 46.76 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 113.097 -1.865 . . . . 0.0 108.311 174.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.507 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 40.9 ptt180 -160.1 152.57 20.94 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 173.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.54 ' HG2' ' CZ3' ' A' 1008 ' ' TRP . 4.0 ptp180 -152.29 148.64 27.78 Favored 'General case' 0 CA--C 1.486 -1.492 0 C-N-CA 118.352 -1.339 . . . . 0.0 110.309 177.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.518 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.9 ptt180 -124.65 140.63 52.76 Favored 'General case' 0 C--N 1.293 -1.873 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.927 -177.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.52 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 38.7 ttm180 -81.07 123.12 28.12 Favored 'General case' 0 N--CA 1.422 -1.853 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.725 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.55 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 77.2 mt -95.8 127.01 41.46 Favored 'General case' 0 N--CA 1.422 -1.827 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 168.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.467 HG11 ' HB2' ' A' ' 983' ' ' ASP . 3.1 m -106.55 139.6 27.44 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.386 -174.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.515 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.7 tpt180 -143.19 101.4 3.8 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.186 -1.37 . . . . 0.0 107.845 171.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -71.44 147.46 47.84 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.214 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.502 ' HD2' ' HB2' ' A' ' 932' ' ' ASP . 12.1 ptm180 -140.91 151.46 44.27 Favored 'General case' 0 C--O 1.206 -1.213 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -172.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.616 ' HG2' ' H ' ' A' 1030 ' ' ASP . 30.4 ttmt -138.24 140.26 39.59 Favored 'General case' 0 C--O 1.197 -1.705 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 -174.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.64 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 29.3 ttmt -88.92 -4.47 58.45 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.844 0.831 . . . . 0.0 109.557 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1030 ' ' ASP . . . . . 0.616 ' H ' ' HG2' ' A' 1028 ' ' LYS . 2.1 t70 83.15 -68.6 0.06 Allowed 'General case' 0 CA--C 1.498 -1.055 0 CA-C-N 113.041 -1.891 . . . . 0.0 106.25 -173.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 927' ' ' HIS . 34.0 tp 149.9 -29.2 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.706 0 O-C-N 127.171 2.795 . . . . 0.0 108.584 173.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 25.6 p -114.67 14.08 17.5 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.675 0.75 . . . . 0.0 111.218 -170.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' 1029 ' ' LYS . 29.5 tt0 -70.93 -30.59 66.95 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.278 -177.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 2.4 p -106.29 107.06 17.88 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 169.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -77.15 130.3 37.13 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -170.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1036 ' ' SER . . . . . 0.792 ' HB3' ' HA ' ' A' 1040 ' ' ARG . 39.0 m -85.5 86.53 7.36 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 107.516 -1.291 . . . . 0.0 107.516 172.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 14.5 t -96.29 -60.58 1.59 Allowed 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -175.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 29.5 p -99.87 -17.48 17.6 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 121.806 0.813 . . . . 0.0 109.623 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -114.26 -174.86 2.56 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 176.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1040 ' ' ARG . . . . . 0.792 ' HA ' ' HB3' ' A' 1036 ' ' SER . 75.3 ttt180 . . . . . 0 C--O 1.25 1.092 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . 0.437 HD11 ' H2 ' ' A' ' 918' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.523 0 CA-C-O 121.809 0.814 . . . . 0.0 110.565 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . 0.443 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 2.7 m-20 -122.37 135.68 25.77 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.269 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 35.3 Cg_exo -64.44 -31.24 61.84 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 122.836 2.357 . . . . 0.0 112.503 175.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 66.5 -74.62 0.06 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.614 1.165 . . . . 0.0 111.83 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 23.7 p -79.27 -48.36 14.27 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . 0.429 ' HB1' ' HB2' ' A' ' 920' ' ' PRO . . . 58.11 85.61 0.09 Allowed 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 124.656 1.223 . . . . 0.0 110.483 -177.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -73.79 33.96 0.08 Allowed 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 124.142 0.977 . . . . 0.0 112.507 -174.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . 0.401 ' H ' ' C ' ' A' ' 923' ' ' ALA . . . -88.43 93.04 9.4 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 122.991 0.516 . . . . 0.0 111.324 -177.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 64.4 31.52 81.14 Favored Glycine 0 N--CA 1.453 -0.222 0 CA-C-N 115.721 -0.672 . . . . 0.0 114.724 175.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -136.3 142.34 43.89 Favored 'General case' 0 CA--C 1.487 -1.475 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 169.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.4 116.42 32.6 Favored 'General case' 0 N--CA 1.409 -2.495 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 163.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.688 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.5 OUTLIER -126.55 132.24 51.38 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 179.874 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . 0.455 ' O ' ' HG2' ' A' 1027 ' ' ARG . 87.4 t80 -124.52 139.17 54.13 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.4 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 20.5 m -74.19 123.39 24.4 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -97.82 150.31 21.41 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 105.048 -2.205 . . . . 0.0 105.048 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.521 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 9.1 pt-20 -143.66 146.89 33.57 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 118.622 0.647 . . . . 0.0 110.899 -175.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 11.2 p -135.45 174.72 12.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.556 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 59.5 m-85 -135.54 146.38 47.98 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 118.674 0.67 . . . . 0.0 110.54 -175.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.591 ' O ' ' HA ' ' A' 1020 ' ' ARG . 53.2 mt-30 -112.87 116.57 30.23 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 124.567 1.167 . . . . 0.0 108.072 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -101.95 137.64 39.96 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 121.957 0.884 . . . . 0.0 112.312 -177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.514 ' HG2' ' HA ' ' A' ' 948' ' ' PRO . 29.3 mt-10 -138.43 150.48 46.54 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 113.261 -1.791 . . . . 0.0 106.619 170.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 47.1 t -144.4 154.91 43.47 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.132 -169.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.503 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 36.6 ptt180 -141.83 157.38 45.08 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . 0.411 ' C ' ' H ' ' A' ' 943' ' ' GLY . 19.2 m-85 -75.91 172.94 8.03 Favored Pre-proline 0 C--N 1.305 -1.353 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -66.73 48.74 0.29 Allowed 'Trans proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.99 2.46 . . . . 0.0 112.259 171.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . 0.579 ' HA2' ' SD ' ' A' 1014 ' ' MET . . . 155.98 37.15 0.02 OUTLIER Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.537 -176.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . 0.503 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -132.62 -173.39 13.29 Favored Glycine 0 CA--C 1.499 -0.949 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -120.14 165.92 14.12 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 174.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.495 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 34.3 m95 -72.56 124.52 25.4 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-O 121.15 0.5 . . . . 0.0 110.306 -173.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -124.97 159.7 57.75 Favored Pre-proline 0 C--N 1.304 -1.388 0 N-CA-C 104.411 -2.44 . . . . 0.0 104.411 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.514 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 88.4 Cg_exo -49.08 138.85 27.42 Favored 'Trans proline' 0 CA--C 1.527 0.152 0 C-N-CA 122.226 1.951 . . . . 0.0 112.493 -178.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -76.78 -161.78 0.22 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.585 -178.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -95.84 -38.24 10.38 Favored 'General case' 0 CA--C 1.481 -1.679 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . 0.7 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 27.8 m-20 -116.45 100.71 8.06 Favored 'General case' 0 N--CA 1.404 -2.726 0 N-CA-C 104.588 -2.375 . . . . 0.0 104.588 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 7.4 m -60.03 -56.78 17.49 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 123.689 0.618 . . . . 0.0 111.421 -172.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . 0.556 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 92.8 m-85 -103.86 135.3 45.65 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-O 121.455 0.645 . . . . 0.0 111.56 -179.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 76.7 p -148.98 -176.05 5.19 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -174.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -106.19 -174.22 2.48 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 173.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.6 -31.05 34.46 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 175.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -77.72 -50.24 12.8 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.959 -0.463 . . . . 0.0 111.215 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 133.65 -3.02 4.6 Favored Glycine 0 CA--C 1.494 -1.28 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -177.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -58.35 107.3 0.47 Allowed 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.174 -1.013 . . . . 0.0 109.678 175.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . 0.7 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 26.2 tptp -47.16 112.69 0.56 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 113.709 -1.587 . . . . 0.0 110.12 175.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -112.68 178.7 4.2 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.279 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . 0.46 ' HB2' ' HB2' ' A' ' 966' ' ' GLU . . . -71.48 155.84 40.13 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 5.9 p -77.81 162.43 67.82 Favored Pre-proline 0 N--CA 1.434 -1.256 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -58.61 -25.6 75.52 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.779 2.319 . . . . 0.0 112.559 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 1.2 m -68.35 -49.93 56.74 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . 0.46 ' HB2' ' HB2' ' A' ' 962' ' ' ALA . 47.4 mt-10 -64.66 -33.92 77.08 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.26 -1.336 . . . . 0.0 112.68 177.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.479 HD11 ' CH2' ' A' ' 980' ' ' TRP . 69.4 mt -67.29 112.16 4.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.811 0.815 . . . . 0.0 111.929 -178.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 21.7 p -117.4 171.19 8.15 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.286 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 19.2 p -87.1 138.54 32.57 Favored Pre-proline 0 C--N 1.319 -0.755 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.637 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.563 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 68.9 Cg_endo -82.88 163.61 15.87 Favored 'Trans proline' 0 C--O 1.243 0.734 0 C-N-CA 122.365 2.043 . . . . 0.0 111.083 178.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . 0.642 ' HA ' ' OG ' ' A' 1036 ' ' SER . 31.4 Cg_exo -61.82 102.98 0.26 Allowed 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 121.928 1.752 . . . . 0.0 110.15 173.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.462 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 127.21 -7.64 7.14 Favored Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.468 -0.873 . . . . 0.0 111.159 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.563 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.6 m95 -136.49 139.8 42.57 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.611 0.72 . . . . 0.0 111.105 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.559 ' HB2' HE21 ' A' 1033 ' ' GLN . 9.2 tp10 -123.66 136.9 54.75 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 126.26 1.824 . . . . 0.0 108.539 -173.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.617 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 91.3 m95 -84.6 158.73 20.79 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 119.436 1.016 . . . . 0.0 110.724 175.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -139.99 -36.78 0.49 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.09 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . 0.562 ' HB3' ' HD2' ' A' 1025 ' ' ARG . 9.9 t70 -67.43 150.52 48.8 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -68.32 -43.72 76.97 Favored 'General case' 0 C--N 1.314 -0.941 0 O-C-N 123.161 0.288 . . . . 0.0 111.577 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.07 159.27 12.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.749 0.309 . . . . 0.0 110.494 -172.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.55 ' HA ' ' O ' ' A' 1024 ' ' VAL . 17.1 m95 -76.43 91.45 3.31 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -177.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 18.5 t -103.45 162.11 13.3 Favored 'General case' 0 C--O 1.205 -1.254 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . 0.405 ' HA ' ' O ' ' A' 1022 ' ' ARG . 8.2 p90 -73.55 139.27 45.52 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 121.646 0.736 . . . . 0.0 111.801 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.442 ' HB2' HG12 ' A' 1024 ' ' VAL . 26.2 t70 -99.89 130.88 46.12 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.406 -175.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.45 ' HA ' HG23 ' A' ' 988' ' ' VAL . 2.4 pp -114.85 18.79 7.4 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.884 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.99 34.3 1.39 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -175.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.41 ' HB2' HG12 ' A' ' 988' ' ' VAL . 63.1 mtp180 -145.47 179.91 7.1 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -177.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -81.8 82.09 7.6 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 172.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.45 HG23 ' HA ' ' A' ' 984' ' ' ILE . 18.6 m -128.96 -170.79 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.794 -173.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -96.39 -172.23 2.48 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 105.265 -2.124 . . . . 0.0 105.265 -178.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -58.28 -33.42 69.41 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 122.94 0.496 . . . . 0.0 111.155 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -112.12 23.79 13.33 Favored 'General case' 0 N--CA 1.427 -1.601 0 C-N-CA 118.761 -1.176 . . . . 0.0 112.927 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 90.78 -11.91 70.38 Favored Glycine 0 C--O 1.229 -0.212 0 C-N-CA 120.112 -1.042 . . . . 0.0 112.899 173.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.556 ' HE3' ' HG2' ' A' 1019 ' ' ARG . 94.8 m95 -52.18 143.85 13.61 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 175.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.583 ' O ' ' HG3' ' A' 1019 ' ' ARG . 9.6 pt-20 -130.3 143.28 50.68 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 174.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.526 ' CD2' ' HA ' ' A' 1011 ' ' ALA . 1.4 t80 -104.54 115.96 31.25 Favored 'General case' 0 C--N 1.285 -2.226 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.894 -165.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . 0.426 ' HA2' ' O ' ' A' 1007 ' ' SER . . . -132.63 144.76 16.68 Favored Glycine 0 N--CA 1.435 -1.383 0 CA-C-O 122.016 0.787 . . . . 0.0 112.354 -177.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.612 HG23 ' CD2' ' A' 1016 ' ' HIS . 0.1 OUTLIER -93.24 173.66 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.502 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 998' ' ' THR . . . . . 0.402 ' HG1' ' HG3' ' A' 1005 ' ' PRO . 39.6 m -169.17 98.63 0.36 Allowed 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 104.995 -2.224 . . . . 0.0 104.995 178.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.435 ' O ' ' HB2' ' A' 1002 ' ' ASP . 68.0 mt -116.11 108.71 45.66 Favored Pre-proline 0 C--N 1.314 -0.969 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 -175.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.03 140.4 78.63 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 123.38 2.72 . . . . 0.0 113.609 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -76.17 150.28 93.33 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.029 -1.655 . . . . 0.0 111.295 -1.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1002 ' ' ASP . . . . . 0.44 ' CG ' ' H ' ' A' 1003 ' ' HIS . 8.5 t70 -172.15 -153.69 0.08 Allowed 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.14 -0.936 . . . . 0.0 108.899 -172.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1003 ' ' HIS . . . . . 0.44 ' H ' ' CG ' ' A' 1002 ' ' ASP . 4.3 m170 -151.87 -82.48 0.09 Allowed 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.44 0.696 . . . . 0.0 110.351 -178.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 80.6 mttt -128.84 154.4 80.05 Favored Pre-proline 0 C--N 1.309 -1.188 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 177.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1005 ' ' PRO . . . . . 0.402 ' HG3' ' HG1' ' A' ' 998' ' ' THR . 52.4 Cg_exo -55.52 125.34 18.81 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 121.888 1.725 . . . . 0.0 111.305 174.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 20.4 pttp -100.06 4.51 44.72 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.313 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1007 ' ' SER . . . . . 0.426 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 48.5 t -142.89 122.99 13.65 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.217 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.498 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 66.8 m95 -122.89 133.15 54.42 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.36 1.464 . . . . 0.0 107.055 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 15.8 m -143.98 -164.98 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -178.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -91.64 -35.31 14.28 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 120.246 1.385 . . . . 0.0 110.045 174.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1011 ' ' ALA . . . . . 0.526 ' HA ' ' CD2' ' A' ' 995' ' ' TYR . . . 171.72 172.66 0.09 Allowed 'General case' 0 CA--C 1.508 -0.64 0 O-C-N 123.81 0.694 . . . . 0.0 111.962 -172.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' 1013 ' ' LYS . 10.9 pt-20 160.22 -61.93 0.0 OUTLIER 'General case' 0 C--N 1.345 0.4 0 O-C-N 126.691 2.494 . . . . 0.0 112.626 174.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.42 ' N ' ' HG3' ' A' 1012 ' ' GLU . 59.1 mttp -131.14 149.56 52.54 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -165.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1014 ' ' MET . . . . . 0.579 ' SD ' ' HA2' ' A' ' 943' ' ' GLY . 59.4 ttp -65.02 -23.96 67.36 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.738 -1.574 . . . . 0.0 112.63 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1015 ' ' TYR . . . . . 0.429 ' O ' HG22 ' A' ' 997' ' ' ILE . 60.2 m-85 -61.06 -6.94 2.18 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 175.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.612 ' CD2' HG23 ' A' ' 997' ' ' ILE . 16.1 m80 -90.71 106.08 18.26 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.656 -2.35 . . . . 0.0 104.656 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 17.9 p -100.24 -6.45 26.0 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -169.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 13.6 m170 -129.45 142.5 50.77 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 122.062 -0.399 . . . . 0.0 110.826 -174.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 994' ' ' GLU . 10.4 ttm180 -150.94 146.99 26.63 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 177.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.591 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 3.5 ptp180 -148.55 166.51 28.02 Favored 'General case' 0 C--O 1.199 -1.566 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 177.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.55 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 23.7 ptt180 -146.35 150.85 36.49 Favored 'General case' 0 C--N 1.287 -2.128 0 O-C-N 123.389 0.431 . . . . 0.0 110.005 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.521 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.4 ttm180 -88.91 129.57 35.59 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 123.487 0.492 . . . . 0.0 111.422 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.553 HD23 ' OE1' ' A' ' 936' ' ' GLN . 70.8 mt -104.98 137.71 42.32 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 105.217 -2.142 . . . . 0.0 105.217 165.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.55 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 12.8 m -113.16 141.24 29.52 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 CA-C-O 122.027 0.918 . . . . 0.0 111.958 -176.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.562 ' HD2' ' HB3' ' A' ' 977' ' ' ASP . 11.8 tpt180 -138.7 100.69 4.14 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 113.579 -1.646 . . . . 0.0 106.682 172.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -74.14 146.22 43.67 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -178.186 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.617 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 10.3 ptm180 -142.62 166.65 24.08 Favored 'General case' 0 CA--C 1.493 -1.234 0 N-CA-C 105.842 -1.91 . . . . 0.0 105.842 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.688 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 13.3 ptpt -156.13 155.8 33.16 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-O 121.033 0.445 . . . . 0.0 110.348 -178.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.462 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 29.3 ttmt -83.73 -21.65 32.21 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 22.0 t70 44.36 23.51 0.07 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 111.298 -2.683 . . . . 0.0 112.024 -171.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 23.0 tp 66.12 -39.42 0.32 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.097 2.159 . . . . 0.0 113.455 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 9.8 t -69.95 -22.58 63.16 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 123.132 0.573 . . . . 0.0 112.092 -176.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.559 HE21 ' HB2' ' A' ' 974' ' ' GLU . 21.1 mt-30 -99.74 127.19 45.88 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 119.018 -1.073 . . . . 0.0 112.489 178.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 17.7 m -143.48 -23.11 0.6 Allowed 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.074 -1.421 . . . . 0.0 107.234 170.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -141.94 162.83 34.51 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 174.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1036 ' ' SER . . . . . 0.642 ' OG ' ' HA ' ' A' ' 971' ' ' PRO . 39.0 m -129.17 25.73 5.5 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.649 0.737 . . . . 0.0 110.416 -178.029 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 15.4 m -112.54 35.29 3.89 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -177.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 4.3 m -66.55 -38.78 87.83 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.345 -175.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -95.73 138.92 32.7 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.732 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 . . . . . 0 N--CA 1.443 -0.817 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.792 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.469 0.519 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -82.42 150.64 64.05 Favored Pre-proline 0 C--N 1.317 -0.814 0 CA-C-N 116.374 -0.376 . . . . 0.0 109.992 -176.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.65 111.25 2.08 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.112 2.541 . . . . 0.0 112.483 -177.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -80.52 -20.03 44.45 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.083 -1.417 . . . . 0.0 108.284 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 8.9 t -76.9 -8.73 57.89 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.684 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . 65.28 -74.45 0.05 Allowed 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.755 1.222 . . . . 0.0 111.649 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . 0.4 ' HA ' ' HD2' ' A' ' 927' ' ' HIS . 22.1 t70 -87.52 100.39 12.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.396 0.617 . . . . 0.0 110.683 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -111.0 12.43 22.09 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.295 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 130.17 73.43 0.13 Allowed Glycine 0 N--CA 1.44 -1.049 0 N-CA-C 109.159 -1.577 . . . . 0.0 109.159 -174.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.4 ' HD2' ' HA ' ' A' ' 924' ' ' ASP . 49.4 m-70 -158.9 -60.39 0.07 Allowed 'General case' 0 CA--C 1.488 -1.433 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -175.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 928' ' ' THR . . . . . 0.406 ' HB ' ' HE3' ' A' 1029 ' ' LYS . 1.5 m 63.34 87.58 0.11 Allowed 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 124.601 1.188 . . . . 0.0 107.843 -165.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.815 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.4 OUTLIER -102.75 168.19 9.4 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 179.652 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . 0.629 ' O ' ' HG2' ' A' 1027 ' ' ARG . 89.5 t80 -153.98 120.86 5.62 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 10.2 m -79.23 121.64 25.31 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 174.029 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -103.51 146.12 29.01 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 104.944 -2.243 . . . . 0.0 104.944 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.432 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -145.42 147.91 32.74 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 118.331 0.514 . . . . 0.0 110.965 -173.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 4.6 p -151.88 134.02 5.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 120.981 0.42 . . . . 0.0 110.085 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.562 ' HA ' ' O ' ' A' 1021 ' ' ARG . 94.9 m-85 -93.4 152.1 19.33 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -175.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.575 ' HG2' ' CE1' ' A' ' 953' ' ' TYR . 21.5 mt-30 -112.09 113.69 26.1 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 105.434 -2.062 . . . . 0.0 105.434 174.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . 0.482 ' HB3' ' HB1' ' A' ' 949' ' ' ALA . 12.2 m-80 -106.34 139.42 40.86 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -176.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.599 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 85.3 mt-10 -135.07 152.67 51.89 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 176.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 50.5 m -145.34 137.47 25.67 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.163 0.506 . . . . 0.0 111.596 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.542 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 18.3 ptt180 -139.82 161.63 37.11 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 124.446 1.098 . . . . 0.0 108.084 -174.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -65.29 161.56 48.61 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 170.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -66.21 86.73 0.25 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 121.458 1.439 . . . . 0.0 111.912 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 99.85 70.04 0.92 Allowed Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 107.728 -2.149 . . . . 0.0 107.728 -175.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -166.08 -148.04 5.41 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.57 -173.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -110.77 128.4 55.73 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 122.737 0.415 . . . . 0.0 110.984 -176.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.599 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 56.1 m95 -73.53 152.73 40.55 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-O 121.835 0.826 . . . . 0.0 109.695 176.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -133.57 169.18 14.62 Favored Pre-proline 0 C--N 1.3 -1.549 0 N-CA-C 103.452 -2.795 . . . . 0.0 103.452 171.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.2 124.4 16.16 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 N-CA-C 107.959 -1.593 . . . . 0.0 107.959 170.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . 0.482 ' HB1' ' HB3' ' A' ' 937' ' ' ASN . . . -37.68 -58.25 0.91 Allowed 'General case' 0 N--CA 1.483 1.215 0 O-C-N 124.877 1.361 . . . . 0.0 113.894 -171.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -168.29 -39.81 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 104.633 -2.358 . . . . 0.0 104.633 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -131.31 160.17 35.75 Favored 'General case' 0 N--CA 1.434 -1.259 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 168.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.0 m -93.65 -57.8 2.46 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 118.205 0.457 . . . . 0.0 110.391 -175.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . 0.575 ' CE1' ' HG2' ' A' ' 936' ' ' GLN . 58.3 m-85 -97.46 127.4 43.39 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 122.008 0.909 . . . . 0.0 110.729 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 954' ' ' THR . . . . . 0.485 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 1.1 p -144.0 167.14 23.08 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.31 -170.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -97.63 -173.68 2.7 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . 0.493 ' HA ' ' CE1' ' A' ' 935' ' ' TYR . . . -51.25 -27.18 8.54 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . 0.51 HD22 ' HB2' ' A' ' 959' ' ' ASP . 23.1 p-10 -92.78 -37.74 12.17 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.293 0.568 . . . . 0.0 111.518 178.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . 0.485 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 110.38 52.15 0.6 Allowed Glycine 0 CA--C 1.484 -1.864 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 -173.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . 0.51 ' HB2' HD22 ' A' ' 957' ' ' ASN . 17.7 t70 -121.07 106.38 11.51 Favored 'General case' 0 N--CA 1.419 -2.004 0 N-CA-C 100.977 -3.712 . . . . 0.0 100.977 176.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -44.21 123.89 3.67 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 124.926 1.391 . . . . 0.0 112.251 -176.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -121.93 -174.93 2.99 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 113.318 -1.764 . . . . 0.0 108.933 -175.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . 0.495 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -71.8 147.88 46.8 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 3.7 m -75.29 158.72 83.5 Favored Pre-proline 0 C--N 1.313 -1.018 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.582 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 29.2 Cg_exo -54.75 -21.49 25.66 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.916 2.411 . . . . 0.0 114.428 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 5.7 p -74.27 -49.44 23.15 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.78 0.8 . . . . 0.0 109.31 175.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . 0.495 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 32.6 mt-10 -65.36 -30.01 70.79 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.295 -1.32 . . . . 0.0 110.666 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.47 HD13 ' HA ' ' A' ' 964' ' ' PRO . 71.4 mt -67.49 111.74 4.29 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.284 0.634 . . . . 0.0 109.557 176.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.2 p -116.55 168.51 10.11 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -171.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 5.8 p -96.86 121.9 58.17 Favored Pre-proline 0 N--CA 1.44 -0.973 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.369 175.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.598 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 28.9 Cg_endo -82.8 175.56 8.56 Favored 'Trans proline' 0 C--O 1.242 0.686 0 C-N-CA 123.92 3.08 . . . . 0.0 111.198 178.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.86 111.05 0.85 Allowed 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 122.15 1.9 . . . . 0.0 111.645 176.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.604 ' HA3' HG23 ' A' 1034 ' ' THR . . . 108.69 -3.54 32.32 Favored Glycine 0 N--CA 1.431 -1.653 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.852 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.598 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 97.3 m95 -120.4 122.62 41.15 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 122.405 1.098 . . . . 0.0 112.688 -178.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.563 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 7.5 tp10 -108.18 123.18 48.34 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 126.953 2.101 . . . . 0.0 111.599 -172.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 24.0 m95 -78.95 105.84 10.55 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.699 172.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . 0.473 ' CD ' ' HE3' ' A' 1028 ' ' LYS . 38.9 mt-10 -73.4 -43.94 59.46 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 121.581 0.705 . . . . 0.0 109.663 175.083 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.02 146.18 54.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.466 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -76.62 -32.11 57.84 Favored 'General case' 0 C--N 1.318 -0.785 0 O-C-N 123.462 0.476 . . . . 0.0 110.84 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -163.43 157.23 19.62 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.582 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 27.1 m95 -72.93 113.22 9.72 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 177.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 18.8 m -120.45 150.36 40.93 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 -172.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . 0.486 ' HA ' ' O ' ' A' 1022 ' ' ARG . 0.3 OUTLIER -74.2 126.57 30.9 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.688 0.756 . . . . 0.0 110.727 -175.675 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -83.03 143.19 30.78 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-N 113.516 -1.675 . . . . 0.0 111.041 -167.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 15.6 pt -133.66 23.45 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.942 0.877 . . . . 0.0 109.38 176.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . 0.429 ' O ' ' HD3' ' A' ' 986' ' ' ARG . 3.4 t-20 -96.12 13.94 25.55 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 178.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.429 ' HD3' ' O ' ' A' ' 985' ' ' ASN . 1.0 OUTLIER -134.02 177.46 7.72 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 114.243 -1.344 . . . . 0.0 107.414 -175.071 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -88.27 82.17 7.14 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.926 0.869 . . . . 0.0 109.471 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.465 HG13 ' HG2' ' A' ' 994' ' ' GLU . 15.4 m -138.49 164.64 26.29 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 114.147 -1.388 . . . . 0.0 109.373 -177.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -55.44 169.98 0.26 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.923 0.489 . . . . 0.0 110.494 171.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -58.61 -30.92 67.6 Favored 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 121.911 -0.493 . . . . 0.0 111.664 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . 0.484 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 48.1 mttm -98.67 9.86 42.37 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 119.414 -0.915 . . . . 0.0 110.868 178.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.69 -13.98 65.28 Favored Glycine 0 C--O 1.226 -0.357 0 CA-C-N 116.724 -0.217 . . . . 0.0 112.646 174.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.484 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 85.1 m95 -51.54 130.97 29.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.844 0.83 . . . . 0.0 112.718 178.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.465 ' HG2' HG13 ' A' ' 988' ' ' VAL . 29.5 mt-10 -107.96 155.79 19.93 Favored 'General case' 0 C--O 1.251 1.148 0 C-N-CA 124.042 0.937 . . . . 0.0 109.413 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.607 ' O ' ' HA ' ' A' 1008 ' ' TRP . 26.2 t80 -81.08 96.72 7.25 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 112.456 -2.156 . . . . 0.0 110.216 -177.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -121.86 106.06 1.05 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 118.863 -1.637 . . . . 0.0 111.86 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.511 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -111.0 151.1 13.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 O-C-N 120.931 -1.335 . . . . 0.0 108.484 178.539 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 5.2 m -127.69 103.3 7.23 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 176.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 62.9 mt -80.64 123.42 82.61 Favored Pre-proline 0 C--N 1.318 -0.803 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -61.84 142.16 92.52 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.462 2.108 . . . . 0.0 112.938 -178.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -96.87 145.96 6.24 Favored 'Cis proline' 0 N--CA 1.452 -0.938 0 C-N-CA 123.366 -1.514 . . . . 0.0 113.636 -2.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 6.6 t70 168.28 -179.54 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 104.435 -2.431 . . . . 0.0 104.435 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -132.37 -33.86 1.25 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 118.861 0.755 . . . . 0.0 112.074 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 79.3 mttt -112.8 132.51 22.25 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -177.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -59.61 134.31 57.04 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 123.179 2.586 . . . . 0.0 109.99 168.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -116.94 15.86 15.16 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 122.434 1.112 . . . . 0.0 109.196 -177.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 41.9 t -148.01 137.81 22.51 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 113.948 -1.478 . . . . 0.0 108.235 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.607 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 56.5 m95 -136.17 137.34 40.82 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.49 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 47.0 t -143.21 178.65 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 N-CA-C 104.183 -2.525 . . . . 0.0 104.183 -173.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1010 ' ' ALA . . . . . 0.471 ' H ' HG13 ' A' 1009 ' ' VAL . . . -99.83 4.34 45.16 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 120.072 1.305 . . . . 0.0 112.657 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -86.59 -168.29 2.18 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 121.736 -0.602 . . . . 0.0 112.294 -178.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.552 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.4 OUTLIER -159.39 106.8 1.75 Allowed 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.735 0.778 . . . . 0.0 108.954 -174.739 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.416 ' H ' ' CE1' ' A' 1016 ' ' HIS . 98.2 mttt -113.55 148.32 36.34 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.761 -178.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 51.7 ttp -47.67 -39.14 16.49 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 124.146 0.904 . . . . 0.0 112.158 176.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -61.37 -0.35 0.37 Allowed 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.552 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 2.9 m80 -61.83 118.95 7.86 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 178.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1017 ' ' THR . . . . . 0.522 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 25.4 p -104.79 -18.45 14.25 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.736 174.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 5.1 m80 -140.93 151.18 44.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.9 -177.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -156.94 151.88 26.0 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 170.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.441 ' HB3' ' OD1' ' A' ' 937' ' ' ASN . 6.1 ptp180 -151.26 163.84 37.96 Favored 'General case' 0 C--O 1.187 -2.199 0 C-N-CA 118.886 -1.126 . . . . 0.0 109.567 175.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.562 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 25.6 ptt180 -141.75 148.62 39.29 Favored 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.919 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 982' ' ' TYR . 41.3 ttm180 -90.42 122.11 32.99 Favored 'General case' 0 N--CA 1.44 -0.933 0 O-C-N 123.525 0.515 . . . . 0.0 111.684 -178.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.581 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 83.6 mt -91.58 129.59 37.53 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 106.009 -1.849 . . . . 0.0 106.009 166.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1024 ' ' VAL . . . . . . . . . . . . . 8.0 m -112.16 137.45 44.86 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 CA-C-O 122.219 1.009 . . . . 0.0 111.518 -177.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.451 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 6.3 tpt180 -137.06 101.32 4.52 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 113.1 -1.863 . . . . 0.0 108.278 171.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -82.1 148.9 28.3 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.629 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 11.5 ptm180 -144.07 179.24 7.33 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 104.915 -2.254 . . . . 0.0 104.915 -171.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.815 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 15.8 ptpt -162.17 160.71 27.45 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 175.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 972' ' ' GLY . 35.6 ttmt -87.81 -16.47 34.01 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-O 123.027 1.394 . . . . 0.0 107.758 -177.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 22.7 t70 55.46 16.56 1.85 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 112.019 -2.355 . . . . 0.0 110.661 -172.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 37.8 tp 62.51 -56.62 0.14 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.583 1.553 . . . . 0.0 112.26 -172.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 11.6 p -87.1 0.61 54.99 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 -172.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.563 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 47.6 mt-30 -76.04 -17.53 59.62 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 118.16 -1.416 . . . . 0.0 110.302 174.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1034 ' ' THR . . . . . 0.604 HG23 ' HA3' ' A' ' 972' ' ' GLY . 12.4 p -100.08 131.73 45.86 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 171.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -72.2 100.2 2.52 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 174.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 49.3 m -135.13 -31.31 1.0 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.168 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 10.1 m -79.33 108.63 12.99 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 5.1 p -91.7 158.19 16.52 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.054 -173.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -107.35 -31.66 8.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.308 -177.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1040 ' ' ARG . . . . . 0.545 ' HA ' ' NE ' ' A' 1040 ' ' ARG . 1.0 OUTLIER . . . . . 0 C--O 1.242 0.69 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.634 -178.256 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 35.9 pt . . . . . 0 N--CA 1.471 0.588 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . 0.752 ' HB2' ' HB ' ' A' ' 922' ' ' THR . 14.7 m-20 -140.54 151.86 64.77 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 -178.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -55.81 -55.15 3.2 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.978 2.452 . . . . 0.0 113.672 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -97.02 -26.65 14.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.037 0.446 . . . . 0.0 109.991 -176.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 922' ' ' THR . . . . . 0.752 ' HB ' ' HB2' ' A' ' 919' ' ' ASP . 4.2 m -90.22 35.33 0.86 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 122.079 0.942 . . . . 0.0 109.37 176.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -72.17 -34.14 68.24 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.107 176.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -109.12 125.09 51.79 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.702 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -110.74 15.32 21.99 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.781 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 117.26 59.0 0.3 Allowed Glycine 0 CA--C 1.498 -1.019 0 C-N-CA 120.329 -0.939 . . . . 0.0 111.795 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.505 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 42.2 m-70 -117.54 -138.11 0.36 Allowed 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 106.155 -1.795 . . . . 0.0 106.155 176.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -168.58 116.98 0.7 Allowed 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 169.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -137.58 129.77 29.21 Favored 'General case' 0 C--N 1.288 -2.07 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 174.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -121.55 138.12 54.44 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.559 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 31.3 m -77.84 122.34 25.32 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 175.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -96.56 175.02 6.55 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.655 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.6 pt-20 -168.83 143.72 3.24 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.497 0.665 . . . . 0.0 110.958 -171.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.454 ' O ' ' HA ' ' A' 1022 ' ' ARG . 13.0 p -135.47 -177.61 2.08 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 173.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.57 ' HA ' ' O ' ' A' 1021 ' ' ARG . 87.3 m-85 -137.27 146.18 44.42 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 118.862 0.755 . . . . 0.0 109.09 -178.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.493 ' O ' ' HA ' ' A' 1020 ' ' ARG . 30.9 tt0 -116.81 118.05 31.42 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 -179.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 -109.18 142.33 40.13 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-O 122.141 0.972 . . . . 0.0 111.536 -175.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.568 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 62.0 mt-10 -128.95 162.57 27.26 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 170.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 38.1 m -146.89 152.75 39.2 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.978 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' 1017 ' ' THR . 25.9 ptt180 -149.45 159.84 43.95 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 114.947 -1.024 . . . . 0.0 108.876 177.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -75.82 161.71 74.82 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 170.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . 0.422 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 23.0 Cg_exo -66.42 92.91 0.29 Allowed 'Trans proline' 0 N--CA 1.458 -0.586 0 N-CA-C 109.169 -1.127 . . . . 0.0 109.169 171.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 119.68 11.03 7.38 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -172.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -109.45 -174.07 21.01 Favored Glycine 0 CA--C 1.498 -0.988 0 N-CA-C 108.203 -1.959 . . . . 0.0 108.203 176.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -120.97 159.26 25.97 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 105.561 -2.014 . . . . 0.0 105.561 170.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.568 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 43.0 m95 -71.07 125.96 28.29 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-O 121.428 0.633 . . . . 0.0 111.374 -172.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -114.9 172.54 3.53 Favored Pre-proline 0 C--N 1.299 -1.607 0 N-CA-C 102.634 -3.099 . . . . 0.0 102.634 170.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -54.73 147.66 49.01 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 CA-C-N 121.649 1.624 . . . . 0.0 111.848 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -69.35 -170.06 0.25 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.777 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.21 -29.01 13.45 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 -179.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -120.53 88.15 2.88 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 103.765 -2.68 . . . . 0.0 103.765 173.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 20.5 m -62.03 -51.97 65.87 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.004 -172.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 79.8 m-85 -103.31 133.9 47.61 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 119.551 -0.86 . . . . 0.0 111.097 177.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 72.7 p -142.91 174.77 10.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.48 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -109.81 -173.48 2.27 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.84 -36.19 36.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 114.044 1.128 . . . . 0.0 114.044 -174.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -101.34 11.13 39.79 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 92.78 0.18 69.31 Favored Glycine 0 CA--C 1.497 -1.042 0 C-N-CA 119.53 -1.319 . . . . 0.0 111.578 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -56.82 104.11 0.14 Allowed 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 174.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . 0.473 ' HD3' ' C ' ' A' ' 960' ' ' LYS . 7.8 tmtm? -49.52 118.5 2.8 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 124.158 0.911 . . . . 0.0 108.887 176.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -121.71 176.0 5.95 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.13 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -66.32 149.9 49.68 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 123.638 0.586 . . . . 0.0 110.661 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 15.6 m -85.38 156.73 59.44 Favored Pre-proline 0 N--CA 1.437 -1.119 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.503 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.3 Cg_exo -48.16 -32.81 19.85 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.397 3.398 . . . . 0.0 116.636 -173.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.6 p -75.81 -45.33 36.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.461 1.124 . . . . 0.0 109.437 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -65.2 -27.26 68.56 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.037 -1.892 . . . . 0.0 110.585 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.467 HD13 ' CH2' ' A' ' 980' ' ' TRP . 33.1 mt -71.49 120.6 17.31 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.061 0.944 . . . . 0.0 110.371 175.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 26.1 p -125.07 170.94 10.68 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.979 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 6.6 p -82.87 148.53 57.52 Favored Pre-proline 0 C--N 1.315 -0.925 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.998 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.549 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 20.0 Cg_endo -91.6 165.75 3.42 Favored 'Trans proline' 0 C--O 1.239 0.568 0 C-N-CA 123.004 2.469 . . . . 0.0 111.267 174.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.11 108.33 1.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 121.709 1.606 . . . . 0.0 110.579 174.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.601 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 118.93 1.71 14.45 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 120.908 -0.663 . . . . 0.0 111.859 -177.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.549 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 90.1 m95 -137.43 137.54 38.87 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 122.2 1.0 . . . . 0.0 111.161 177.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.586 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 9.4 tp10 -118.23 143.23 46.71 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.155 -1.839 . . . . 0.0 106.115 -174.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.518 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 98.7 m95 -83.53 153.77 24.2 Favored 'General case' 0 C--N 1.296 -1.736 0 O-C-N 120.693 -1.255 . . . . 0.0 110.418 171.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -121.55 -42.2 2.45 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . 0.748 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 1.6 m-20 -77.05 155.83 32.22 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.432 178.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -75.81 -56.72 4.41 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -171.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -156.54 147.88 22.37 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -175.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.503 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 17.6 m95 -61.39 120.43 10.45 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 124.167 0.917 . . . . 0.0 109.295 -172.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 981' ' ' SER . . . . . 0.6 ' O ' ' HA ' ' A' 1023 ' ' LEU . 42.4 m -111.63 -166.69 1.1 Allowed 'General case' 0 C--O 1.201 -1.45 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 17.6 p90 -109.82 154.34 23.13 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 119.825 1.193 . . . . 0.0 112.208 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.52 ' HB3' ' HB3' ' A' 1022 ' ' ARG . 9.0 t70 -99.89 131.57 45.78 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.672 -171.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 30.8 pt -119.87 28.32 3.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 122.209 1.004 . . . . 0.0 109.011 173.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -106.4 24.35 12.69 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 123.012 1.387 . . . . 0.0 108.963 -175.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -139.5 -177.61 5.02 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 -179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -83.93 80.76 9.05 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 172.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.896 HG13 ' HG2' ' A' ' 994' ' ' GLU . 29.2 m -135.97 156.14 36.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.352 -170.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.37 170.14 0.16 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.956 170.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -52.62 -34.18 49.93 Favored 'General case' 0 CA--C 1.498 -1.02 0 C-N-CA 123.479 0.711 . . . . 0.0 111.239 176.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . 0.424 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 84.5 mttt -98.35 2.97 48.54 Favored 'General case' 0 N--CA 1.422 -1.842 0 CA-C-N 114.924 -1.035 . . . . 0.0 111.947 -176.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 100.67 -16.08 57.94 Favored Glycine 0 C--O 1.223 -0.576 0 C-N-CA 121.27 -0.49 . . . . 0.0 111.888 178.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.71 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 71.3 m95 -55.8 116.61 3.04 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.896 ' HG2' HG13 ' A' ' 988' ' ' VAL . 5.0 mt-10 -99.76 155.44 17.64 Favored 'General case' 0 C--O 1.257 1.451 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.432 176.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.504 ' HD2' ' HB2' ' A' 1011 ' ' ALA . 21.9 t80 -69.47 102.67 1.85 Allowed 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 129.015 2.926 . . . . 0.0 110.829 -178.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -124.13 122.41 4.8 Favored Glycine 0 CA--C 1.503 -0.659 0 C-N-CA 119.33 -1.414 . . . . 0.0 111.876 172.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.982 ' HB ' ' HD2' ' A' 1016 ' ' HIS . 1.3 tt -133.24 139.57 48.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 O-C-N 121.663 -0.904 . . . . 0.0 109.291 -179.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 35.0 m -132.61 116.81 17.13 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.401 ' HA ' ' HD2' ' A' 1000 ' ' PRO . 12.2 pt -114.18 97.38 45.39 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-O 121.188 0.518 . . . . 0.0 111.891 -175.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1000 ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 999' ' ' ILE . 18.7 Cg_endo -58.88 132.98 50.77 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.632 2.888 . . . . 0.0 114.415 -175.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -79.59 146.02 75.26 Favored 'Cis proline' 0 N--CA 1.454 -0.835 0 C-N-CA 122.743 -1.774 . . . . 0.0 112.015 -0.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 6.2 t70 -153.53 -159.91 1.05 Allowed 'General case' 0 C--N 1.293 -1.878 0 CA-C-N 113.873 -1.512 . . . . 0.0 107.91 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -138.0 -57.67 0.66 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.248 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 63.0 mttp -165.26 155.69 12.09 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 102.837 -3.023 . . . . 0.0 102.837 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -60.53 122.0 10.61 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 CA-C-N 121.758 1.664 . . . . 0.0 109.244 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 46.7 pttt -83.78 -7.51 59.45 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.566 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 9.6 t -144.01 135.22 25.62 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -174.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.579 ' HE3' ' HB2' ' A' ' 994' ' ' GLU . 42.6 m95 -134.24 135.39 42.91 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 125.436 1.71 . . . . 0.0 106.405 175.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 2.6 m -162.9 -174.01 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 -174.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -97.4 104.74 16.78 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1011 ' ' ALA . . . . . 0.504 ' HB2' ' HD2' ' A' ' 995' ' ' TYR . . . -178.25 -176.96 0.55 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -175.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.548 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.2 OUTLIER -174.63 118.03 0.2 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.805 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.43 ' H ' ' ND1' ' A' 1016 ' ' HIS . 46.9 mttp -132.37 153.4 50.81 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.421 -172.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 23.0 ttt -53.03 -44.03 67.03 Favored 'General case' 0 C--N 1.315 -0.918 0 O-C-N 124.607 1.192 . . . . 0.0 113.38 -177.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1015 ' ' TYR . . . . . 0.422 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 54.0 m-85 -68.47 9.63 0.33 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.982 ' HD2' ' HB ' ' A' ' 997' ' ' ILE . 22.0 m170 -69.72 175.65 4.1 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.908 0.861 . . . . 0.0 112.233 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1017 ' ' THR . . . . . 0.445 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 1.1 m -155.75 -42.0 0.08 Allowed 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 -169.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 16.7 m170 -132.02 144.31 50.68 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.49 -174.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.71 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 42.7 ttp180 -151.92 146.09 25.36 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.493 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 5.5 ptp180 -156.15 165.48 36.28 Favored 'General case' 0 C--O 1.198 -1.627 0 C-N-CA 117.575 -1.65 . . . . 0.0 110.824 178.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.57 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 29.4 ptt180 -144.38 151.36 39.17 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.792 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.655 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 36.2 ttm180 -83.7 129.76 34.95 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.6 ' HA ' ' O ' ' A' ' 981' ' ' SER . 72.9 mt -98.95 128.22 45.05 Favored 'General case' 0 N--CA 1.414 -2.275 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 167.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.513 HG13 ' HB2' ' A' ' 983' ' ' ASP . 1.4 m -104.76 145.1 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.828 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.503 -171.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.748 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -156.22 114.08 3.29 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 124.999 1.437 . . . . 0.0 111.299 168.001 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.56 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 1.8 tmmm? -82.09 144.83 30.52 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 -176.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.518 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 6.3 ptm180 -135.79 137.89 42.04 Favored 'General case' 0 C--O 1.209 -1.036 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 -172.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.556 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 30.2 ttmt -123.08 137.85 54.82 Favored 'General case' 0 C--N 1.284 -2.258 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.012 -171.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.652 ' C ' ' H ' ' A' 1031 ' ' LEU . 36.8 ttmt -89.1 -21.14 23.53 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-O 123.228 1.49 . . . . 0.0 108.26 -177.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 21.5 t70 66.67 -22.91 0.1 Allowed 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 111.927 -2.397 . . . . 0.0 112.28 -169.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.652 ' H ' ' C ' ' A' 1029 ' ' LYS . 27.6 tp 88.46 -25.34 0.08 Allowed 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 129.029 2.932 . . . . 0.0 110.899 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 34.4 p -74.77 -16.35 60.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.307 0.575 . . . . 0.0 111.363 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.586 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 98.0 mt-30 -78.92 -7.57 58.11 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.459 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1034 ' ' THR . . . . . 0.432 HG23 ' HD3' ' A' 1029 ' ' LYS . 24.6 p -122.74 110.56 15.64 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.243 178.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -74.53 110.18 8.61 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 176.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 17.4 t -88.19 -18.58 28.39 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.378 0.609 . . . . 0.0 109.579 -177.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 36.8 t -104.58 150.15 24.89 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.405 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 11.7 t -107.85 -1.83 20.45 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -87.33 117.22 25.95 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.398 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 . . . . . 0 C--N 1.313 -1.0 0 CA-C-O 117.899 -1.048 . . . . 0.0 109.393 179.621 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 2.7 pp . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . 0.475 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 16.1 t70 -73.98 123.47 89.3 Favored Pre-proline 0 C--O 1.236 0.389 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 174.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 16.7 Cg_exo -68.99 123.31 10.22 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 123.099 2.533 . . . . 0.0 113.654 -174.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -85.77 -11.1 54.38 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 113.725 -1.579 . . . . 0.0 109.277 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 34.1 m -149.13 100.85 3.09 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.323 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -109.67 93.4 4.48 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 106.058 -1.83 . . . . 0.0 106.058 174.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . 0.525 ' HA ' ' CD2' ' A' ' 927' ' ' HIS . 23.5 t70 -104.71 116.7 32.49 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -169.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -111.75 17.21 20.07 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.581 173.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 109.58 66.18 0.56 Allowed Glycine 0 N--CA 1.437 -1.237 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 -177.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.525 ' CD2' ' HA ' ' A' ' 924' ' ' ASP . 56.9 m-70 -107.75 -147.92 0.41 Allowed 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 175.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.6 m -161.2 124.43 3.25 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 102.804 -3.035 . . . . 0.0 102.804 168.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.475 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.4 OUTLIER -153.25 145.96 24.29 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 178.639 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -141.14 143.7 34.42 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.615 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 25.7 m -74.15 125.71 28.97 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 177.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -101.36 156.78 17.25 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 105.085 -2.191 . . . . 0.0 105.085 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.457 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.0 pt-20 -147.77 152.48 37.79 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.448 -174.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.488 HG12 ' HG3' ' A' ' 964' ' ' PRO . 12.2 p -141.95 174.76 5.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.49 ' HA ' ' O ' ' A' 1021 ' ' ARG . 68.6 m-85 -135.61 150.39 49.65 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.557 ' O ' ' HA ' ' A' 1020 ' ' ARG . 36.8 tt0 -126.18 127.53 45.85 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -178.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . 0.982 ' HB3' ' HG2' ' A' 1020 ' ' ARG . 0.0 OUTLIER -137.92 152.23 48.78 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 -177.05 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.621 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 46.3 mt-10 -135.22 161.05 36.48 Favored 'General case' 0 C--O 1.245 0.834 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 178.065 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 939' ' ' SER . . . . . 0.484 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 17.9 p -133.36 147.92 51.83 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.143 0.497 . . . . 0.0 111.336 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.466 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 21.6 ptt180 -149.02 161.44 41.91 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.81 158.38 69.69 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 171.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . 0.463 ' HG3' HG23 ' A' 1017 ' ' THR . 24.5 Cg_exo -62.78 92.32 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 121.345 1.363 . . . . 0.0 110.259 174.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 97.0 70.58 1.03 Allowed Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 108.974 -1.65 . . . . 0.0 108.974 -176.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -160.5 -131.24 1.2 Allowed Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.102 -175.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -137.42 131.07 31.45 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.547 -0.827 . . . . 0.0 111.047 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.621 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 36.1 m95 -78.92 149.98 32.22 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-O 121.512 0.672 . . . . 0.0 110.485 -177.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -137.84 166.06 29.07 Favored Pre-proline 0 C--N 1.305 -1.352 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 171.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -49.31 127.95 19.04 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 CA-C-N 121.262 1.486 . . . . 0.0 110.285 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . 0.484 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -47.78 -51.7 21.46 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 124.725 1.266 . . . . 0.0 111.613 -174.61 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 163.33 -35.37 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 178.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . 0.412 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 15.6 m-20 -132.13 102.27 5.73 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 174.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 952' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 936' ' ' GLN . 24.1 m -68.96 -46.2 68.76 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -172.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . 0.412 ' CE1' ' HB2' ' A' ' 936' ' ' GLN . 59.7 m-85 -104.79 130.57 52.87 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.874 0.845 . . . . 0.0 110.591 175.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 5.0 p -145.02 173.09 12.19 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.264 -1.334 . . . . 0.0 111.017 -166.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . 0.478 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 11.3 t70 -97.72 170.74 8.79 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 175.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.49 -27.95 7.52 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 119.548 1.067 . . . . 0.0 113.67 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -95.39 2.19 54.5 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 98.07 -3.87 60.5 Favored Glycine 0 CA--C 1.497 -1.049 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.845 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . 0.478 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 38.6 t70 -51.74 108.41 0.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 O-C-N 124.388 0.699 . . . . 0.0 110.308 176.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . 0.412 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 51.8 tptt -47.14 111.1 0.36 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.537 1.148 . . . . 0.0 109.076 172.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -120.96 -179.91 4.17 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.604 -174.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -74.75 146.63 42.01 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 13.6 m -76.16 156.82 83.73 Favored Pre-proline 0 C--N 1.313 -1.011 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.546 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 53.1 Cg_exo -50.91 -25.13 15.14 Favored 'Trans proline' 0 N--CA 1.487 1.101 0 C-N-CA 123.537 2.825 . . . . 0.0 115.407 -177.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 9.3 p -71.3 -49.47 42.46 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.861 0.839 . . . . 0.0 108.993 176.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -66.2 -28.15 68.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.699 175.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.497 HD13 ' HA ' ' A' ' 964' ' ' PRO . 67.7 mt -66.46 110.72 3.24 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 10.6 p -126.27 -179.95 4.98 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.891 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.673 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 24.0 p -94.65 124.92 53.44 Favored Pre-proline 0 C--N 1.308 -1.239 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.689 178.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.575 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 80.3 Cg_endo -78.53 162.84 27.38 Favored 'Trans proline' 0 C--N 1.336 -0.118 0 C-N-CA 123.197 2.598 . . . . 0.0 110.461 178.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -59.45 100.91 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 121.66 1.574 . . . . 0.0 110.942 174.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.656 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 127.34 -3.57 7.2 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -176.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.673 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 94.7 m95 -141.21 145.98 36.33 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 122.68 0.392 . . . . 0.0 110.307 177.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.563 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 5.5 tp10 -131.69 157.57 43.41 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 126.004 1.722 . . . . 0.0 106.41 -175.248 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.635 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 98.4 m95 -90.34 148.05 23.09 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 120.468 -1.395 . . . . 0.0 112.691 170.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -113.2 -43.82 3.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 178.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . 0.467 ' HB3' ' NE ' ' A' 1025 ' ' ARG . 69.4 m-20 -78.22 161.19 27.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.788 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -84.18 -57.48 3.16 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 115.186 1.551 . . . . 0.0 115.186 -176.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -155.77 142.69 18.99 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 121.408 -0.808 . . . . 0.0 110.404 -170.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.546 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 15.4 m95 -66.84 130.49 43.33 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.118 0.485 . . . . 0.0 109.97 -173.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 981' ' ' SER . . . . . 0.425 ' O ' ' HA ' ' A' 1023 ' ' LEU . 62.3 m -128.67 166.39 19.01 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 -179.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 20.4 p90 -74.41 142.55 44.98 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -178.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.494 ' HB2' HG13 ' A' 1024 ' ' VAL . 31.9 t0 -97.96 122.03 40.6 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.024 -177.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.2 pp -114.46 22.66 5.65 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.385 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -97.98 27.44 4.52 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.522 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 50.6 mtp180 -141.78 -177.16 5.06 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 -173.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.31 84.89 6.97 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 16.8 m -141.1 157.21 22.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.477 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -53.06 169.45 0.1 Allowed 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.773 172.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -55.33 -34.17 63.98 Favored 'General case' 0 CA--C 1.507 -0.675 0 C-N-CA 123.061 0.544 . . . . 0.0 112.439 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -98.68 11.85 37.26 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.418 0.628 . . . . 0.0 110.008 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 69.85 81.27 0.24 Allowed Glycine 0 N--CA 1.431 -1.654 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.243 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.513 ' CE3' ' HD2' ' A' 1019 ' ' ARG . 99.5 m95 -148.13 131.53 16.63 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.66 ' HG2' ' O ' ' A' 1020 ' ' ARG . 6.4 pt-20 -108.02 150.88 26.58 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-O 121.611 0.719 . . . . 0.0 112.493 -177.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.685 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -74.67 94.63 2.72 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 112.556 -2.111 . . . . 0.0 111.329 -173.339 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -110.88 101.37 1.34 Allowed Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 120.33 -0.938 . . . . 0.0 111.272 177.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.46 HD12 ' HB3' ' A' 1015 ' ' TYR . 0.7 OUTLIER -110.19 133.19 56.34 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.055 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.792 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 8.7 m -118.61 97.05 5.54 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 120.608 0.242 . . . . 0.0 110.357 -177.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.443 ' O ' HD12 ' A' ' 999' ' ' ILE . 2.4 pp -81.41 133.59 53.01 Favored Pre-proline 0 C--N 1.319 -0.724 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.764 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1000 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 51.5 Cg_endo -70.55 143.36 46.8 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.825 2.35 . . . . 0.0 113.736 -175.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1001 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 9.3 Cg_endo -93.7 143.86 9.01 Favored 'Cis proline' 0 N--CA 1.451 -1.009 0 C-N-CA 123.057 -1.643 . . . . 0.0 112.198 -3.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 2.7 t70 170.0 167.28 0.06 Allowed 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 113.342 -1.754 . . . . 0.0 107.718 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 13.9 p-80 -142.24 33.49 1.51 Allowed 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.845 0.355 . . . . 0.0 110.148 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -163.5 124.74 1.5 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.426 -175.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1005 ' ' PRO . . . . . 0.545 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 51.5 Cg_exo -63.79 126.29 17.13 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 121.525 1.484 . . . . 0.0 109.445 166.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 55.2 pttt -107.21 7.71 29.58 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.949 0.88 . . . . 0.0 109.188 -178.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.0 t -144.28 138.03 27.65 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.421 -1.263 . . . . 0.0 108.651 -177.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.564 ' CE3' ' HG3' ' A' ' 994' ' ' GLU . 66.9 m95 -133.72 140.24 46.88 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 98.4 t -139.34 152.86 23.65 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -78.86 100.32 7.13 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 175.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1011 ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' A' ' 995' ' ' TYR . . . 177.19 -174.2 0.12 Allowed 'General case' 0 C--O 1.235 0.293 0 O-C-N 123.876 0.735 . . . . 0.0 110.588 -171.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.753 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.3 OUTLIER -172.34 104.52 0.17 Allowed 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 106.491 -1.67 . . . . 0.0 106.491 177.61 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.446 ' H ' ' CE1' ' A' 1016 ' ' HIS . 21.9 mttp -141.66 166.93 23.39 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 112.852 -1.976 . . . . 0.0 110.283 -170.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 55.6 ttp -49.95 -47.34 52.62 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -173.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1015 ' ' TYR . . . . . 0.46 ' HB3' HD12 ' A' ' 997' ' ' ILE . 33.2 m-85 -62.25 -0.89 0.61 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.753 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 15.3 m80 -59.28 111.05 1.22 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 118.55 0.613 . . . . 0.0 112.229 175.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1017 ' ' THR . . . . . 0.463 HG23 ' HG3' ' A' ' 942' ' ' PRO . 42.1 p -96.32 -28.63 14.4 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 123.478 1.609 . . . . 0.0 107.525 174.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 7.2 m170 -139.3 156.26 47.16 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 112.658 -2.064 . . . . 0.0 109.348 -178.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.513 ' HD2' ' CE3' ' A' ' 993' ' ' TRP . 38.0 ptt180 -149.93 145.76 26.67 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 171.016 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.982 ' HG2' ' HB3' ' A' ' 937' ' ' ASN . 53.9 mtp180 -144.09 167.4 22.46 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.3 ptt180 -157.38 154.48 28.96 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.611 174.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.522 ' NH1' ' HD2' ' A' ' 986' ' ' ARG . 35.8 ttm180 -90.31 133.27 35.07 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 123.604 0.565 . . . . 0.0 109.775 178.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.487 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 71.9 mt -102.12 130.76 48.81 Favored 'General case' 0 N--CA 1.421 -1.909 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 165.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.494 HG13 ' HB2' ' A' ' 983' ' ' ASP . 1.8 m -106.35 145.09 14.56 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.354 -174.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.749 ' NE ' ' HA ' ' A' 1025 ' ' ARG . 0.6 OUTLIER -158.99 115.99 2.73 Favored 'General case' 0 C--N 1.31 -1.146 0 O-C-N 125.218 1.574 . . . . 0.0 113.017 168.233 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.8 tmmm? -76.29 142.38 41.34 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.204 0.526 . . . . 0.0 109.765 -177.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.635 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 11.2 ptm180 -130.69 144.52 51.49 Favored 'General case' 0 CA--C 1.497 -1.076 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -173.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.529 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 58.5 tttt -134.02 135.3 43.29 Favored 'General case' 0 C--N 1.286 -2.157 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.191 -167.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.656 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 34.6 ttmt -84.58 -20.26 31.77 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 123.473 1.606 . . . . 0.0 107.362 179.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1030 ' ' ASP . . . . . 0.433 ' H ' ' HG2' ' A' 1028 ' ' LYS . 24.6 t70 61.95 -17.71 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 111.246 -2.706 . . . . 0.0 113.555 -171.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.629 ' H ' ' C ' ' A' 1029 ' ' LYS . 18.5 tp 81.25 -10.54 1.19 Allowed 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 128.43 2.692 . . . . 0.0 110.621 -178.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 17.6 p -87.69 -3.5 58.96 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.384 0.612 . . . . 0.0 111.394 -177.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.563 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 80.3 mt-30 -93.8 7.77 43.62 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.691 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 7.0 t -160.09 155.47 25.24 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -178.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -115.58 -43.37 3.04 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.426 0.632 . . . . 0.0 109.386 175.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 45.3 t -144.38 -29.46 0.48 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.985 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 48.7 m -150.47 -174.64 4.82 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.862 -0.524 . . . . 0.0 110.389 -176.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 17.2 m -60.11 -53.88 52.48 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.089 0.471 . . . . 0.0 110.688 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -91.66 6.73 44.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.16 0.505 . . . . 0.0 110.991 -178.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 . . . . . 0 C--N 1.322 -0.629 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -178.752 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.471 0.58 0 N-CA-C 110.688 -0.116 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . 0.433 ' HB2' ' HD3' ' A' ' 920' ' ' PRO . 7.2 m-20 -107.09 -56.25 0.06 OUTLIER Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . 0.433 ' HD3' ' HB2' ' A' ' 919' ' ' ASP . 11.0 Cg_exo -70.07 154.3 66.65 Favored 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 123.562 2.841 . . . . 0.0 112.914 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -91.5 -37.75 12.96 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 113.994 -1.457 . . . . 0.0 108.873 179.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 11.6 t -115.13 105.15 12.59 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -122.96 138.45 54.68 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.365 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -91.21 145.42 24.68 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.319 0.58 . . . . 0.0 112.243 -175.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -139.84 22.66 2.46 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 176.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 103.31 66.96 0.74 Allowed Glycine 0 N--CA 1.438 -1.195 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.848 -173.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.541 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 6.1 m-70 -131.81 160.85 34.41 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 176.209 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.87 127.26 48.77 Favored 'General case' 0 N--CA 1.42 -1.971 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 162.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.507 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 0.0 OUTLIER -138.48 149.66 45.64 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 104.853 -2.277 . . . . 0.0 104.853 171.715 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -154.48 138.65 16.53 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 -174.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 931' ' ' THR . . . . . . . . . . . . . 45.4 m -79.77 132.82 36.25 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 177.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -110.04 156.88 19.94 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.438 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.0 pt-20 -154.21 159.48 41.37 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 121.282 0.563 . . . . 0.0 111.118 -173.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.626 ' O ' ' HA ' ' A' 1022 ' ' ARG . 8.8 p -147.96 179.6 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 176.022 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.479 ' HA ' ' O ' ' A' 1021 ' ' ARG . 77.9 m-85 -139.97 118.51 12.25 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 118.468 0.576 . . . . 0.0 110.418 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.468 ' O ' ' HA ' ' A' 1020 ' ' ARG . 47.3 mt-30 -78.46 122.47 25.87 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 170.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . 0.45 ' HB3' ' HB3' ' A' ' 949' ' ' ALA . 24.5 m-80 -117.5 143.24 46.26 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 123.338 0.655 . . . . 0.0 112.049 -176.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.64 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 52.4 mt-10 -136.18 150.76 49.16 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 174.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 939' ' ' SER . . . . . 0.494 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 31.8 p -134.85 146.63 49.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 117.895 0.316 . . . . 0.0 111.72 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.549 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 25.0 ptt180 -153.3 161.33 42.48 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 124.156 0.982 . . . . 0.0 108.685 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -68.71 153.21 96.16 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 172.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . 0.495 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 70.2 Cg_exo -55.49 97.97 0.06 OUTLIER 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 121.893 1.729 . . . . 0.0 111.219 174.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 93.88 66.99 1.05 Allowed Glycine 0 N--CA 1.435 -1.374 0 N-CA-C 107.849 -2.101 . . . . 0.0 107.849 -175.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -159.01 -155.68 7.73 Favored Glycine 0 N--CA 1.434 -1.485 0 C-N-CA 120.138 -1.03 . . . . 0.0 113.145 -176.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -116.47 131.23 57.0 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 113.541 -1.329 . . . . 0.0 110.032 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.64 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 48.1 m95 -79.9 154.21 28.49 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.407 0.622 . . . . 0.0 110.609 -175.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -136.53 173.96 5.0 Favored Pre-proline 0 C--N 1.306 -1.284 0 N-CA-C 103.806 -2.665 . . . . 0.0 103.806 173.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.63 128.9 32.3 Favored 'Trans proline' 0 C--N 1.346 0.436 0 CA-C-N 121.522 1.579 . . . . 0.0 109.47 173.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . 0.494 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -71.51 37.58 0.06 Allowed 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.849 1.426 . . . . 0.0 114.849 -175.111 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 85.18 -57.45 0.09 Allowed 'General case' 0 CA--C 1.474 -1.948 0 C-N-CA 125.274 1.43 . . . . 0.0 107.981 174.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -119.04 101.56 8.11 Favored 'General case' 0 N--CA 1.401 -2.903 0 N-CA-C 104.393 -2.447 . . . . 0.0 104.393 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.2 m -64.05 -57.76 8.7 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.085 0.241 . . . . 0.0 111.545 -172.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -98.35 126.3 43.82 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 954' ' ' THR . . . . . 0.434 ' HG1' ' ND2' ' A' ' 937' ' ' ASN . 37.5 p -149.66 -178.23 6.33 Favored 'General case' 0 C--O 1.246 0.896 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -172.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -105.33 -177.15 3.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 175.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.16 -31.63 32.29 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.27 -41.46 20.15 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 129.5 -2.07 6.09 Favored Glycine 0 CA--C 1.498 -0.974 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.887 177.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.43 104.36 0.62 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 114.626 -0.787 . . . . 0.0 109.181 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . 0.404 ' HD3' ' N ' ' A' ' 961' ' ' ALA . 9.3 tmtt? -48.87 120.14 3.66 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.404 ' N ' ' HD3' ' A' ' 960' ' ' LYS . . . -125.39 -172.45 2.59 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.653 -175.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . 0.448 ' CB ' ' HG ' ' A' ' 967' ' ' LEU . . . -62.16 140.89 58.41 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 121.902 0.858 . . . . 0.0 111.35 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 963' ' ' SER . . . . . 0.479 ' O ' ' HB2' ' A' ' 967' ' ' LEU . 15.0 m -102.47 162.64 19.61 Favored Pre-proline 0 N--CA 1.43 -1.466 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -176.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.592 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.2 Cg_endo -51.23 -37.95 60.35 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.733 2.289 . . . . 0.0 114.249 -177.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 25.5 p -79.91 -47.46 15.02 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 121.906 -0.496 . . . . 0.0 111.03 175.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . 0.404 ' HB2' ' H ' ' A' ' 963' ' ' SER . 45.2 mt-10 -65.65 -8.23 19.39 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.479 ' HB2' ' O ' ' A' ' 963' ' ' SER . 1.0 OUTLIER -102.02 112.49 25.15 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 -175.322 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.91 155.5 18.88 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.089 -176.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.5 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 16.0 p -76.85 126.95 85.07 Favored Pre-proline 0 C--N 1.313 -1.005 0 C-N-CA 120.169 -0.613 . . . . 0.0 109.49 174.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.582 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 52.6 Cg_endo -80.27 166.14 20.64 Favored 'Trans proline' 0 C--O 1.238 0.479 0 C-N-CA 122.886 2.39 . . . . 0.0 111.363 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.82 102.8 0.21 Allowed 'Trans proline' 0 C--O 1.24 0.585 0 C-N-CA 121.84 1.694 . . . . 0.0 110.266 173.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.659 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 121.63 3.47 10.18 Favored Glycine 0 N--CA 1.429 -1.8 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.383 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.582 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 93.5 m95 -138.57 137.62 37.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.96 0.886 . . . . 0.0 112.177 177.094 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.625 ' HB3' ' O ' ' A' 1028 ' ' LYS . 3.5 tp10 -122.0 137.2 54.89 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.163 -1.38 . . . . 0.0 108.262 -175.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.607 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 80.9 m95 -81.07 100.41 9.0 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 120.996 -1.065 . . . . 0.0 110.48 175.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . 0.44 ' HB3' ' HB3' ' A' 1028 ' ' LYS . 8.4 pt-20 -75.9 -31.54 59.24 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 177.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -78.07 146.43 35.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.387 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.59 -46.38 66.45 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -166.75 156.41 11.22 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.437 0.637 . . . . 0.0 111.596 -173.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.635 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 37.7 m95 -70.75 119.63 15.18 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.422 -0.808 . . . . 0.0 108.822 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 19.6 m -125.35 148.51 48.72 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -175.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' A' 1022 ' ' ARG . 7.2 p90 -73.68 135.85 43.75 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 119.251 0.932 . . . . 0.0 110.284 -175.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.573 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 12.5 t70 -88.21 126.34 35.1 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 114.423 -1.262 . . . . 0.0 111.048 -172.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.459 ' HA ' HG23 ' A' ' 988' ' ' VAL . 2.3 pp -121.01 16.19 6.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.471 -179.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . 0.501 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 16.7 t-20 -90.36 16.89 7.94 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.848 -177.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.573 ' HD3' ' OD2' ' A' ' 983' ' ' ASP . 5.0 mpt_? -141.47 -175.86 4.52 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -175.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -73.85 84.21 1.68 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.286 0.565 . . . . 0.0 110.812 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.476 HG12 ' HG2' ' A' ' 994' ' ' GLU . 17.9 m -141.13 -171.89 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -104.0 -172.7 2.15 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -58.36 -35.44 71.95 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.734 0.778 . . . . 0.0 111.829 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -106.75 9.1 31.19 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.363 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.72 -121.55 7.2 Favored Glycine 0 C--O 1.205 -1.701 0 N-CA-C 105.691 -2.964 . . . . 0.0 105.691 -174.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.452 ' H ' ' HB3' ' A' 1021 ' ' ARG . 42.9 m95 52.72 99.4 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 173.075 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.476 ' HG2' HG12 ' A' ' 988' ' ' VAL . 26.2 mt-10 -98.6 148.95 23.28 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.69 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.7 ' HD2' ' HE2' ' A' 1016 ' ' HIS . 19.9 t80 -65.79 96.65 0.3 Allowed 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 127.059 2.144 . . . . 0.0 111.098 177.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -118.93 102.89 0.96 Allowed Glycine 0 N--CA 1.444 -0.825 0 C-N-CA 119.255 -1.45 . . . . 0.0 111.975 174.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.447 HG22 ' HD2' ' A' 1016 ' ' HIS . 0.1 OUTLIER -108.71 143.24 19.37 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 O-C-N 119.951 -1.911 . . . . 0.0 107.563 178.447 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 998' ' ' THR . . . . . 0.593 ' HG1' ' HG3' ' A' 1005 ' ' PRO . 7.9 m -138.92 127.97 23.84 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.4 HD12 ' N ' ' A' ' 999' ' ' ILE . 3.7 mp -100.37 97.95 7.17 Favored Pre-proline 0 C--N 1.313 -0.99 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.26 140.85 38.02 Favored 'Trans proline' 0 C--O 1.238 0.478 0 C-N-CA 122.607 2.204 . . . . 0.0 114.071 -173.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -80.89 155.98 84.18 Favored 'Cis proline' 0 CA--C 1.512 -0.575 0 C-N-CA 123.177 -1.593 . . . . 0.0 110.857 -2.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1002 ' ' ASP . . . . . 0.433 ' CG ' ' H ' ' A' 1003 ' ' HIS . 21.1 t70 -159.18 -133.84 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.336 -174.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1003 ' ' HIS . . . . . 0.433 ' H ' ' CG ' ' A' 1002 ' ' ASP . 5.8 p-80 -158.37 -45.09 0.06 Allowed 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 122.999 0.52 . . . . 0.0 111.25 -174.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 61.1 tttt -167.26 145.67 4.18 Favored Pre-proline 0 N--CA 1.448 -0.543 0 C-N-CA 119.651 -0.819 . . . . 0.0 108.793 -173.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1005 ' ' PRO . . . . . 0.593 ' HG3' ' HG1' ' A' ' 998' ' ' THR . 52.1 Cg_exo -64.55 124.61 13.53 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 121.058 1.172 . . . . 0.0 109.724 167.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1006 ' ' LYS . . . . . 0.434 ' HG3' ' H ' ' A' 1007 ' ' SER . 57.8 pttt -70.64 -59.42 2.84 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1007 ' ' SER . . . . . 0.434 ' H ' ' HG3' ' A' 1006 ' ' LYS . 34.3 t -97.38 150.59 20.83 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 120.594 0.235 . . . . 0.0 111.179 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.481 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 53.0 m95 -137.37 145.55 43.43 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 125.113 1.508 . . . . 0.0 107.454 175.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.472 ' N ' ' HB3' ' A' ' 995' ' ' TYR . 10.8 m -161.92 -155.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 -177.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -103.14 -36.34 8.16 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 119.553 1.07 . . . . 0.0 113.104 -174.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -61.22 108.88 0.98 Allowed 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -168.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.464 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 4.9 tp10 -66.58 118.04 9.61 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 172.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' 1016 ' ' HIS . 83.1 mttt -122.18 155.92 34.8 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.747 -174.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1014 ' ' MET . . . . . 0.441 ' C ' ' H ' ' A' 1016 ' ' HIS . 23.7 ttt -55.88 -47.66 76.97 Favored 'General case' 0 CA--C 1.503 -0.864 0 O-C-N 123.951 0.782 . . . . 0.0 111.593 178.019 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1015 ' ' TYR . . . . . 0.495 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 31.6 p90 -75.09 28.07 0.09 Allowed 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.083 -0.647 . . . . 0.0 112.66 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.7 ' HE2' ' HD2' ' A' ' 995' ' ' TYR . 9.0 m170 -82.54 116.81 22.13 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 121.731 -0.606 . . . . 0.0 110.61 173.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 4.4 m -93.2 -28.99 15.94 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 123.088 1.423 . . . . 0.0 107.561 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 31.2 m80 -139.19 156.83 46.83 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 113.383 -1.735 . . . . 0.0 110.68 -176.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -156.37 150.74 25.53 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 105.75 -1.945 . . . . 0.0 105.75 169.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.468 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.9 ptp180 -149.99 163.65 37.56 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 118.267 -1.373 . . . . 0.0 110.86 176.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.479 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 21.9 ptt180 -143.36 142.3 31.23 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.911 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.626 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 33.0 ttm180 -82.3 129.19 34.8 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.112 -178.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.635 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 97.0 mt -102.16 133.65 46.68 Favored 'General case' 0 N--CA 1.427 -1.609 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 166.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 13.8 m -111.11 138.99 37.09 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.009 -176.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.474 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 13.8 tpt180 -138.56 110.28 7.12 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.543 170.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.507 ' HE2' ' HG2' ' A' ' 929' ' ' GLU . 2.2 tmtp? -69.63 147.02 51.21 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.607 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 9.8 ptm180 -140.71 129.49 23.04 Favored 'General case' 0 C--O 1.201 -1.496 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -177.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.625 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 36.0 ttmt -121.55 135.5 55.01 Favored 'General case' 0 C--N 1.275 -2.661 0 CA-C-N 115.373 -0.831 . . . . 0.0 108.849 -174.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.659 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 35.5 ttmt -84.59 -23.54 29.57 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 123.709 1.719 . . . . 0.0 107.058 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1030 ' ' ASP . . . . . 0.541 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 16.7 t70 61.77 -5.24 0.15 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 110.811 -2.904 . . . . 0.0 111.62 -169.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.604 ' H ' ' C ' ' A' 1029 ' ' LYS . 36.7 tp 74.56 -34.33 0.27 Allowed 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 127.67 2.388 . . . . 0.0 111.892 -177.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 8.1 t -68.27 -15.46 63.58 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -175.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.471 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 93.4 mt-30 -72.27 -34.46 68.23 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.429 -0.509 . . . . 0.0 110.764 177.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 20.7 p -94.33 -41.06 9.63 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-O 121.02 0.438 . . . . 0.0 110.121 178.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -99.58 79.75 2.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 22.9 t -92.71 95.57 9.64 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 3.4 p -80.87 158.58 25.29 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.146 -177.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 59.0 p 61.25 -74.01 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.524 1.93 . . . . 0.0 114.038 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -112.24 145.37 40.06 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.702 0.287 . . . . 0.0 110.657 -176.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 . . . . . 0 C--N 1.318 -0.798 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.822 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 41.1 pt . . . . . 0 C--O 1.241 0.622 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 32.3 m-20 -130.32 136.98 29.83 Favored Pre-proline 0 C--N 1.316 -0.864 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 27.5 Cg_exo -68.87 95.87 0.5 Allowed 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.511 2.14 . . . . 0.0 112.02 178.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -73.29 -23.17 60.26 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.849 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 25.9 m -70.65 -16.46 62.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.239 176.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . 61.12 -159.38 0.32 Allowed 'General case' 0 C--O 1.243 0.738 0 C-N-CA 123.625 0.77 . . . . 0.0 109.536 -177.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -76.33 170.54 16.15 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 176.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . 73.23 153.75 0.14 Allowed 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.831 1.252 . . . . 0.0 110.531 -171.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 82.28 14.89 75.61 Favored Glycine 0 CA--C 1.491 -1.439 0 N-CA-C 109.86 -1.296 . . . . 0.0 109.86 -175.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.458 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 46.1 m-70 -123.61 -140.35 0.31 Allowed 'General case' 0 N--CA 1.421 -1.913 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 176.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.09 115.73 0.97 Allowed 'General case' 0 N--CA 1.413 -2.314 0 N-CA-C 101.495 -3.52 . . . . 0.0 101.495 172.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -142.22 132.08 24.32 Favored 'General case' 0 C--N 1.274 -2.686 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 177.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -128.69 140.43 51.75 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -177.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.604 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 38.7 m -70.64 126.72 30.4 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -96.35 166.36 11.75 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -161.07 149.31 15.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-O 121.204 0.526 . . . . 0.0 110.719 -172.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.558 ' O ' ' HA ' ' A' 1022 ' ' ARG . 14.8 p -145.33 175.07 2.69 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 176.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.594 ' CD2' ' HD3' ' A' 1020 ' ' ARG . 75.8 m-85 -135.62 151.47 50.28 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.49 ' O ' ' HA ' ' A' 1020 ' ' ARG . 13.0 tt0 -123.2 118.09 26.84 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 178.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -106.82 141.11 38.58 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.831 0.824 . . . . 0.0 111.121 -174.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.595 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 67.5 mt-10 -136.65 157.66 46.25 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 175.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 40.7 t -144.69 141.63 29.45 Favored 'General case' 0 N--CA 1.426 -1.632 0 CA-C-O 121.073 0.463 . . . . 0.0 109.997 -178.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.541 HH21 ' HB2' ' A' 1016 ' ' HIS . 21.6 ptt180 -139.03 159.61 41.73 Favored 'General case' 0 N--CA 1.435 -1.203 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 177.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -71.89 161.42 78.84 Favored Pre-proline 0 C--N 1.303 -1.452 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 170.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . 0.547 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 31.4 Cg_exo -61.84 86.16 0.1 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 121.374 1.383 . . . . 0.0 111.031 175.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 103.15 70.18 0.83 Allowed Glycine 0 N--CA 1.434 -1.484 0 N-CA-C 107.716 -2.154 . . . . 0.0 107.716 -173.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.62 -140.57 2.9 Favored Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 120.35 -0.929 . . . . 0.0 113.647 -175.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -127.97 122.62 32.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.702 -0.749 . . . . 0.0 111.532 -173.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.595 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 74.6 m95 -70.47 135.59 48.77 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -142.88 178.78 1.36 Allowed Pre-proline 0 C--N 1.302 -1.482 0 N-CA-C 103.073 -2.936 . . . . 0.0 103.073 -179.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.05 124.29 15.91 Favored 'Trans proline' 0 C--O 1.238 0.501 0 CA-C-N 122.735 2.012 . . . . 0.0 111.423 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -49.23 -49.99 40.52 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.626 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 173.88 -38.7 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -122.5 116.07 23.3 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 174.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 6.6 m -63.64 -59.51 4.51 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -174.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . 0.436 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 91.7 m-85 -110.03 135.3 51.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.788 0.328 . . . . 0.0 110.425 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 954' ' ' THR . . . . . 0.441 ' HA ' ' HA ' ' A' ' 960' ' ' LYS . 58.5 p -142.74 179.91 6.72 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.55 0.691 . . . . 0.0 110.183 -171.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -98.21 174.36 6.55 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 104.911 -2.255 . . . . 0.0 104.911 172.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.54 -34.96 52.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 118.587 0.631 . . . . 0.0 110.952 174.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -86.36 -0.54 56.13 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 96.6 -10.12 66.69 Favored Glycine 0 CA--C 1.501 -0.782 0 C-N-CA 119.739 -1.219 . . . . 0.0 113.308 177.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -51.64 99.2 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 954' ' ' THR . 0.2 OUTLIER -60.36 137.9 58.06 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -177.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -134.24 -178.98 5.29 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.397 -175.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . 0.507 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -70.72 153.06 43.15 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 172.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 3.7 m -76.32 158.51 81.53 Favored Pre-proline 0 C--N 1.313 -1.017 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -178.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.584 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 53.9 Cg_exo -44.94 -31.73 5.68 Favored 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 124.263 3.308 . . . . 0.0 116.317 -178.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.8 t -71.61 -45.54 61.83 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . 0.507 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 35.2 mt-10 -65.19 -25.88 67.9 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.373 175.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.535 HD12 ' HA ' ' A' ' 964' ' ' PRO . 57.4 mt -71.43 112.05 7.24 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.702 0.763 . . . . 0.0 110.208 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 20.6 p -118.77 169.99 9.38 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.881 -172.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 20.3 p -83.91 129.21 59.9 Favored Pre-proline 0 N--CA 1.443 -0.781 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.646 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.566 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 53.5 Cg_endo -82.59 163.28 16.64 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.931 2.421 . . . . 0.0 110.642 177.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -59.61 104.82 0.23 Allowed 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.02 1.813 . . . . 0.0 110.657 174.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.501 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 121.19 -1.67 11.57 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.066 -177.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.566 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.4 m95 -136.81 141.57 42.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 117.256 0.528 . . . . 0.0 111.167 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.975 ' HB3' HE22 ' A' 1033 ' ' GLN . 2.9 pt-20 -117.94 148.37 42.25 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -177.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.532 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 85.5 m95 -84.64 98.36 10.15 Favored 'General case' 0 C--N 1.296 -1.732 0 C-N-CA 119.169 -1.013 . . . . 0.0 110.327 167.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . 0.4 ' HG2' ' HE3' ' A' 1026 ' ' LYS . 8.9 tp10 -67.83 -41.19 83.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.06 -1.427 . . . . 0.0 108.21 176.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . 0.546 ' HB3' ' NE ' ' A' 1025 ' ' ARG . 64.9 m-20 -84.1 158.68 21.32 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.842 -177.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -75.53 -63.79 1.21 Allowed 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 -175.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -154.21 144.38 22.02 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -171.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.584 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 6.8 m95 -68.4 130.06 41.76 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -173.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 981' ' ' SER . . . . . 0.504 ' O ' ' HA ' ' A' 1023 ' ' LEU . 22.9 t -136.18 -175.12 3.88 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . 0.529 ' CD2' ' HA ' ' A' ' 991' ' ' LYS . 0.1 OUTLIER -77.05 151.82 35.35 Favored 'General case' 0 C--N 1.295 -1.791 0 CA-C-N 118.986 0.812 . . . . 0.0 112.179 -175.394 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.504 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 54.0 t0 -91.0 125.5 35.82 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 172.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.3 pp -119.06 6.76 6.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . 0.538 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 67.1 t30 -93.63 18.36 10.21 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.801 0.81 . . . . 0.0 110.767 -172.066 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.538 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 5.7 mpt_? -139.86 -176.35 4.55 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -177.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -75.29 75.55 2.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.991 0.9 . . . . 0.0 110.302 176.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.543 HG11 ' HG2' ' A' ' 994' ' ' GLU . 9.7 m -143.92 152.81 15.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.169 -1.378 . . . . 0.0 108.531 -177.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -55.8 170.52 0.28 Allowed 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 123.64 0.776 . . . . 0.0 111.966 177.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -57.5 -33.39 67.98 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 121.374 0.607 . . . . 0.0 111.074 174.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . 0.552 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 81.6 mttt -96.38 6.79 48.02 Favored 'General case' 0 N--CA 1.428 -1.546 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.931 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 93.62 -14.2 65.83 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.058 175.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.552 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 74.2 m95 -50.84 135.34 24.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.199 1.0 . . . . 0.0 113.262 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.543 ' HG2' HG11 ' A' ' 988' ' ' VAL . 41.7 mt-10 -114.61 148.75 37.64 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.407 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.753 ' O ' ' HA ' ' A' 1008 ' ' TRP . 3.9 t80 -81.37 100.9 9.49 Favored 'General case' 0 C--O 1.199 -1.561 0 CA-C-N 112.985 -1.916 . . . . 0.0 108.966 -177.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -123.29 101.64 0.71 Allowed Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 119.125 -1.512 . . . . 0.0 111.895 173.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.562 HG21 ' CD2' ' A' 1016 ' ' HIS . 0.7 OUTLIER -102.57 151.04 6.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 O-C-N 120.864 -1.374 . . . . 0.0 107.741 179.65 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 15.8 m -127.91 102.77 6.91 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 15.8 pt -86.89 112.5 47.67 Favored Pre-proline 0 C--N 1.319 -0.721 0 C-N-CA 120.08 -0.648 . . . . 0.0 110.935 174.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -70.55 147.04 56.89 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.72 2.28 . . . . 0.0 112.975 -176.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -83.6 136.04 26.13 Favored 'Cis proline' 0 N--CA 1.451 -0.999 0 C-N-CA 122.931 -1.695 . . . . 0.0 112.993 -0.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 39.3 t0 167.23 154.98 0.03 OUTLIER 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 111.524 -2.58 . . . . 0.0 105.359 -176.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -119.11 -40.9 2.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 118.704 -1.199 . . . . 0.0 112.346 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 70.2 mttt -104.29 132.15 21.24 Favored Pre-proline 0 C--N 1.31 -1.143 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -176.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1005 ' ' PRO . . . . . 0.425 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 74.5 Cg_exo -56.05 125.32 18.71 Favored 'Trans proline' 0 CA--C 1.515 -0.427 0 C-N-CA 123.117 2.545 . . . . 0.0 111.019 170.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -94.43 -48.07 6.29 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 35.4 t -85.15 134.72 34.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.44 -1.255 . . . . 0.0 111.093 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.753 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 54.4 m95 -131.54 136.41 47.83 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 124.457 1.098 . . . . 0.0 108.48 176.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.761 HG12 ' H ' ' A' 1010 ' ' ALA . 11.2 t -147.32 -164.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 103.664 -2.717 . . . . 0.0 103.664 -176.245 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1010 ' ' ALA . . . . . 0.761 ' H ' HG12 ' A' 1009 ' ' VAL . . . -114.98 12.16 16.69 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 120.381 1.446 . . . . 0.0 111.755 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -88.08 -166.36 1.57 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -177.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.449 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 8.5 tp10 -158.74 105.96 1.84 Allowed 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -175.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.58 ' O ' ' HB2' ' A' 1016 ' ' HIS . 56.5 mtpt -111.69 151.44 28.88 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 177.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1014 ' ' MET . . . . . 0.433 ' C ' ' H ' ' A' 1016 ' ' HIS . 50.8 ttp -53.24 -37.54 62.17 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 123.881 0.738 . . . . 0.0 111.013 175.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1015 ' ' TYR . . . . . 0.547 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 97.8 m-85 -69.2 16.08 0.06 Allowed 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 177.009 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.58 ' HB2' ' O ' ' A' 1013 ' ' LYS . 0.2 OUTLIER -79.54 115.91 19.44 Favored 'General case' 0 CA--C 1.499 -1.019 0 O-C-N 121.906 -0.496 . . . . 0.0 110.981 176.309 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1017 ' ' THR . . . . . 0.439 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 10.9 p -95.95 -27.03 15.35 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.701 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -139.15 153.82 48.0 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.693 -1.139 . . . . 0.0 111.648 -175.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -156.73 151.26 25.55 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 170.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.594 ' HD3' ' CD2' ' A' ' 935' ' ' TYR . 2.7 ptp180 -149.4 165.21 32.76 Favored 'General case' 0 C--O 1.193 -1.871 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 175.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.593 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.3 ptt180 -145.06 148.03 33.23 Favored 'General case' 0 C--N 1.285 -2.229 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.699 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.558 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 41.2 ttm180 -89.4 122.52 32.69 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.504 ' HA ' ' O ' ' A' ' 981' ' ' SER . 78.0 mt -98.27 125.68 43.46 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 103.706 -2.701 . . . . 0.0 103.706 168.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.492 HG12 ' HB2' ' A' ' 983' ' ' ASP . 2.5 m -106.5 151.16 8.57 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.069 -173.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.764 ' NE ' ' HA ' ' A' 1025 ' ' ARG . 0.5 OUTLIER -159.09 110.08 2.05 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 125.427 1.705 . . . . 0.0 112.614 169.421 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.604 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 3.2 tmmm? -78.21 146.86 34.72 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.398 0.618 . . . . 0.0 109.409 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.532 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 6.0 ptm180 -135.75 146.96 48.21 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 -171.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' A' ' 974' ' ' GLU . 34.3 ttmt -129.94 136.27 49.28 Favored 'General case' 0 C--O 1.193 -1.873 0 O-C-N 123.429 0.456 . . . . 0.0 110.573 -172.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 38.7 ttmt -85.82 -22.3 27.69 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 123.466 1.603 . . . . 0.0 107.668 -176.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 9.3 t70 56.98 12.17 1.15 Allowed 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 111.431 -2.622 . . . . 0.0 110.044 -171.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 927' ' ' HIS . 22.6 tp 69.24 -52.1 0.6 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.635 1.974 . . . . 0.0 111.659 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 10.3 t -69.44 -10.08 56.43 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -173.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.975 HE22 ' HB3' ' A' ' 974' ' ' GLU . 76.2 mt-30 -77.81 -11.12 59.85 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.255 177.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1034 ' ' THR . . . . . 0.476 ' OG1' ' HD3' ' A' 1029 ' ' LYS . 58.4 p -120.31 137.34 54.31 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 175.584 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -120.81 140.12 52.17 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 17.1 m -76.47 -38.66 55.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 122.011 0.91 . . . . 0.0 109.013 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 61.2 p -139.71 111.95 7.62 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.277 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 28.5 m -91.36 -30.71 16.39 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.599 -1.259 . . . . 0.0 107.599 175.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -68.57 -66.95 0.51 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.528 177.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 . . . . . 0 C--O 1.24 0.553 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.235 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 8.5 tp . . . . . 0 N--CA 1.466 0.34 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 45.3 m-20 79.12 113.31 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 124.336 1.054 . . . . 0.0 111.135 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 4.7 Cg_exo -83.21 25.35 0.69 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 123.902 3.068 . . . . 0.0 112.921 179.183 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -134.12 -156.66 0.75 Allowed 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 105.846 -1.909 . . . . 0.0 105.846 178.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.8 98.97 0.14 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 118.263 0.483 . . . . 0.0 110.003 173.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -78.19 85.14 4.37 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.421 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -78.51 108.35 11.82 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.286 -174.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -151.38 31.97 0.58 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.176 -1.374 . . . . 0.0 109.555 -178.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 84.76 23.46 49.8 Favored Glycine 0 CA--C 1.493 -1.33 0 C-N-CA 121.05 -0.595 . . . . 0.0 113.407 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -86.69 -32.15 20.64 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 173.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 928' ' ' THR . . . . . 0.438 ' HB ' ' HB3' ' A' 1029 ' ' LYS . 1.5 m 63.39 90.97 0.08 Allowed 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.799 -169.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 929' ' ' GLU . 0.5 OUTLIER -135.95 129.11 31.67 Favored 'General case' 0 N--CA 1.42 -1.94 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 173.158 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . 0.433 ' O ' ' HG2' ' A' 1027 ' ' ARG . 70.8 t80 -122.62 139.86 53.46 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -178.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 9.0 m -76.01 121.14 22.31 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -99.54 157.38 16.49 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 -175.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.646 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 0.0 OUTLIER -159.06 156.29 28.97 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 119.433 1.015 . . . . 0.0 111.668 -175.489 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.46 HG12 HD12 ' A' ' 967' ' ' LEU . 20.3 m -145.99 142.71 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 174.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.474 ' CG ' ' HD3' ' A' 1020 ' ' ARG . 98.5 m-85 -101.15 113.67 26.92 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 120.861 -1.149 . . . . 0.0 111.516 178.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.538 ' HB3' ' CE2' ' A' ' 953' ' ' TYR . 3.8 pt20 -81.41 137.01 35.72 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 171.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . 0.862 ' HB3' ' HB3' ' A' 1020 ' ' ARG . 0.0 OUTLIER -140.56 163.23 33.41 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -175.2 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.63 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 43.2 mt-10 -136.67 161.35 36.17 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 113.334 -1.757 . . . . 0.0 107.422 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 19.6 m -138.46 147.61 43.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 120.7 0.286 . . . . 0.0 111.143 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.527 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 16.2 ptt180 -156.07 162.47 40.28 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 123.59 0.756 . . . . 0.0 109.756 -173.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -60.33 162.43 10.86 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 171.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -67.96 78.37 0.57 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.071 1.848 . . . . 0.0 112.32 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 105.28 74.31 0.94 Allowed Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 108.533 -1.827 . . . . 0.0 108.533 -175.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -165.41 -150.1 6.11 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.236 -176.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -101.28 130.02 47.35 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.991 -0.604 . . . . 0.0 110.07 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.63 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 45.6 m95 -82.79 139.67 33.42 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 177.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -117.52 163.79 22.28 Favored Pre-proline 0 C--N 1.292 -1.932 0 N-CA-C 101.279 -3.6 . . . . 0.0 101.279 171.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.22 149.02 47.07 Favored 'Trans proline' 0 C--O 1.238 0.49 0 CA-C-N 121.456 1.556 . . . . 0.0 110.353 175.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.14 -171.07 0.1 Allowed 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.161 0.505 . . . . 0.0 110.787 177.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.26 -38.61 30.58 Favored 'General case' 0 CA--C 1.476 -1.885 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -117.94 99.01 6.63 Favored 'General case' 0 N--CA 1.397 -3.085 0 N-CA-C 103.804 -2.665 . . . . 0.0 103.804 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 27.3 m -61.5 -50.35 73.09 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 123.342 0.401 . . . . 0.0 111.365 -172.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . 0.538 ' CE2' ' HB3' ' A' ' 936' ' ' GLN . 81.4 m-85 -101.83 132.44 47.59 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 18.4 p -142.73 177.22 8.47 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 123.393 0.677 . . . . 0.0 110.835 -171.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -104.97 171.17 7.46 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 171.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.88 -37.44 52.25 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 118.971 0.805 . . . . 0.0 110.159 174.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -73.23 -10.19 59.51 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 95.07 -7.79 69.78 Favored Glycine 0 CA--C 1.5 -0.872 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.15 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -58.7 105.76 0.34 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -47.01 124.0 5.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.54 178.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -115.76 168.54 9.95 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.903 -176.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -71.6 157.0 38.75 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.882 177.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.1 m -89.08 149.9 44.1 Favored Pre-proline 0 N--CA 1.435 -1.192 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.56 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 2.8 Cg_exo -43.57 -38.51 9.0 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 125.001 3.801 . . . . 0.0 116.925 -176.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 28.4 m -74.3 -41.8 60.59 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 122.143 0.973 . . . . 0.0 109.391 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -64.57 -28.77 69.86 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.041 -1.436 . . . . 0.0 110.565 173.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.472 HD11 ' CH2' ' A' ' 980' ' ' TRP . 39.6 mt -74.08 120.17 19.29 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 121.776 0.798 . . . . 0.0 110.616 178.22 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 22.0 p -124.38 169.09 12.17 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.042 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 16.9 p -90.44 138.96 26.66 Favored Pre-proline 0 C--N 1.312 -1.054 0 C-N-CA 120.459 -0.496 . . . . 0.0 109.906 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.57 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 92.8 Cg_endo -79.2 172.38 14.81 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.912 2.408 . . . . 0.0 111.066 173.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . 0.493 ' HG3' ' HA ' ' A' 1040 ' ' ARG . 98.7 Cg_exo -45.88 -43.52 19.45 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 123.211 2.607 . . . . 0.0 114.329 178.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.949 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . -102.76 22.79 35.95 Favored Glycine 0 N--CA 1.434 -1.438 0 C-N-CA 121.478 -0.391 . . . . 0.0 113.614 -175.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.57 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 78.1 m95 -135.42 138.11 42.93 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 117.946 0.873 . . . . 0.0 110.743 172.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.597 ' HB3' ' O ' ' A' 1028 ' ' LYS . 7.3 tp10 -118.85 131.02 56.06 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 125.671 1.588 . . . . 0.0 108.315 -175.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.436 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 82.5 m95 -77.07 98.75 5.11 Favored 'General case' 0 C--N 1.306 -1.288 0 O-C-N 120.92 -1.113 . . . . 0.0 110.129 173.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -69.72 -35.15 74.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 177.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . 0.758 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 1.5 m-20 -87.22 151.43 23.17 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.383 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.65 -65.08 0.75 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -170.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -153.81 146.39 24.13 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -171.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.56 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 19.7 m95 -60.62 125.64 24.47 Favored 'General case' 0 CA--C 1.502 -0.903 0 O-C-N 124.325 1.016 . . . . 0.0 109.834 -169.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 981' ' ' SER . . . . . 0.653 ' O ' ' HA ' ' A' 1023 ' ' LEU . 18.0 m -111.95 -171.74 1.9 Allowed 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 -175.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -107.26 149.36 27.85 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 119.804 1.184 . . . . 0.0 109.224 175.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.522 ' O ' HG23 ' A' ' 988' ' ' VAL . 52.4 t0 -86.59 119.72 27.13 Favored 'General case' 0 C--N 1.317 -0.815 0 O-C-N 123.206 0.316 . . . . 0.0 110.216 -175.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 24.2 pt -120.11 13.33 6.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 122.227 1.013 . . . . 0.0 108.97 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.59 18.86 6.87 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.845 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -137.22 -176.24 4.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.401 -178.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.83 81.17 8.66 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 172.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 983' ' ' ASP . 16.5 m -134.66 162.67 38.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 114.429 -1.259 . . . . 0.0 109.555 -176.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -54.7 170.27 0.17 Allowed 'General case' 0 C--O 1.239 0.551 0 O-C-N 123.976 0.798 . . . . 0.0 110.026 170.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . 0.502 ' HB2' ' HZ1' ' A' ' 991' ' ' LYS . 48.3 mt-10 -53.04 -34.51 56.77 Favored 'General case' 0 CA--C 1.5 -0.973 0 CA-C-O 121.993 0.902 . . . . 0.0 110.538 178.185 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . 0.502 ' HZ1' ' HB2' ' A' ' 990' ' ' GLU . 26.3 mttp -103.63 11.83 35.61 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.401 -1.272 . . . . 0.0 111.607 -174.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 90.73 -13.87 64.59 Favored Glycine 0 C--N 1.331 0.285 0 CA-C-N 116.739 -0.21 . . . . 0.0 113.483 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.627 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 97.7 m95 -51.9 146.78 7.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.566 0.698 . . . . 0.0 112.47 176.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -135.68 150.46 49.59 Favored 'General case' 0 C--O 1.252 1.198 0 CA-C-O 122.24 1.019 . . . . 0.0 112.216 -177.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.826 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 50.5 t80 -80.87 93.2 6.23 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 111.792 -2.458 . . . . 0.0 112.208 -172.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . 0.606 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -118.31 93.72 0.58 Allowed Glycine 0 CA--C 1.49 -1.478 0 C-N-CA 119.44 -1.362 . . . . 0.0 111.243 177.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.529 HG23 ' HA ' ' A' 1016 ' ' HIS . 12.0 pt -103.83 148.59 8.51 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.883 0 C-N-CA 118.204 -1.399 . . . . 0.0 108.556 -178.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 11.6 t -138.72 132.21 30.4 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.355 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.3 mp -114.45 114.47 45.12 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1000 ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 31.6 Cg_exo -61.03 136.34 64.74 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 123.068 2.512 . . . . 0.0 113.113 -178.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1001 ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 9.4 Cg_endo -85.23 138.42 25.69 Favored 'Cis proline' 0 N--CA 1.449 -1.11 0 C-N-CA 122.774 -1.761 . . . . 0.0 113.898 1.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 7.9 t0 162.02 126.52 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 111.271 -2.695 . . . . 0.0 104.624 -179.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -85.19 -43.04 14.16 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.739 -168.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 84.7 mttt -127.14 141.34 40.42 Favored Pre-proline 0 C--N 1.309 -1.157 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.347 -174.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -50.26 127.88 21.24 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.617 2.211 . . . . 0.0 110.614 169.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 21.2 pttm -110.62 15.52 21.98 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.012 -0.995 . . . . 0.0 108.484 -177.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 42.6 t -146.95 137.13 23.46 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.448 -175.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.699 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 59.7 m95 -137.62 135.89 36.99 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 125.367 1.667 . . . . 0.0 107.085 175.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 96.5 t -144.95 165.74 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 -171.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -82.99 -2.16 54.47 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -175.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -112.23 122.09 46.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 119.018 0.826 . . . . 0.0 112.538 -174.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.43 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 52.0 tp10 -72.13 120.58 17.93 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 174.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.525 ' H ' ' CE1' ' A' 1016 ' ' HIS . 94.5 mttt -124.66 155.79 38.6 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.004 -178.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 52.3 ttp -53.12 -40.08 63.92 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 123.863 0.727 . . . . 0.0 112.554 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -52.49 -7.98 0.08 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.568 1.321 . . . . 0.0 114.568 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.826 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 13.5 m80 -57.85 154.8 11.46 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 122.53 1.157 . . . . 0.0 112.993 179.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -161.55 -33.41 0.05 OUTLIER 'General case' 0 C--N 1.294 -1.827 0 CA-C-N 111.295 -2.684 . . . . 0.0 106.599 -167.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 14.2 m80 -135.21 141.49 45.83 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.697 -1.592 . . . . 0.0 108.601 174.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.627 ' HG2' ' CE3' ' A' ' 993' ' ' TRP . 43.3 ttt180 -152.47 142.49 22.22 Favored 'General case' 0 CA--C 1.483 -1.598 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.862 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . 2.5 ptp180 -150.57 167.89 25.89 Favored 'General case' 0 C--N 1.294 -1.822 0 O-C-N 124.074 0.859 . . . . 0.0 109.626 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.525 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 26.5 ptt180 -148.62 151.47 35.05 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.646 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 32.5 ttm180 -90.21 129.45 36.47 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.261 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.653 ' HA ' ' O ' ' A' ' 981' ' ' SER . 84.8 mt -94.46 125.87 39.38 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 167.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.485 HG13 ' HB2' ' A' ' 983' ' ' ASP . 2.5 m -105.46 136.62 38.76 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.803 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.366 -174.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.758 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -144.24 109.75 5.2 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 124.641 1.213 . . . . 0.0 111.726 168.639 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.658 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -78.73 141.98 37.43 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -178.703 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.501 ' N ' ' HD2' ' A' 1026 ' ' LYS . 12.1 ptm180 -135.78 143.19 45.1 Favored 'General case' 0 C--O 1.201 -1.452 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -171.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.597 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.7 ttmt -125.9 138.53 53.79 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 123.606 0.566 . . . . 0.0 109.65 -175.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.66 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.7 ttmt -89.33 -22.3 22.7 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 123.285 1.517 . . . . 0.0 108.124 -178.132 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 21.6 t70 55.45 21.08 4.06 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 111.098 -2.774 . . . . 0.0 109.331 -169.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 42.8 tp 57.53 -41.54 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.849 2.059 . . . . 0.0 115.227 -174.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 9.4 t -69.15 -23.6 63.98 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 122.953 0.501 . . . . 0.0 112.32 -170.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.949 ' HB3' ' HA2' ' A' ' 972' ' ' GLY . 3.8 mt-30 -63.15 -46.21 88.24 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -175.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1034 ' ' THR . . . . . 0.528 ' OG1' ' HD3' ' A' 1029 ' ' LYS . 12.2 p -75.8 -42.93 48.58 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.402 179.397 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -57.44 -44.07 84.42 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.178 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 47.4 t -79.0 -56.94 4.01 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.743 179.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 70.0 m 56.02 72.11 0.51 Allowed 'General case' 0 C--O 1.238 0.468 0 CA-C-O 122.254 1.026 . . . . 0.0 108.602 -170.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 8.2 m -83.39 -51.54 7.3 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 114.206 -1.361 . . . . 0.0 109.043 -176.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -133.79 162.28 32.43 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.143 -177.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1040 ' ' ARG . . . . . 0.493 ' HA ' ' HG3' ' A' ' 971' ' ' PRO . 13.6 ptt180 . . . . . 0 C--N 1.312 -1.024 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 31.6 pt . . . . . 0 N--CA 1.469 0.479 0 CA-C-O 121.692 0.758 . . . . 0.0 109.893 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -94.54 143.97 27.16 Favored Pre-proline 0 C--N 1.315 -0.915 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.623 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -62.25 -17.55 57.64 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.868 2.379 . . . . 0.0 113.487 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -123.81 98.43 5.81 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 13.0 t -156.01 -38.79 0.08 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.413 0.625 . . . . 0.0 110.534 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -113.45 30.51 7.17 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . 0.763 ' HB3' ' HD2' ' A' ' 927' ' ' HIS . 5.9 m-20 -122.84 100.51 6.94 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 111.778 -2.465 . . . . 0.0 108.915 -169.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -75.51 99.51 4.25 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.245 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 51.43 43.06 51.79 Favored Glycine 0 CA--C 1.506 -0.504 0 N-CA-C 115.582 0.993 . . . . 0.0 115.582 174.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.763 ' HD2' ' HB3' ' A' ' 924' ' ' ASP . 31.0 m-70 -98.24 -167.93 1.58 Allowed 'General case' 0 CA--C 1.493 -1.249 0 N-CA-C 105.37 -2.085 . . . . 0.0 105.37 171.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 928' ' ' THR . . . . . 0.611 ' HB ' ' HB2' ' A' 1029 ' ' LYS . 1.0 OUTLIER -143.72 120.01 10.89 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 102.132 -3.285 . . . . 0.0 102.132 168.442 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.506 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.0 OUTLIER -142.16 168.36 19.92 Favored 'General case' 0 C--N 1.272 -2.783 0 C-N-CA 118.865 -1.134 . . . . 0.0 110.797 -178.375 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . 0.627 ' O ' ' HG2' ' A' 1027 ' ' ARG . 54.7 t80 -157.19 124.7 5.31 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.589 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 17.8 m -75.42 126.85 31.84 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 118.897 0.771 . . . . 0.0 109.617 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -104.72 159.18 15.99 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 -177.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.473 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -153.42 145.01 23.31 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -174.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 12.0 p -139.5 172.89 12.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 105.365 -2.087 . . . . 0.0 105.365 178.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.553 ' HA ' ' O ' ' A' 1021 ' ' ARG . 54.8 m-85 -132.52 138.88 47.67 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 118.7 0.682 . . . . 0.0 110.248 -174.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.619 ' O ' ' HA ' ' A' 1020 ' ' ARG . 24.3 tt0 -113.77 126.21 54.97 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -176.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . 0.517 ' HA ' ' O ' ' A' 1019 ' ' ARG . 0.0 OUTLIER -124.25 141.31 52.17 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 122.127 0.965 . . . . 0.0 113.432 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.53 ' HG2' ' HA ' ' A' ' 948' ' ' PRO . 35.8 mt-10 -115.31 158.5 22.3 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 104.972 -2.232 . . . . 0.0 104.972 171.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 36.8 m -139.62 152.58 46.9 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 119.007 0.821 . . . . 0.0 109.846 -172.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.677 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 24.6 ptt180 -156.99 160.95 39.53 Favored 'General case' 0 N--CA 1.44 -0.953 0 O-C-N 124.548 1.155 . . . . 0.0 109.499 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -78.55 161.26 70.29 Favored Pre-proline 0 C--N 1.312 -1.038 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 170.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -63.36 87.09 0.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 121.374 1.383 . . . . 0.0 111.273 172.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.22 1.93 5.17 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -176.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . 0.59 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -100.21 -178.68 30.19 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 109.88 -1.288 . . . . 0.0 109.88 177.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -108.38 163.1 13.5 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 171.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.677 ' CZ3' ' HG2' ' A' ' 940' ' ' ARG . 53.5 m95 -83.87 137.61 33.59 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 117.901 0.318 . . . . 0.0 110.756 -173.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -129.78 139.1 34.66 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 170.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.53 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 6.8 Cg_endo -50.28 123.4 11.05 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.691 2.261 . . . . 0.0 112.777 -176.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -52.04 151.2 3.83 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -57.3 -45.97 83.64 Favored 'General case' 0 CA--C 1.484 -1.561 0 CA-C-N 114.799 -1.091 . . . . 0.0 108.453 172.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . 0.432 ' HB3' ' HG2' ' A' ' 960' ' ' LYS . 52.8 m-20 -96.4 77.12 2.97 Favored 'General case' 0 N--CA 1.414 -2.267 0 N-CA-C 105.113 -2.18 . . . . 0.0 105.113 175.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 3.9 m -63.77 -41.73 97.91 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.439 -168.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -108.74 137.73 46.21 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 122.02 0.914 . . . . 0.0 112.18 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 4.6 p -144.87 174.47 10.97 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 125.485 1.514 . . . . 0.0 108.257 -170.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -106.07 178.69 4.49 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 173.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.47 -28.35 13.02 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -93.62 -13.16 27.96 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.934 -0.479 . . . . 0.0 111.455 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 107.33 -2.95 34.82 Favored Glycine 0 CA--C 1.491 -1.461 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.099 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -58.07 107.33 0.46 Allowed 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . 0.432 ' HG2' ' HB3' ' A' ' 951' ' ' ASP . 1.1 tmtp? -47.03 119.64 2.66 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 124.556 1.16 . . . . 0.0 110.169 178.565 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.45 179.59 4.07 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.047 -0.978 . . . . 0.0 110.306 -175.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . 0.438 ' HB2' ' HB2' ' A' ' 966' ' ' GLU . . . -78.4 156.37 29.5 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.813 178.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 13.0 p -76.21 161.23 75.87 Favored Pre-proline 0 N--CA 1.437 -1.096 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 178.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -61.12 -18.28 57.17 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 122.716 2.278 . . . . 0.0 112.454 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 4.2 m -74.27 -48.83 26.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 174.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . 0.438 ' HB2' ' HB2' ' A' ' 962' ' ' ALA . 42.4 mt-10 -65.26 -37.31 86.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.499 -1.228 . . . . 0.0 112.389 177.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.47 111.0 2.14 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.236 0.541 . . . . 0.0 110.396 -177.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 73.0 p -107.24 165.36 11.43 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.863 -176.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.601 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 9.1 p -97.81 128.6 33.57 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.705 172.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.566 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 61.3 Cg_endo -71.11 169.0 21.66 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.488 2.125 . . . . 0.0 110.34 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -46.91 -34.78 16.96 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.125 2.55 . . . . 0.0 114.685 -178.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.538 ' O ' ' HG2' ' A' 1029 ' ' LYS . . . -101.43 8.42 56.85 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 119.943 -1.122 . . . . 0.0 112.995 -177.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.601 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 76.1 m95 -124.2 133.47 53.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.829 0.823 . . . . 0.0 110.451 179.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.539 ' HB3' ' O ' ' A' 1028 ' ' LYS . 5.5 tp10 -126.01 119.45 27.71 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 126.563 1.945 . . . . 0.0 109.569 -173.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.658 ' CE3' ' HG2' ' A' 1025 ' ' ARG . 90.2 m95 -70.35 104.56 2.73 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 121.416 -0.802 . . . . 0.0 111.716 -178.033 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -70.49 -38.55 74.37 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.563 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . 0.529 ' HB2' ' HG3' ' A' 1025 ' ' ARG . 83.5 m-20 -78.46 152.67 31.98 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.269 0.557 . . . . 0.0 111.811 -176.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -88.69 107.57 19.01 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 174.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . 57.13 173.04 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 123.37 1.557 . . . . 0.0 114.405 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.432 ' HA ' ' O ' ' A' 1024 ' ' VAL . 24.5 m95 -91.2 124.09 35.15 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 112.851 -1.977 . . . . 0.0 108.08 177.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 15.1 m -124.31 155.62 38.37 Favored 'General case' 0 C--O 1.206 -1.211 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -175.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -74.46 144.68 44.1 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 119.044 0.838 . . . . 0.0 111.206 -174.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.448 ' HB3' ' HD2' ' A' 1022 ' ' ARG . 18.0 t70 -102.67 126.16 49.66 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.633 -174.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.0 pp -114.86 26.5 3.69 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.111 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -109.25 27.27 9.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 123.489 1.614 . . . . 0.0 107.31 -178.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.651 ' HG2' ' H ' ' A' ' 987' ' ' ALA . 11.3 ttt180 -141.24 -178.58 5.66 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 -178.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.651 ' H ' ' HG2' ' A' ' 986' ' ' ARG . . . -89.0 82.0 6.75 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 119.451 1.023 . . . . 0.0 109.732 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.404 HG22 ' O ' ' A' ' 983' ' ' ASP . 28.3 m -128.41 -172.15 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 114.337 -1.301 . . . . 0.0 109.289 -178.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . 0.401 ' CG ' ' H ' ' A' ' 990' ' ' GLU . 34.2 t70 -92.9 -178.8 4.93 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 177.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . 0.401 ' H ' ' CG ' ' A' ' 989' ' ' ASP . 46.7 mt-10 -57.07 -33.45 67.27 Favored 'General case' 0 CA--C 1.494 -1.181 0 C-N-CA 123.987 0.915 . . . . 0.0 111.721 179.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -108.25 17.41 22.25 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.222 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 86.13 -23.06 10.08 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.12 -0.945 . . . . 0.0 113.588 177.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.846 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 79.0 m95 -56.25 111.68 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.695 0.759 . . . . 0.0 112.5 -177.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.692 ' HG3' ' CE3' ' A' 1008 ' ' TRP . 7.4 pt-20 -98.62 157.25 16.37 Favored 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 124.244 1.018 . . . . 0.0 109.944 -178.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.502 ' HH ' HD13 ' A' ' 997' ' ' ILE . 59.3 t80 -64.99 99.08 0.32 Allowed 'General case' 0 C--O 1.211 -0.953 0 CA-C-N 111.803 -2.453 . . . . 0.0 113.002 -174.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -120.9 114.93 2.75 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 119.462 -1.351 . . . . 0.0 112.573 172.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.502 HD13 ' HH ' ' A' ' 995' ' ' TYR . 1.6 pt -118.57 151.84 20.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 106.131 -1.803 . . . . 0.0 106.131 174.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 76.7 m -133.37 97.32 3.93 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-O 122.168 0.985 . . . . 0.0 110.589 174.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 77.0 mt -97.42 115.52 65.75 Favored Pre-proline 0 C--N 1.317 -0.845 0 CA-C-N 114.014 -1.448 . . . . 0.0 109.184 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1000 ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 27.0 Cg_exo -60.57 141.87 96.43 Favored 'Trans proline' 0 C--O 1.241 0.649 0 C-N-CA 122.82 2.347 . . . . 0.0 112.864 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1001 ' ' PRO . . . . . 0.437 ' O ' ' HB2' ' A' 1002 ' ' ASP . 9.7 Cg_endo -90.41 141.13 13.37 Favored 'Cis proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.862 -1.724 . . . . 0.0 114.365 0.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1002 ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' 1001 ' ' PRO . 7.8 t0 160.17 166.59 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 111.867 -2.424 . . . . 0.0 106.521 176.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -117.04 -33.63 4.66 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 174.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 33.8 mttm -105.88 134.12 19.88 Favored Pre-proline 0 N--CA 1.429 -1.507 0 CA-C-N 114.806 -1.088 . . . . 0.0 113.463 -171.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1005 ' ' PRO . . . . . 0.556 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 31.7 Cg_exo -66.26 126.28 15.43 Favored 'Trans proline' 0 C--N 1.329 -0.463 0 C-N-CA 122.775 2.317 . . . . 0.0 109.782 167.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -84.03 -57.39 3.21 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 122.217 1.008 . . . . 0.0 109.409 -177.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 3.7 m -87.5 136.01 33.11 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 112.742 -2.026 . . . . 0.0 111.608 -173.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.692 ' CE3' ' HG3' ' A' ' 994' ' ' GLU . 60.4 m95 -134.65 137.2 43.42 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 11.0 m -163.11 -173.31 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -175.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -97.3 97.6 9.28 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 175.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -165.27 167.37 18.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.426 -176.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.605 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.9 tp10 -148.2 101.24 3.25 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-O 122.066 0.936 . . . . 0.0 109.553 178.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 90.4 mttt -118.0 135.92 53.85 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 113.662 -1.608 . . . . 0.0 107.363 174.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 56.8 ttp -44.87 -22.77 0.1 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -177.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -68.01 -9.03 42.5 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 178.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.605 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 2.5 m80 -50.49 107.7 0.18 Allowed 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 123.754 0.821 . . . . 0.0 112.419 176.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1017 ' ' THR . . . . . 0.409 ' H ' ' HA ' ' A' ' 997' ' ' ILE . 2.6 m -103.21 -21.38 13.87 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.78 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 3.5 m170 -145.54 123.3 11.9 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.576 -172.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.846 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 17.8 mmt180 -100.36 136.36 40.37 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 170.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.619 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 41.8 ttm180 -140.25 161.97 36.39 Favored 'General case' 0 C--O 1.197 -1.674 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 178.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.6 ptt180 -159.28 159.21 33.8 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 118.068 0.395 . . . . 0.0 110.257 174.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.473 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.5 ttm180 -90.6 120.99 32.13 Favored 'General case' 0 N--CA 1.424 -1.771 0 O-C-N 123.842 0.714 . . . . 0.0 109.934 177.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1023 ' ' LEU . . . . . . . . . . . . . 65.7 mt -102.66 126.89 49.92 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 104.648 -2.352 . . . . 0.0 104.648 167.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.432 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 6.9 m -110.29 151.54 12.48 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.895 0 CA-C-O 122.032 0.92 . . . . 0.0 111.667 -175.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.658 ' HG2' ' CE3' ' A' ' 975' ' ' TRP . 0.6 OUTLIER -149.53 111.49 4.6 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 113.054 -1.884 . . . . 0.0 108.997 169.017 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.5 tmmm? -70.86 138.05 49.9 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.642 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 14.1 ptm180 -122.02 150.95 41.37 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 104.092 -2.559 . . . . 0.0 104.092 -173.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.539 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 71.3 tttt -144.8 132.07 20.63 Favored 'General case' 0 C--N 1.283 -2.31 0 O-C-N 123.265 0.353 . . . . 0.0 110.399 -167.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.611 ' HB2' ' HB ' ' A' ' 928' ' ' THR . 24.3 mtpp -88.58 -24.42 22.87 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 123.685 1.707 . . . . 0.0 108.049 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1030 ' ' ASP . . . . . 0.48 ' HB3' HG22 ' A' 1032 ' ' THR . 29.8 t0 50.21 10.25 0.05 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 110.895 -2.866 . . . . 0.0 112.742 -168.326 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.45 ' H ' ' C ' ' A' 1029 ' ' LYS . 20.8 tp 60.15 13.68 4.01 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.053 1.741 . . . . 0.0 111.625 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1032 ' ' THR . . . . . 0.48 HG22 ' HB3' ' A' 1030 ' ' ASP . 13.5 t -125.55 7.07 7.59 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -174.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.496 ' OE1' ' HB2' ' A' ' 974' ' ' GLU . 6.0 tt0 -112.28 138.03 49.57 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.914 -177.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 6.3 t -50.19 95.66 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 -173.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -100.05 -37.84 8.81 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 169.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 16.8 m -97.14 84.9 3.59 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.198 -1.365 . . . . 0.0 108.769 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 15.6 m -79.63 -12.38 59.83 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.31 178.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 24.6 m -60.98 128.34 35.96 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.957 177.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -75.44 86.34 2.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.362 0.601 . . . . 0.0 111.134 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 . . . . . 0 C--N 1.314 -0.959 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 175.548 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.471 0.623 0 CA-C-O 120.993 0.425 . . . . 0.0 110.875 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . 0.681 ' HB3' ' HB ' ' A' ' 922' ' ' THR . 6.7 t70 -133.82 147.89 66.13 Favored Pre-proline 0 C--N 1.315 -0.902 0 N-CA-C 107.832 -1.174 . . . . 0.0 107.832 177.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -42.76 -40.54 8.07 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 123.654 2.903 . . . . 0.0 114.235 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -104.98 -41.05 5.7 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 122.246 -0.284 . . . . 0.0 110.281 177.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 922' ' ' THR . . . . . 0.681 ' HB ' ' HB3' ' A' ' 919' ' ' ASP . 92.2 m -84.45 75.47 10.25 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 122.515 1.15 . . . . 0.0 109.952 177.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -80.44 -28.09 37.78 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.877 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -130.39 143.08 50.54 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.429 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -126.87 15.19 7.45 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.122 178.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . 0.424 ' O ' ' HB2' ' A' 1031 ' ' LEU . . . 106.6 56.35 0.64 Allowed Glycine 0 CA--C 1.496 -1.144 0 N-CA-C 110.565 -1.014 . . . . 0.0 110.565 -178.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 65.2 m-70 -105.09 -31.63 9.08 Favored 'General case' 0 CA--C 1.499 -1.008 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.735 177.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 2.9 m 60.84 85.38 0.11 Allowed 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.962 0.887 . . . . 0.0 108.784 -167.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.841 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.6 OUTLIER -104.76 165.92 10.74 Favored 'General case' 0 C--N 1.282 -2.33 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 178.225 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . 0.566 ' O ' ' HG2' ' A' 1027 ' ' ARG . 79.2 t80 -148.45 123.56 10.13 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 -178.098 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 931' ' ' THR . . . . . . . . . . . . . 21.1 m -75.97 114.76 14.96 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 173.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -93.66 163.37 13.57 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.539 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 11.9 pt-20 -162.01 145.98 12.32 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 118.64 0.655 . . . . 0.0 110.368 -171.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 5.8 p -155.43 128.31 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.537 0.684 . . . . 0.0 111.381 172.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.643 ' HA ' ' O ' ' A' 1021 ' ' ARG . 70.1 m-85 -90.32 113.38 25.23 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.524 ' O ' ' HA ' ' A' 1020 ' ' ARG . 16.3 tt0 -79.52 128.62 33.59 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.792 171.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . 0.44 ' N ' HD21 ' A' ' 937' ' ' ASN . 0.5 OUTLIER -117.89 146.58 43.82 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 123.501 0.72 . . . . 0.0 109.907 -177.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.598 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 38.4 mt-10 -129.07 172.11 11.72 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 171.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 27.1 t -152.08 136.76 17.0 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 118.529 0.604 . . . . 0.0 110.622 -175.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.63 ' O ' ' HA ' ' A' 1017 ' ' THR . 22.4 ptt180 -136.85 159.63 41.3 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 176.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -81.21 166.92 35.56 Favored Pre-proline 0 C--N 1.308 -1.227 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 171.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . 0.442 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 15.6 Cg_exo -69.66 86.69 0.56 Allowed 'Trans proline' 0 N--CA 1.452 -0.948 0 N-CA-C 108.988 -1.197 . . . . 0.0 108.988 170.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.13 8.18 3.41 Favored Glycine 0 N--CA 1.436 -1.352 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 -173.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . 0.496 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -117.89 -179.26 17.32 Favored Glycine 0 CA--C 1.503 -0.713 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -112.02 158.28 19.74 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 119.822 1.811 . . . . 0.0 107.012 172.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.598 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 28.9 m95 -67.35 138.69 56.96 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-O 121.392 0.615 . . . . 0.0 110.798 -174.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -129.12 179.31 1.33 Allowed Pre-proline 0 C--N 1.302 -1.498 0 N-CA-C 101.412 -3.551 . . . . 0.0 101.412 174.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.9 144.48 99.57 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 CA-C-N 123.243 2.194 . . . . 0.0 111.406 177.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.94 -170.09 0.1 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.481 0.658 . . . . 0.0 110.818 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.62 -35.74 14.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 -177.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -123.28 100.15 6.7 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 104.556 -2.387 . . . . 0.0 104.556 168.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 27.6 m -69.13 -59.45 3.02 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -173.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -96.0 128.25 42.73 Favored 'General case' 0 C--N 1.313 -0.99 0 O-C-N 121.277 -0.889 . . . . 0.0 109.719 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 18.1 p -148.89 -178.05 6.14 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.705 0.764 . . . . 0.0 111.352 -168.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -108.3 168.49 9.27 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 104.314 -2.476 . . . . 0.0 104.314 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.38 -30.88 31.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 119.153 0.888 . . . . 0.0 111.114 174.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -78.54 -8.34 58.47 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 95.07 -4.75 68.02 Favored Glycine 0 CA--C 1.501 -0.799 0 C-N-CA 120.263 -0.97 . . . . 0.0 112.224 178.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -62.08 102.25 0.27 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . 0.409 ' C ' ' HD3' ' A' ' 960' ' ' LYS . 12.5 tmtt? -50.68 122.78 7.74 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.571 1.17 . . . . 0.0 109.438 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.24 -173.2 2.41 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.317 -178.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . 0.562 ' HB3' ' HB2' ' A' ' 966' ' ' GLU . . . -78.9 152.94 30.89 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 177.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.3 m -79.05 157.7 75.68 Favored Pre-proline 0 C--N 1.315 -0.892 0 N-CA-C 107.435 -1.321 . . . . 0.0 107.435 178.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.57 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 7.5 Cg_exo -49.18 -24.89 8.66 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.586 2.857 . . . . 0.0 115.653 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.8 t -80.24 -43.34 21.58 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 177.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . 0.562 ' HB2' ' HB3' ' A' ' 962' ' ' ALA . 46.2 mm-40 -64.87 -32.2 73.79 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.768 175.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.482 HD13 ' CH2' ' A' ' 980' ' ' TRP . 83.6 mt -68.59 118.55 11.76 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 175.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 10.0 p -126.14 -175.39 3.35 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.126 -171.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.647 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 25.9 p -109.99 124.94 32.2 Favored Pre-proline 0 N--CA 1.435 -1.189 0 O-C-N 121.905 -0.497 . . . . 0.0 110.457 177.344 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.6 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 98.1 Cg_endo -77.04 173.24 14.77 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 122.908 2.405 . . . . 0.0 110.713 174.034 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -41.93 -48.64 6.02 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 124.271 3.314 . . . . 0.0 115.451 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.443 ' O ' ' HA ' ' A' 1029 ' ' LYS . . . -101.38 14.01 58.21 Favored Glycine 0 N--CA 1.439 -1.102 0 C-N-CA 120.141 -1.028 . . . . 0.0 113.584 -175.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.647 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 88.5 m95 -119.95 121.4 38.91 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 118.437 1.118 . . . . 0.0 111.71 179.342 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.456 ' HB2' ' OE1' ' A' 1033 ' ' GLN . 7.5 tp10 -110.08 127.69 55.01 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 126.602 1.961 . . . . 0.0 109.585 -172.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -70.77 106.89 3.73 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.722 0.772 . . . . 0.0 112.393 174.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -72.15 -47.11 53.41 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 172.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . 0.786 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 3.6 m-20 -87.41 160.6 18.26 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.704 -1.135 . . . . 0.0 112.229 -178.551 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -91.13 -53.32 4.41 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -168.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -148.32 132.67 17.53 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -173.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.57 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 17.1 m95 -61.11 123.1 16.69 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 123.989 0.805 . . . . 0.0 109.806 -172.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 49.8 p -122.8 156.02 35.38 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -177.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . 0.477 ' HB3' ' HD2' ' A' 1021 ' ' ARG . 0.0 OUTLIER -72.47 140.84 48.49 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.334 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.506 ' HB2' HG11 ' A' 1024 ' ' VAL . 52.6 t0 -91.16 130.5 37.04 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.832 -1.077 . . . . 0.0 111.117 -171.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.1 pp -115.59 14.25 7.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.501 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . 0.585 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 3.5 t-20 -97.37 16.45 20.07 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.009 0.909 . . . . 0.0 109.146 -176.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.585 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 7.6 mpt_? -139.87 179.75 6.42 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -175.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.85 86.2 3.43 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.691 0.758 . . . . 0.0 110.768 179.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 18.2 m -125.73 -179.23 2.37 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 114.933 -1.03 . . . . 0.0 109.39 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -73.67 177.82 5.17 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -64.82 -28.14 69.36 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 118.725 0.693 . . . . 0.0 111.768 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 57.3 mttt -85.87 -57.42 3.05 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 141.08 71.79 0.03 OUTLIER Glycine 0 CA--C 1.498 -1.013 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.667 177.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -145.6 140.79 27.63 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -99.93 160.08 14.59 Favored 'General case' 0 C--O 1.252 1.235 0 CA-C-N 118.944 0.793 . . . . 0.0 109.996 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.645 ' O ' ' HA ' ' A' 1008 ' ' TRP . 21.6 t80 -83.65 99.36 10.16 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 127.412 2.285 . . . . 0.0 109.547 -176.078 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . 0.513 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -120.97 120.95 4.65 Favored Glycine 0 N--CA 1.433 -1.505 0 C-N-CA 119.005 -1.569 . . . . 0.0 110.741 175.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.523 HG23 ' HA ' ' A' 1016 ' ' HIS . 13.8 pt -127.47 143.17 41.52 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 C-N-CA 118.579 -1.248 . . . . 0.0 109.148 177.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.7 t -146.1 155.63 42.89 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 20.5 pt -116.6 107.91 45.92 Favored Pre-proline 0 C--N 1.315 -0.927 0 C-N-CA 119.931 -0.708 . . . . 0.0 110.865 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1000 ' ' PRO . . . . . 0.434 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 38.3 Cg_endo -69.13 136.6 35.11 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.497 2.131 . . . . 0.0 112.556 -178.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1001 ' ' PRO . . . . . 0.434 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 5.5 Cg_endo -87.15 150.35 38.57 Favored 'Cis proline' 0 N--CA 1.45 -1.035 0 C-N-CA 122.938 -1.692 . . . . 0.0 112.816 -1.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 25.0 t70 -165.0 -86.68 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 113.336 -1.756 . . . . 0.0 107.707 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -178.5 -81.14 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 63.3 mttm -144.19 160.42 49.06 Favored Pre-proline 0 C--N 1.317 -0.811 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1005 ' ' PRO . . . . . 0.556 ' HG2' ' HB2' ' A' 1018 ' ' HIS . 36.1 Cg_exo -58.5 144.34 97.04 Favored 'Trans proline' 0 C--O 1.241 0.675 0 C-N-CA 122.433 2.089 . . . . 0.0 110.882 169.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 39.8 mmtt -98.85 -48.18 5.01 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 -177.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 3.4 m -89.06 139.14 30.76 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 111.724 -2.489 . . . . 0.0 111.406 -173.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.645 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 61.8 m95 -135.11 132.64 38.34 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 175.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 37.1 t -142.11 170.04 12.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 -169.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -90.53 97.99 11.51 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 119.619 1.099 . . . . 0.0 108.274 172.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1011 ' ' ALA . . . . . 0.423 ' HB2' ' CD2' ' A' ' 995' ' ' TYR . . . -177.08 177.26 1.28 Allowed 'General case' 0 C--O 1.238 0.492 0 C-N-CA 122.81 0.444 . . . . 0.0 109.862 -176.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.531 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.1 OUTLIER -169.48 110.62 0.46 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.242 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 76.3 mttt -122.34 150.81 41.87 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.384 -1.28 . . . . 0.0 108.756 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1014 ' ' MET . . . . . 0.421 ' C ' ' H ' ' A' 1016 ' ' HIS . 24.2 ttt -53.43 -36.26 61.35 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1015 ' ' TYR . . . . . 0.442 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 59.7 m-85 -72.85 14.21 0.3 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.03 0.532 . . . . 0.0 111.62 -179.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.621 ' HB2' HH21 ' A' ' 940' ' ' ARG . 0.3 OUTLIER -63.45 176.38 0.84 Allowed 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 121.863 0.84 . . . . 0.0 110.12 171.032 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 1017 ' ' THR . . . . . 0.63 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.7 OUTLIER -163.41 -31.04 0.04 OUTLIER 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.006 -1.452 . . . . 0.0 108.793 -168.236 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 1018 ' ' HIS . . . . . 0.556 ' HB2' ' HG2' ' A' 1005 ' ' PRO . 59.7 m80 -145.56 155.87 43.33 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.416 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.415 ' O ' ' HA ' ' A' ' 937' ' ' ASN . 35.8 ptt180 -154.66 152.52 30.06 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 105.863 -1.903 . . . . 0.0 105.863 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.524 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 3.8 ptp180 -151.65 165.58 33.9 Favored 'General case' 0 C--O 1.195 -1.805 0 C-N-CA 118.418 -1.313 . . . . 0.0 109.837 178.188 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.643 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.3 ptt180 -149.17 145.71 27.3 Favored 'General case' 0 C--N 1.289 -2.05 0 C-N-CA 119.471 -0.891 . . . . 0.0 109.64 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.539 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.7 ttm180 -85.91 114.99 23.26 Favored 'General case' 0 N--CA 1.424 -1.749 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.443 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 65.6 mt -84.67 123.31 30.22 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 103.603 -2.74 . . . . 0.0 103.603 167.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.506 HG11 ' HB2' ' A' ' 983' ' ' ASP . 3.3 m -102.3 149.41 6.89 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.92 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -176.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.786 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -152.34 110.0 3.62 Favored 'General case' 0 C--N 1.289 -2.048 0 O-C-N 125.138 1.524 . . . . 0.0 111.542 166.558 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.455 ' HD2' ' N ' ' A' 1027 ' ' ARG . 2.7 tmmm? -84.35 146.42 27.71 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -176.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.566 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 12.2 ptm180 -142.98 179.9 6.76 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 104.643 -2.355 . . . . 0.0 104.643 -170.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.841 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 14.1 ptpt -162.56 155.58 19.83 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 118.648 0.658 . . . . 0.0 109.767 178.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.443 ' HA ' ' O ' ' A' ' 972' ' ' GLY . 33.1 ttmt -91.24 -12.56 34.86 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.166 0.984 . . . . 0.0 109.953 -172.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 33.9 t70 60.03 19.44 8.58 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.208 -1.815 . . . . 0.0 108.734 -175.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.424 ' HB2' ' O ' ' A' ' 926' ' ' GLY . 37.3 tp 62.33 -29.46 0.08 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.865 2.066 . . . . 0.0 115.196 -179.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 13.4 t -136.41 19.87 3.14 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 119.508 1.049 . . . . 0.0 110.106 -169.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.456 ' OE1' ' HB2' ' A' ' 974' ' ' GLU . 18.5 tt0 -75.94 -20.76 57.69 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.559 0.695 . . . . 0.0 110.561 -179.027 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 1.5 m -83.57 111.0 18.7 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -57.82 122.22 12.36 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.542 0.526 . . . . 0.0 110.742 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 16.0 m -95.65 -33.81 12.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 52.4 m -114.44 127.77 56.0 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.937 176.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 20.3 m -117.49 107.89 14.86 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -99.03 172.67 7.25 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.244 -0.435 . . . . 0.0 109.94 -179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 . . . . . 0 C--N 1.315 -0.914 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.452 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . 0.406 HD13 ' HE2' ' A' ' 921' ' ' PHE . 27.0 pt . . . . . 0 N--CA 1.473 0.685 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -94.43 154.38 40.26 Favored Pre-proline 0 C--N 1.31 -1.134 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -64.31 95.72 0.22 Allowed 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.705 2.27 . . . . 0.0 111.816 178.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . 0.406 ' HE2' HD13 ' A' ' 918' ' ' ILE . 95.4 m-85 -62.34 -41.01 98.23 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.017 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 5.7 m -101.93 -9.23 20.86 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.082 -173.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . 67.33 111.16 0.04 OUTLIER 'General case' 0 C--O 1.237 0.422 0 CA-C-O 122.023 0.916 . . . . 0.0 108.536 -172.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -91.31 101.91 14.61 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 122.129 0.966 . . . . 0.0 111.304 -173.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . 0.565 ' H ' ' NE2' ' A' ' 927' ' ' HIS . . . -102.52 -150.99 0.42 Allowed 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 171.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -77.98 79.62 1.43 Allowed Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.204 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.565 ' NE2' ' H ' ' A' ' 925' ' ' ALA . 0.0 OUTLIER -127.74 132.31 49.58 Favored 'General case' 0 CA--C 1.487 -1.478 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.483 176.104 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 928' ' ' THR . . . . . 0.421 ' OG1' ' HB3' ' A' 1029 ' ' LYS . 0.5 OUTLIER -91.34 113.29 25.52 Favored 'General case' 0 N--CA 1.415 -2.213 0 N-CA-C 104.809 -2.293 . . . . 0.0 104.809 160.555 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.611 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.4 OUTLIER -129.28 129.62 45.14 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 176.866 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -121.64 135.14 54.99 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -179.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 26.0 m -71.16 123.06 21.3 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 177.279 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -98.54 156.53 16.74 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 104.651 -2.351 . . . . 0.0 104.651 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.763 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.1 pt-20 -154.93 159.21 40.26 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 118.209 0.459 . . . . 0.0 110.672 -170.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.436 HG12 ' CZ3' ' A' ' 980' ' ' TRP . 7.7 p -158.77 131.37 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 170.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.44 ' HA ' ' O ' ' A' 1021 ' ' ARG . 37.7 m-85 -82.3 150.19 27.38 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 122.284 1.04 . . . . 0.0 111.063 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.572 ' O ' ' HA ' ' A' 1020 ' ' ARG . 23.8 tt0 -126.12 125.42 42.49 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 -179.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . 0.983 ' HB3' ' HG2' ' A' 1020 ' ' ARG . 0.0 OUTLIER -124.1 145.68 49.11 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.787 0.804 . . . . 0.0 111.398 -178.392 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.583 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 18.8 mt-10 -139.13 153.3 47.96 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 -178.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 15.2 m -136.37 149.55 48.39 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 121.168 0.509 . . . . 0.0 111.544 -172.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.571 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 20.2 ptt180 -146.62 161.34 40.74 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 114.14 -1.391 . . . . 0.0 108.343 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -66.89 158.76 79.33 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 170.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . 0.555 ' HG3' HG22 ' A' 1017 ' ' THR . 36.9 Cg_exo -61.13 85.85 0.09 OUTLIER 'Trans proline' 0 C--O 1.237 0.458 0 CA-C-N 120.687 1.281 . . . . 0.0 110.39 172.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 110.03 73.52 0.75 Allowed Glycine 0 N--CA 1.434 -1.457 0 N-CA-C 106.74 -2.544 . . . . 0.0 106.74 -173.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -166.34 -144.89 4.25 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 119.721 -1.228 . . . . 0.0 113.65 -172.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -128.91 123.6 33.02 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.417 -0.892 . . . . 0.0 110.639 -172.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.583 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 64.3 m95 -73.84 136.44 43.48 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 -178.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -142.34 163.16 41.12 Favored Pre-proline 0 C--N 1.295 -1.763 0 N-CA-C 102.791 -3.04 . . . . 0.0 102.791 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -49.2 137.06 30.52 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.851 1.7 . . . . 0.0 113.575 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.38 -172.7 0.08 Allowed 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.349 175.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.402 ' H ' ' CD ' ' A' ' 950' ' ' GLU . 0.1 OUTLIER -84.36 -35.91 22.86 Favored 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 -178.452 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . 0.489 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 53.4 m-20 -123.03 97.45 5.44 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 170.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 25.7 m -61.16 -49.67 76.3 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -170.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -102.73 126.17 49.74 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.026 0.917 . . . . 0.0 111.783 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 10.6 p -135.16 165.59 25.05 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.702 -174.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -91.19 170.05 10.33 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 172.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.93 -29.88 22.05 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.101 0.864 . . . . 0.0 112.635 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -96.02 13.05 28.33 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 70.67 49.39 30.32 Favored Glycine 0 CA--C 1.484 -1.898 0 C-N-CA 121.061 -0.59 . . . . 0.0 111.711 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -107.73 109.43 21.02 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 103.617 -2.734 . . . . 0.0 103.617 177.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . 0.489 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 20.9 tptm -45.16 113.54 0.59 Allowed 'General case' 0 C--N 1.312 -1.027 0 O-C-N 124.6 1.188 . . . . 0.0 111.276 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.11 176.02 5.41 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.002 -176.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . 0.489 ' HB2' ' HB2' ' A' ' 966' ' ' GLU . . . -80.5 159.88 25.41 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.2 m -86.87 159.02 52.67 Favored Pre-proline 0 N--CA 1.433 -1.304 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.61 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 15.4 Cg_exo -46.57 -26.77 4.58 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 124.225 3.283 . . . . 0.0 115.608 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.9 t -71.93 -49.22 39.46 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . 0.489 ' HB2' ' HB2' ' A' ' 962' ' ' ALA . 1.5 mp0 -64.56 -33.15 75.25 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.15 0.5 . . . . 0.0 110.181 176.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 73.5 mt -64.89 110.96 2.61 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.978 0.894 . . . . 0.0 109.591 178.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.09 179.21 5.88 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.141 -173.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.506 ' HB3' ' NE1' ' A' ' 975' ' ' TRP . 25.0 p -94.74 136.87 22.65 Favored Pre-proline 0 C--N 1.321 -0.632 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.974 -176.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.561 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 44.7 Cg_endo -84.78 167.66 11.24 Favored 'Trans proline' 0 C--O 1.241 0.641 0 C-N-CA 122.977 2.452 . . . . 0.0 110.731 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . 0.583 ' HB2' ' HB1' ' A' 1035 ' ' ALA . 14.9 Cg_exo -67.01 103.96 0.79 Allowed 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 121.607 1.538 . . . . 0.0 110.289 175.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.502 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 124.59 -2.23 8.74 Favored Glycine 0 N--CA 1.438 -1.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.92 -177.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.561 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 94.5 m95 -133.98 130.75 38.08 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 122.035 0.921 . . . . 0.0 111.255 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -117.24 131.41 56.85 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 126.586 1.954 . . . . 0.0 109.602 -170.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.574 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 91.9 m95 -83.95 156.74 22.18 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.571 177.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -140.11 -36.36 0.49 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.183 -178.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -68.15 146.52 53.35 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.507 178.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.55 -43.63 80.22 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -177.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.73 168.51 12.43 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -176.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.61 ' CD1' ' HB3' ' A' ' 964' ' ' PRO . 45.2 m95 -70.07 118.37 12.81 Favored 'General case' 0 C--N 1.309 -1.159 0 O-C-N 124.435 1.085 . . . . 0.0 108.446 -179.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 981' ' ' SER . . . . . 0.65 ' O ' ' HA ' ' A' 1023 ' ' LEU . 21.0 m -110.3 -161.0 0.73 Allowed 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 104.853 -2.277 . . . . 0.0 104.853 -173.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -119.75 153.06 36.24 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 121.669 2.031 . . . . 0.0 109.697 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.521 ' HB2' ' HD2' ' A' 1022 ' ' ARG . 20.8 t70 -83.28 114.95 21.75 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.719 0.771 . . . . 0.0 111.063 -173.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.429 ' HA ' HG22 ' A' ' 988' ' ' VAL . 23.4 pt -107.1 -157.89 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.649 176.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 10.1 t30 49.79 44.01 24.85 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.923 1.344 . . . . 0.0 108.589 -172.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.46 ' HG2' ' H ' ' A' ' 987' ' ' ALA . 52.4 ttt85 -153.43 -179.71 8.01 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 -172.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.46 ' H ' ' HG2' ' A' ' 986' ' ' ARG . . . -87.95 69.82 9.42 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.832 -1.174 . . . . 0.0 107.832 176.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.454 ' CG1' ' HD3' ' A' ' 986' ' ' ARG . 24.1 m -122.79 150.66 26.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.67 -1.15 . . . . 0.0 113.154 -173.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . 0.424 ' HB3' ' HB2' ' A' ' 993' ' ' TRP . 23.8 t70 -55.25 171.68 0.16 Allowed 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 113.271 -1.786 . . . . 0.0 110.751 168.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.53 -34.01 47.89 Favored 'General case' 0 CA--C 1.499 -0.991 0 C-N-CA 123.669 0.788 . . . . 0.0 111.304 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . 0.518 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 71.3 mmtt -106.46 16.92 24.07 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.347 -174.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 93.69 -11.1 71.79 Favored Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.586 173.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.615 ' CG ' ' HD3' ' A' 1019 ' ' ARG . 97.1 m95 -59.93 153.31 21.45 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -137.49 152.38 49.47 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-N 115.238 -0.892 . . . . 0.0 112.252 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.703 ' HD2' ' HB ' ' A' 1009 ' ' VAL . 0.3 OUTLIER -62.32 99.85 0.15 Allowed 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 113.429 -1.714 . . . . 0.0 111.853 -178.267 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . 0.493 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -117.91 84.36 0.37 Allowed Glycine 0 CA--C 1.49 -1.497 0 C-N-CA 118.964 -1.589 . . . . 0.0 111.829 172.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.742 ' O ' ' HA ' ' A' 1005 ' ' PRO . 2.3 tt -92.4 131.79 38.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 O-C-N 121.581 -0.953 . . . . 0.0 109.806 -176.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 29.4 m -131.23 110.93 11.48 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 61.0 mt -117.81 119.46 33.87 Favored Pre-proline 0 C--N 1.314 -0.975 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.489 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -58.53 144.62 96.88 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 122.816 2.344 . . . . 0.0 112.145 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -90.86 127.22 6.48 Favored 'Cis proline' 0 N--CA 1.445 -1.341 0 C-N-CA 123.279 -1.55 . . . . 0.0 112.805 -1.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 49.3 t0 156.8 141.7 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 110.878 -2.874 . . . . 0.0 105.84 -176.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.0 p80 -125.43 41.95 3.4 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 122.997 1.38 . . . . 0.0 108.7 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 59.1 mttp -138.5 139.42 24.7 Favored Pre-proline 0 N--CA 1.434 -1.257 0 CA-C-N 112.915 -1.948 . . . . 0.0 107.441 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1005 ' ' PRO . . . . . 0.742 ' HA ' ' O ' ' A' ' 997' ' ' ILE . 81.5 Cg_exo -57.23 170.38 1.66 Allowed 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.234 1.956 . . . . 0.0 113.081 167.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -110.16 -46.33 3.46 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.85 -173.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 13.4 t -160.81 147.23 15.09 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -174.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1008 ' ' TRP . . . . . . . . . . . . . 42.8 m95 -112.83 124.33 52.36 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.703 ' HB ' ' HD2' ' A' ' 995' ' ' TYR . 46.3 t -143.88 161.62 15.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 -169.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -93.34 -1.2 56.21 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.835 0.35 . . . . 0.0 111.483 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1011 ' ' ALA . . . . . 0.468 ' H ' HG12 ' A' 1009 ' ' VAL . . . -101.08 116.5 32.99 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.158 0.504 . . . . 0.0 111.045 -175.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.4 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 42.9 tp10 -71.36 114.99 10.0 Favored 'General case' 0 N--CA 1.439 -1.025 0 CA-C-O 122.226 1.012 . . . . 0.0 111.033 177.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.462 ' H ' ' CE1' ' A' 1016 ' ' HIS . 66.4 mttm -120.59 147.92 44.57 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 113.985 -1.461 . . . . 0.0 108.51 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 54.8 ttp -51.13 -37.43 46.08 Favored 'General case' 0 C--N 1.307 -1.28 0 O-C-N 124.091 0.869 . . . . 0.0 112.799 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -55.11 -12.14 0.84 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.694 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 26.5 m80 -58.19 109.76 0.82 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.071 0.463 . . . . 0.0 111.833 175.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1017 ' ' THR . . . . . 0.555 HG22 ' HG3' ' A' ' 942' ' ' PRO . 0.0 OUTLIER -97.63 -31.34 12.34 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 123.268 1.508 . . . . 0.0 109.319 175.62 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 1018 ' ' HIS . . . . . 0.493 ' HB2' ' O ' ' A' ' 996' ' ' GLY . 30.4 m170 -136.41 155.93 49.33 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 113.774 -1.557 . . . . 0.0 108.162 -176.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.615 ' HD3' ' CG ' ' A' ' 993' ' ' TRP . 11.3 ttm180 -153.08 139.37 18.47 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 177.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.983 ' HG2' ' HB3' ' A' ' 937' ' ' ASN . 95.9 mtt180 -134.05 166.02 23.7 Favored 'General case' 0 CA--C 1.481 -1.69 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -177.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.565 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 24.5 ptt180 -155.74 153.47 29.94 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 124.23 0.956 . . . . 0.0 108.616 168.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.763 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 34.4 ttm180 -86.52 120.75 28.18 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 176.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.65 ' HA ' ' O ' ' A' ' 981' ' ' SER . 77.6 mt -86.71 129.45 34.87 Favored 'General case' 0 N--CA 1.423 -1.791 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 169.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.447 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 14.1 m -108.3 135.26 47.61 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 CA-C-O 121.419 0.628 . . . . 0.0 112.397 -172.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.449 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.3 tpt180 -142.98 97.63 3.13 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 170.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.557 ' HD3' ' HB2' ' A' ' 929' ' ' GLU . 0.0 OUTLIER -74.65 152.79 39.15 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 -179.607 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.574 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 8.1 ptm180 -142.18 166.58 24.31 Favored 'General case' 0 CA--C 1.496 -1.098 0 N-CA-C 106.255 -1.757 . . . . 0.0 106.255 -171.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.611 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 13.6 ptpt -155.19 152.74 29.74 Favored 'General case' 0 C--O 1.196 -1.727 0 CA-C-O 121.042 0.449 . . . . 0.0 110.842 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 36.9 ttmt -91.39 -21.28 21.07 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 -178.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 14.3 t70 46.97 27.53 0.74 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 111.175 -2.738 . . . . 0.0 110.411 -169.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 34.8 tp 70.82 -47.52 0.65 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.332 1.853 . . . . 0.0 114.005 177.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 11.3 t -90.55 14.82 12.13 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -170.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -119.06 113.78 21.47 Favored 'General case' 0 C--O 1.216 -0.692 0 O-C-N 121.237 -0.914 . . . . 0.0 110.833 175.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1034 ' ' THR . . . . . 0.464 ' OG1' ' HB2' ' A' 1037 ' ' SER . 37.2 p -137.53 -179.37 5.7 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 175.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1035 ' ' ALA . . . . . 0.583 ' HB1' ' HB2' ' A' ' 971' ' ' PRO . . . -92.61 -39.12 11.5 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 177.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 50.6 m -77.95 -38.69 44.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.198 -0.91 . . . . 0.0 112.812 -177.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1037 ' ' SER . . . . . 0.464 ' HB2' ' OG1' ' A' 1034 ' ' THR . 74.4 m -85.59 85.01 7.44 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 122.235 1.017 . . . . 0.0 111.674 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 15.5 p -83.55 -42.53 16.7 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 174.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -134.17 -36.53 0.9 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.409 -1.269 . . . . 0.0 110.19 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 . . . . . 0 C--O 1.241 0.648 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.504 179.812 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 34.3 pt . . . . . 0 N--CA 1.472 0.626 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -97.59 107.05 37.19 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -98.11 -178.96 0.31 Allowed 'Trans proline' 0 N--CA 1.448 -1.15 0 C-N-CA 122.818 2.345 . . . . 0.0 112.813 -178.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -99.16 -22.92 15.43 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 174.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 5.4 m -78.13 84.18 4.38 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.162 175.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -142.3 133.7 26.44 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . 0.489 ' HB2' ' H ' ' A' ' 927' ' ' HIS . 2.3 p-10 -138.26 150.48 46.72 Favored 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.086 -173.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -91.23 -32.25 15.84 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 170.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -178.74 46.46 0.09 OUTLIER Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 114.29 -1.323 . . . . 0.0 112.518 174.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.489 ' H ' ' HB2' ' A' ' 924' ' ' ASP 0.259 0.6 OUTLIER -117.35 140.43 49.58 Favored 'General case' 0 CA--C 1.492 -1.277 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 174.335 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.66 122.91 35.55 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 163.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.448 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.1 OUTLIER -139.19 137.86 36.4 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 170.758 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -136.19 140.62 43.71 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.639 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 28.0 m -72.2 129.65 38.95 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 118.673 0.67 . . . . 0.0 112.108 178.257 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -100.19 160.56 14.23 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 105.989 -1.856 . . . . 0.0 105.989 177.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -158.94 145.24 16.84 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.323 0.582 . . . . 0.0 110.961 -171.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.521 HG13 ' HG3' ' A' ' 964' ' ' PRO . 14.6 p -141.02 171.47 12.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 177.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -127.89 143.13 51.11 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -176.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.678 ' O ' ' HA ' ' A' 1020 ' ' ARG . 16.9 tt0 -117.65 118.21 31.49 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.397 179.265 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -95.89 126.17 40.96 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 124.365 1.041 . . . . 0.0 111.288 -178.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.51 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 47.8 mt-10 -121.27 154.38 36.42 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 169.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 33.8 m -144.84 158.19 43.89 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.566 -0.853 . . . . 0.0 110.727 -173.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.497 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 28.7 ptt180 -151.64 159.58 43.98 Favored 'General case' 0 N--CA 1.427 -1.598 0 O-C-N 124.57 1.169 . . . . 0.0 108.612 178.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -76.51 166.85 41.68 Favored Pre-proline 0 C--N 1.309 -1.185 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.73 74.36 1.28 Allowed 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 121.359 1.373 . . . . 0.0 111.212 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 139.86 8.14 0.94 Allowed Glycine 0 CA--C 1.528 0.86 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 -176.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . 0.47 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -101.43 -166.33 27.54 Favored Glycine 0 C--N 1.336 0.538 0 N-CA-C 111.071 -0.811 . . . . 0.0 111.071 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -125.61 159.9 31.0 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.578 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 45.5 m95 -73.53 129.76 38.65 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 122.127 0.965 . . . . 0.0 110.304 -175.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -146.39 138.45 13.55 Favored Pre-proline 0 C--N 1.287 -2.15 0 N-CA-C 103.627 -2.731 . . . . 0.0 103.627 172.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -49.87 124.6 12.78 Favored 'Trans proline' 0 C--O 1.239 0.548 0 C-N-CA 123.148 2.565 . . . . 0.0 114.733 -169.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -52.44 -177.49 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.231 169.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -102.61 -0.08 32.49 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 115.883 -2.327 . . . . 0.0 109.215 -163.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . 0.507 ' HB3' ' HG3' ' A' ' 960' ' ' LYS . 20.3 m-20 -132.63 82.92 2.03 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 103.018 -2.956 . . . . 0.0 103.018 169.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.0 m -69.31 -37.04 77.57 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.342 -167.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -109.12 131.01 55.48 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.531 0.681 . . . . 0.0 112.204 -176.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 42.5 p -145.54 178.81 7.85 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.842 -169.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -99.19 171.5 7.97 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 176.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.01 -31.88 31.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 118.335 0.516 . . . . 0.0 111.231 174.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -81.21 -15.23 56.28 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.065 0.46 . . . . 0.0 112.037 177.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 101.64 -4.32 53.76 Favored Glycine 0 CA--C 1.497 -1.064 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.458 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.87 102.5 0.08 Allowed 'General case' 0 CA--C 1.503 -0.829 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . 0.507 ' HG3' ' HB3' ' A' ' 951' ' ' ASP . 5.3 tmmm? -51.65 130.69 28.86 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 124.432 1.082 . . . . 0.0 109.571 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -130.54 175.73 8.75 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.014 -0.993 . . . . 0.0 109.484 -173.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -64.18 144.44 57.12 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 176.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.0 m -68.91 159.42 82.72 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -178.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.563 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 51.8 Cg_exo -52.65 -21.66 15.21 Favored 'Trans proline' 0 N--CA 1.48 0.733 0 C-N-CA 123.865 3.043 . . . . 0.0 114.705 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 5.2 p -70.94 -53.45 14.93 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -68.84 -24.8 64.4 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.297 176.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.518 HD11 ' HA ' ' A' ' 964' ' ' PRO . 37.3 mt -63.56 111.37 2.33 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.206 1.003 . . . . 0.0 108.68 175.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 2.7 p -130.08 169.52 15.2 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.85 -171.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 15.8 p -87.15 143.07 34.17 Favored Pre-proline 0 C--N 1.313 -0.985 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.981 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 973' ' ' TRP . 96.8 Cg_endo -75.09 175.61 11.01 Favored 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 122.703 2.269 . . . . 0.0 110.017 174.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.61 -45.4 41.31 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.928 1.752 . . . . 0.0 114.272 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . . . . . . . . . . . -76.56 -45.4 13.72 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.073 -1.06 . . . . 0.0 112.779 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.561 ' HB2' ' HG2' ' A' ' 970' ' ' PRO . 97.5 m95 -76.82 145.15 38.63 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 -179.356 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.515 ' HB3' ' O ' ' A' 1028 ' ' LYS . 4.6 tp10 -125.59 149.78 48.08 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 -179.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.59 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 94.6 m95 -86.07 156.33 20.45 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 120.495 -1.378 . . . . 0.0 111.594 172.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -120.42 -44.98 2.45 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . 0.562 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.0 OUTLIER -78.75 157.14 28.56 Favored 'General case' 0 CA--C 1.499 -1.018 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.914 -176.629 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -88.62 110.05 20.61 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.863 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . 0.507 ' C ' ' HD3' ' A' 1025 ' ' ARG . . . 57.51 176.77 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 O-C-N 125.223 1.577 . . . . 0.0 113.71 174.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.563 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 36.9 m95 -89.53 120.66 31.02 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 113.905 -1.498 . . . . 0.0 107.291 176.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 36.7 m -125.64 145.28 50.22 Favored 'General case' 0 C--N 1.295 -1.77 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 -176.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -73.21 135.03 44.52 Favored 'General case' 0 C--N 1.301 -1.536 0 CA-C-O 121.691 0.757 . . . . 0.0 110.044 -174.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -85.72 133.36 34.01 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 114.195 -1.366 . . . . 0.0 111.608 -170.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.555 ' HA ' HG21 ' A' ' 988' ' ' VAL . 1.8 pp -114.22 21.85 6.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.024 177.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -104.39 30.5 5.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.856 0.836 . . . . 0.0 108.798 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.518 ' HB2' HG12 ' A' ' 988' ' ' VAL . 78.1 mtp180 -136.84 -179.52 5.75 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 -178.282 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -81.34 84.17 6.71 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 171.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.555 HG21 ' HA ' ' A' ' 984' ' ' ILE . 11.9 m -115.5 -178.78 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 122.485 1.136 . . . . 0.0 113.928 -173.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . 0.514 ' HB3' ' H ' ' A' ' 993' ' ' TRP . 3.7 t70 -74.15 179.12 4.62 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 112.727 -2.033 . . . . 0.0 108.67 178.094 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.49 -31.56 69.47 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 118.768 0.713 . . . . 0.0 111.967 178.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -102.06 -44.65 5.4 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.169 -174.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 139.19 75.37 0.05 OUTLIER Glycine 0 CA--C 1.489 -1.534 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.899 176.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.556 ' HA ' ' HB3' ' A' 1021 ' ' ARG . 72.2 m95 -139.45 179.68 6.41 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.53 ' HG3' ' CE3' ' A' 1008 ' ' TRP . 6.9 pt-20 -143.15 153.54 42.97 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 122.285 1.04 . . . . 0.0 110.917 -177.308 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.763 ' O ' ' HA ' ' A' 1008 ' ' TRP . 9.6 t80 -81.99 104.44 12.35 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 112.777 -2.011 . . . . 0.0 112.272 -173.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . 0.451 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -128.78 116.8 2.32 Favored Glycine 0 C--O 1.216 -0.995 0 C-N-CA 118.478 -1.82 . . . . 0.0 112.667 172.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.804 HD11 ' HE1' ' A' 1015 ' ' TYR . 0.5 OUTLIER -109.18 149.61 12.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 O-C-N 120.349 -1.677 . . . . 0.0 109.461 -179.157 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 33.1 m -138.27 115.86 11.33 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 174.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.407 ' HA ' ' HD3' ' A' 1000 ' ' PRO . 2.6 mp -100.42 108.13 51.44 Favored Pre-proline 0 C--N 1.305 -1.326 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 177.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1000 ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 999' ' ' ILE . 16.2 Cg_exo -68.32 150.3 76.1 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.519 2.146 . . . . 0.0 113.057 -175.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -89.33 148.33 23.77 Favored 'Cis proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.474 -1.886 . . . . 0.0 112.474 -2.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 13.4 t70 -164.05 -89.16 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.419 -1.718 . . . . 0.0 109.032 177.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 159.32 -76.85 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.0 1.32 . . . . 0.0 109.925 -177.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 90.8 mttt -126.42 150.59 70.82 Favored Pre-proline 0 N--CA 1.447 -0.589 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.049 -172.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -63.85 147.07 92.33 Favored 'Trans proline' 0 C--O 1.239 0.571 0 C-N-CA 123.555 2.837 . . . . 0.0 110.425 170.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -93.89 -50.73 5.2 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 20.7 m -102.06 152.15 21.31 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 112.774 -2.012 . . . . 0.0 112.543 -172.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.763 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 67.3 m95 -135.22 137.09 42.28 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.214 -1.357 . . . . 0.0 107.929 -178.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.519 ' N ' ' HB3' ' A' ' 995' ' ' TYR . 20.9 t -136.63 -109.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.864 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 -175.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -167.44 -31.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 118.65 0.659 . . . . 0.0 110.939 -171.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -72.16 -169.44 0.5 Allowed 'General case' 0 C--O 1.237 0.433 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.452 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.2 tp10 -150.0 105.95 3.45 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.528 -172.336 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.402 ' O ' ' HB2' ' A' 1016 ' ' HIS . 87.4 mttt -115.0 139.15 50.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.761 -1.108 . . . . 0.0 109.456 176.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1014 ' ' MET . . . . . 0.418 ' HA ' ' NH2' ' A' ' 940' ' ' ARG . 24.4 ttt -45.92 -32.56 2.76 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1015 ' ' TYR . . . . . 0.804 ' HE1' HD11 ' A' ' 997' ' ' ILE . 40.5 p90 -74.79 5.27 5.16 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 118.794 -1.162 . . . . 0.0 111.366 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.578 ' HB3' ' CH2' ' A' ' 946' ' ' TRP . 0.6 OUTLIER -60.02 118.35 6.18 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.535 171.282 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 21.1 p -110.5 -13.04 14.31 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.081 174.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 27.0 m80 -140.5 147.52 39.69 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 122.653 1.216 . . . . 0.0 113.265 -174.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -151.47 144.87 24.8 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 176.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.678 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 98.0 mtt180 -138.27 168.79 19.0 Favored 'General case' 0 CA--C 1.466 -2.252 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -179.137 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.556 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 30.3 ptt180 -154.16 153.64 32.15 Favored 'General case' 0 C--N 1.284 -2.281 0 O-C-N 124.677 1.235 . . . . 0.0 108.007 168.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.446 ' HG2' HG12 ' A' 1024 ' ' VAL . 41.8 ttm180 -91.51 115.65 28.22 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 123.558 0.536 . . . . 0.0 109.837 179.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.515 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 81.3 mt -90.12 125.19 35.35 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 169.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.474 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 17.6 m -112.83 153.45 14.42 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.866 0 CA-C-O 121.776 0.798 . . . . 0.0 111.33 -174.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.523 ' HG3' ' HB2' ' A' ' 977' ' ' ASP . 31.3 ttp180 -158.83 110.28 2.14 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-N 112.798 -2.001 . . . . 0.0 109.691 168.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.639 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.7 tmmm? -76.0 149.52 37.58 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -178.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.59 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 7.4 ptm180 -136.17 139.41 42.83 Favored 'General case' 0 C--O 1.204 -1.336 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -169.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.515 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 30.2 ttmt -125.74 135.83 52.5 Favored 'General case' 0 C--N 1.283 -2.283 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.078 -173.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.573 ' C ' ' H ' ' A' 1031 ' ' LEU . 35.3 ttmt -88.34 -21.02 24.59 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 123.571 1.653 . . . . 0.0 107.781 -177.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 3.2 t70 53.65 -2.92 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 111.135 -2.757 . . . . 0.0 114.127 -170.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.573 ' H ' ' C ' ' A' 1029 ' ' LYS . 15.9 tp 61.68 16.31 7.66 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 125.905 1.682 . . . . 0.0 111.305 178.078 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 13.5 t -123.09 3.45 9.31 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -179.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -102.6 130.97 49.64 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 113.852 -1.522 . . . . 0.0 107.141 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 40.6 p 64.08 13.3 7.66 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.742 1.617 . . . . 0.0 111.463 -172.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -129.27 172.68 11.22 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 114.363 -1.289 . . . . 0.0 107.626 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 20.9 m 66.18 90.82 0.09 Allowed 'General case' 0 C--O 1.239 0.535 0 O-C-N 124.397 1.061 . . . . 0.0 109.818 -179.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 20.1 m -120.11 97.74 5.74 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.587 -176.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 27.4 m -102.51 126.94 49.73 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -68.52 102.42 1.45 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 173.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 80.3 mtt180 . . . . . 0 C--N 1.318 -0.803 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -177.328 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 44.1 pt . . . . . 0 N--CA 1.477 0.882 0 CA-C-O 120.843 0.354 . . . . 0.0 110.331 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -110.42 144.91 31.13 Favored Pre-proline 0 C--N 1.32 -0.699 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -71.7 -13.38 29.67 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.111 1.874 . . . . 0.0 111.901 176.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -81.72 -31.41 32.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.936 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 5.0 p -94.16 -41.48 9.48 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.053 0.454 . . . . 0.0 110.788 177.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . 61.14 45.51 8.99 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 114.442 -1.253 . . . . 0.0 108.811 -175.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -46.79 118.03 1.89 Allowed 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 113.996 -1.457 . . . . 0.0 112.526 -174.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -160.88 29.18 0.15 Allowed 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.154 -1.384 . . . . 0.0 107.961 -177.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 81.11 64.23 1.8 Allowed Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.671 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.507 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 20.1 m-70 -117.65 -152.2 0.5 Allowed 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 171.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -161.92 116.79 1.94 Allowed 'General case' 0 N--CA 1.413 -2.312 0 N-CA-C 102.267 -3.234 . . . . 0.0 102.267 172.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -142.29 138.65 31.48 Favored 'General case' 0 C--N 1.282 -2.337 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 175.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . 0.409 ' O ' ' HG2' ' A' 1027 ' ' ARG . 84.4 t80 -131.13 139.55 49.83 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.538 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 33.3 m -78.75 123.0 26.73 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -99.79 159.72 14.85 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 -173.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -154.51 156.25 36.33 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 119.589 -0.845 . . . . 0.0 111.492 -171.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . 0.51 ' O ' ' HA ' ' A' 1022 ' ' ARG . 14.2 p -150.37 177.4 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 N-CA-C 106.768 -1.568 . . . . 0.0 106.768 175.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' 1021 ' ' ARG . 78.7 m-85 -138.28 151.22 47.4 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.405 ' O ' ' HA ' ' A' 1020 ' ' ARG . 28.0 tt0 -120.34 124.83 46.51 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 -177.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -117.79 149.71 40.34 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.528 0.68 . . . . 0.0 111.849 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.608 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 38.9 mt-10 -144.0 159.33 42.78 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 125.306 1.442 . . . . 0.0 107.44 175.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 46.1 m -142.3 142.63 32.56 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.452 0.644 . . . . 0.0 111.777 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.47 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 17.8 ptt180 -141.78 161.07 38.86 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -176.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -67.68 152.67 96.09 Favored Pre-proline 0 C--N 1.311 -1.103 0 N-CA-C 105.291 -2.114 . . . . 0.0 105.291 170.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . 0.533 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 40.8 Cg_exo -60.59 90.37 0.09 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.636 1.558 . . . . 0.0 112.131 176.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 101.44 68.58 0.83 Allowed Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -157.98 -123.15 0.72 Allowed Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.176 -1.012 . . . . 0.0 111.106 -175.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -145.98 131.03 18.28 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.77 -0.715 . . . . 0.0 109.928 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.608 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 51.2 m95 -72.35 141.3 48.79 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.942 0.877 . . . . 0.0 109.448 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -125.02 149.66 64.07 Favored Pre-proline 0 C--N 1.289 -2.032 0 N-CA-C 101.955 -3.35 . . . . 0.0 101.955 175.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.517 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 31.8 Cg_exo -56.39 152.01 41.85 Favored 'Trans proline' 0 C--N 1.323 -0.787 0 C-N-CA 121.394 1.396 . . . . 0.0 111.697 -177.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -70.07 -171.55 0.45 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.121 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -105.98 -18.92 13.89 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -119.18 85.82 2.44 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 103.635 -2.728 . . . . 0.0 103.635 169.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 9.6 m -56.62 -54.0 51.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.032 -173.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 70.5 m-85 -105.73 134.22 49.2 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-O 121.666 0.746 . . . . 0.0 111.106 177.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 15.5 p -143.9 171.63 13.97 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.628 -171.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . 0.673 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 20.7 t0 -107.64 -176.23 3.01 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 106.187 -1.783 . . . . 0.0 106.187 178.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.05 -35.56 25.53 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -175.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -105.9 10.42 32.44 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 100.14 -1.9 56.41 Favored Glycine 0 CA--C 1.497 -1.091 0 C-N-CA 119.36 -1.4 . . . . 0.0 112.457 177.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . 0.673 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 23.9 t70 -51.48 101.95 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 O-C-N 124.791 0.936 . . . . 0.0 109.165 173.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -56.53 123.64 15.48 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.559 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -120.95 -179.88 4.16 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.817 -175.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -75.98 154.87 35.52 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 175.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 6.1 m -83.29 150.42 60.63 Favored Pre-proline 0 N--CA 1.431 -1.389 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.694 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 50.7 Cg_exo -42.71 -33.75 3.12 Favored 'Trans proline' 0 N--CA 1.48 0.686 0 C-N-CA 124.841 3.694 . . . . 0.0 117.324 -174.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 15.5 t -79.05 -43.62 23.85 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -66.8 -25.72 66.59 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.0 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.5 HD12 ' CH2' ' A' ' 980' ' ' TRP . 7.0 mt -66.3 110.43 3.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.398 0.618 . . . . 0.0 110.904 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.3 p -105.5 154.01 20.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.251 0.548 . . . . 0.0 112.211 -176.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 8.1 p -90.43 153.71 46.24 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.143 179.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.563 ' HG2' ' HB2' ' A' ' 973' ' ' TRP . 89.7 Cg_endo -77.58 168.89 21.89 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.05 1.833 . . . . 0.0 110.118 173.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -65.03 -9.75 22.84 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.111 1.874 . . . . 0.0 113.74 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.607 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -115.05 17.45 17.24 Favored Glycine 0 C--O 1.221 -0.665 0 C-N-CA 121.331 -0.462 . . . . 0.0 112.6 178.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.563 ' HB2' ' HG2' ' A' ' 970' ' ' PRO . 75.6 m95 -137.31 134.9 36.59 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-O 122.066 0.936 . . . . 0.0 110.133 175.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.65 ' HB3' ' O ' ' A' 1028 ' ' LYS . 8.7 tp10 -116.92 133.49 55.95 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-N 113.609 -1.632 . . . . 0.0 109.573 -169.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.654 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 65.9 m95 -82.39 100.26 9.9 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.422 -0.911 . . . . 0.0 109.911 174.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -74.44 -40.14 62.14 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.61 138.3 58.46 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 114.057 -1.428 . . . . 0.0 112.081 -177.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -52.39 -60.3 3.39 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 124.115 0.884 . . . . 0.0 111.953 176.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.5 154.72 8.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.99 -171.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.694 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 28.3 m95 -65.33 117.22 7.55 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -178.119 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 19.8 m -120.98 151.75 39.36 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 -173.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -73.52 133.17 43.54 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 119.055 0.843 . . . . 0.0 110.434 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . 0.435 ' HB2' HG12 ' A' 1024 ' ' VAL . 45.0 t0 -82.35 122.45 28.0 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.123 -172.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 31.2 pt -114.03 8.36 7.77 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.314 -177.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -93.38 33.27 1.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.809 0.814 . . . . 0.0 109.064 -175.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . 0.626 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 53.6 mtp180 -143.58 -176.25 4.89 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -176.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -84.79 78.65 9.84 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 172.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.414 HG21 ' O ' ' A' ' 983' ' ' ASP . 17.3 m -138.71 161.42 30.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.624 -175.154 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -55.58 169.34 0.32 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.293 1.037 . . . . 0.0 110.914 172.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -54.76 -33.6 61.49 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.479 0.657 . . . . 0.0 110.176 178.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . 0.496 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 86.4 mttt -98.38 9.07 43.94 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 115.092 -0.958 . . . . 0.0 112.106 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.68 -11.81 71.11 Favored Glycine 0 C--O 1.227 -0.314 0 N-CA-C 111.674 -0.57 . . . . 0.0 111.674 175.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . 0.662 ' HB3' ' CD ' ' A' 1019 ' ' ARG . 59.6 m95 -54.16 138.97 36.92 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.536 -0.832 . . . . 0.0 112.91 178.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' 1020 ' ' ARG . 31.2 mt-10 -113.48 155.56 25.12 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.437 0.637 . . . . 0.0 111.462 -177.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.628 ' O ' ' HA ' ' A' 1008 ' ' TRP . 15.1 t80 -77.46 100.53 6.05 Favored 'General case' 0 C--O 1.209 -1.074 0 C-N-CA 127.08 2.152 . . . . 0.0 111.329 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -126.59 97.84 0.5 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 119.056 -1.545 . . . . 0.0 113.218 173.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.594 HG22 ' HD2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -97.75 146.7 7.41 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 O-C-N 120.628 -1.513 . . . . 0.0 107.179 178.869 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 25.0 m -115.12 79.03 1.22 Allowed 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.719 0.771 . . . . 0.0 109.418 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.482 ' HA ' ' HD3' ' A' 1000 ' ' PRO . 2.0 pp -72.98 125.46 91.07 Favored Pre-proline 0 N--CA 1.447 -0.586 0 CA-C-N 114.592 -1.186 . . . . 0.0 111.846 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1000 ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 999' ' ' ILE . 2.7 Cg_exo -71.31 143.34 43.3 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.401 2.067 . . . . 0.0 114.183 -177.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1001 ' ' PRO . . . . . 0.444 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.9 Cg_endo -97.27 137.31 3.94 Favored 'Cis proline' 0 N--CA 1.444 -1.384 0 C-N-CA 122.973 -1.678 . . . . 0.0 112.873 -3.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 3.9 t70 -177.18 177.92 1.17 Allowed 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 112.312 -2.222 . . . . 0.0 106.507 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 10.7 m170 -119.61 -43.51 2.58 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 82.1 mttt -125.15 150.6 67.42 Favored Pre-proline 0 C--N 1.307 -1.249 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.128 -174.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1005 ' ' PRO . . . . . 0.509 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 77.0 Cg_exo -57.7 124.6 16.42 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.335 2.023 . . . . 0.0 110.305 171.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 41.5 pttt -112.14 11.18 20.32 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 121.918 0.866 . . . . 0.0 109.726 -177.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 46.8 t -148.85 140.98 23.94 Favored 'General case' 0 N--CA 1.431 -1.386 0 CA-C-N 114.611 -1.177 . . . . 0.0 107.933 -176.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.628 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 47.1 m95 -138.76 141.82 38.83 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.229 0.956 . . . . 0.0 108.836 -178.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.82 HG11 ' H ' ' A' 1010 ' ' ALA . 21.5 t -152.14 -165.08 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 102.933 -2.988 . . . . 0.0 102.933 -176.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1010 ' ' ALA . . . . . 0.82 ' H ' HG11 ' A' 1009 ' ' VAL . . . -101.67 -32.92 10.09 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 120.112 1.324 . . . . 0.0 112.554 -179.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -68.64 122.81 19.29 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -167.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.52 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 3.0 tp10 -70.98 117.91 13.08 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 171.127 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.416 ' HD3' ' HE2' ' A' ' 995' ' ' TYR . 56.5 mtpt -115.34 151.95 33.69 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 173.093 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 25.6 ttt -49.48 -44.6 46.04 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 124.442 1.089 . . . . 0.0 111.677 174.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1015 ' ' TYR . . . . . 0.533 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 88.4 m-85 -65.32 7.44 0.21 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.594 ' HD2' HG22 ' A' ' 997' ' ' ILE . 6.2 m170 -66.79 114.16 5.45 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 121.86 0.838 . . . . 0.0 112.366 176.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.31 -35.19 11.32 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-N 112.852 -1.976 . . . . 0.0 108.156 177.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 25.6 m170 -136.31 154.29 50.91 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.104 -174.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1019 ' ' ARG . . . . . 0.662 ' CD ' ' HB3' ' A' ' 993' ' ' TRP . 9.1 ttm180 -160.44 147.16 15.64 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.405 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 2.2 ptm180 -151.06 154.73 37.56 Favored 'General case' 0 C--O 1.196 -1.743 0 C-N-CA 119.516 -0.874 . . . . 0.0 110.676 -177.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.566 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 23.2 ptt180 -135.25 149.29 49.82 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.563 -0.855 . . . . 0.0 111.428 -176.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.626 ' NH1' ' HD2' ' A' ' 986' ' ' ARG . 34.7 ttm180 -87.95 129.55 35.21 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 123.2 0.313 . . . . 0.0 110.512 178.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.461 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 61.6 mt -103.96 129.25 51.5 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 167.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.565 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 6.2 m -107.11 141.57 22.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.877 -174.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.536 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 9.9 tpt180 -137.46 106.11 5.87 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.164 170.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.0 tmmm? -72.5 135.85 45.77 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.654 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.2 ptm180 -131.56 134.43 46.07 Favored 'General case' 0 C--O 1.204 -1.333 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -172.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.65 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.1 ttmt -125.03 137.88 54.22 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 -173.058 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.607 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.9 ttmt -91.13 -17.74 25.65 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 124.053 1.882 . . . . 0.0 106.978 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1030 ' ' ASP . . . . . 0.435 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 15.6 t70 60.99 -0.41 0.32 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 111.347 -2.66 . . . . 0.0 111.624 -171.381 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.565 ' H ' ' C ' ' A' 1029 ' ' LYS . 29.6 tp 72.58 -2.68 2.57 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 127.02 2.128 . . . . 0.0 112.56 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 10.3 t -119.62 -1.8 10.56 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -177.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.455 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 26.5 tt0 -95.21 131.0 41.73 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.438 -178.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 9.2 m -153.18 -26.16 0.15 Allowed 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -141.21 76.82 1.57 Allowed 'General case' 0 N--CA 1.436 -1.142 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.768 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 20.0 m -73.17 -26.17 61.08 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 167.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 3.4 m -126.49 103.46 7.62 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 105.504 -2.035 . . . . 0.0 105.504 174.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 28.6 m -76.68 -49.86 15.08 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.042 0.449 . . . . 0.0 110.092 -175.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -160.23 -177.65 6.41 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 . . . . . 0 C--N 1.312 -1.031 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.236 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 14.3 pt . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 120.557 0.218 . . . . 0.0 110.72 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -110.25 97.95 33.3 Favored Pre-proline 0 CA--C 1.515 -0.385 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 175.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -73.69 108.14 2.57 Favored 'Trans proline' 0 N--CA 1.448 -1.15 0 C-N-CA 122.312 2.008 . . . . 0.0 110.797 177.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -67.24 -38.54 85.38 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 174.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 94.9 m -121.69 94.68 4.39 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.267 174.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -88.82 161.44 16.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.176 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 924' ' ' ASP . . . . . 0.545 ' HA ' ' CD2' ' A' ' 927' ' ' HIS . 19.3 t70 -135.47 139.23 43.9 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.426 0.631 . . . . 0.0 111.824 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -138.8 13.68 2.7 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.299 175.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 123.87 53.97 0.19 Allowed Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.877 -177.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 927' ' ' HIS . . . . . 0.545 ' CD2' ' HA ' ' A' ' 924' ' ' ASP . 3.1 m-70 -127.3 157.46 39.81 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 177.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.48 131.25 55.0 Favored 'General case' 0 N--CA 1.413 -2.291 0 N-CA-C 105.85 -1.908 . . . . 0.0 105.85 160.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 929' ' ' GLU . . . . . 0.735 ' HG3' ' HZ3' ' A' 1026 ' ' LYS . 0.9 OUTLIER -143.81 147.56 34.3 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.348 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -140.89 143.89 34.94 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 176.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 931' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 24.8 m -75.32 130.53 39.2 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 120.769 0.319 . . . . 0.0 111.068 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -106.08 158.08 17.07 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 933' ' ' GLU . . . . . 0.894 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 10.6 pt-20 -149.46 156.54 42.16 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 118.54 0.609 . . . . 0.0 110.385 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 7.2 p -153.2 130.4 2.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-O 121.255 0.55 . . . . 0.0 109.944 170.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 935' ' ' TYR . . . . . 0.617 ' HA ' ' O ' ' A' 1021 ' ' ARG . 62.0 m-85 -80.34 147.09 31.24 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -176.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 936' ' ' GLN . . . . . 0.665 ' O ' ' HA ' ' A' 1020 ' ' ARG . 32.9 tt0 -116.27 111.66 20.47 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -110.56 142.19 42.72 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.811 0.815 . . . . 0.0 112.328 -172.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.585 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 49.3 mt-10 -141.78 162.11 36.28 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 113.806 -1.543 . . . . 0.0 107.196 173.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 939' ' ' SER . . . . . 0.668 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 25.4 p -150.23 157.72 43.39 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 121.7 0.762 . . . . 0.0 111.995 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 940' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 30.9 ptt180 -149.95 158.56 44.29 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 113.459 -1.7 . . . . 0.0 108.029 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -76.56 166.51 44.33 Favored Pre-proline 0 C--N 1.308 -1.212 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 168.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -65.75 90.74 0.24 Allowed 'Trans proline' 0 N--CA 1.449 -1.104 0 N-CA-C 108.576 -1.356 . . . . 0.0 108.576 168.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.39 -8.45 5.93 Favored Glycine 0 N--CA 1.435 -1.424 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -172.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 944' ' ' GLY . . . . . 0.533 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -103.44 -177.8 26.14 Favored Glycine 0 C--N 1.341 0.809 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 -178.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -118.89 163.21 17.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 120.795 2.297 . . . . 0.0 106.969 172.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 946' ' ' TRP . . . . . 0.585 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 42.3 m95 -64.45 135.65 56.29 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.955 0.883 . . . . 0.0 112.656 -172.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -138.84 171.82 7.56 Favored Pre-proline 0 C--N 1.309 -1.173 0 N-CA-C 103.394 -2.817 . . . . 0.0 103.394 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -52.21 124.07 14.06 Favored 'Trans proline' 0 C--O 1.234 0.322 0 CA-C-N 121.806 1.681 . . . . 0.0 110.76 176.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 949' ' ' ALA . . . . . 0.668 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -51.88 -68.43 0.17 Allowed 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -174.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.455 ' CG ' ' H ' ' A' ' 951' ' ' ASP . 7.2 pt-20 -168.18 -50.59 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 104.793 -2.299 . . . . 0.0 104.793 -172.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 951' ' ' ASP . . . . . 0.455 ' H ' ' CG ' ' A' ' 950' ' ' GLU . 23.2 m-20 -132.48 125.94 31.82 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 104.216 -2.513 . . . . 0.0 104.216 171.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 20.0 m -65.7 -58.64 5.23 Favored 'General case' 0 C--N 1.313 -1.002 0 O-C-N 123.329 0.393 . . . . 0.0 111.698 -174.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 953' ' ' TYR . . . . . 0.489 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 76.4 m-85 -102.25 132.21 48.33 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.381 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 69.9 p -142.23 177.78 8.01 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.817 0.817 . . . . 0.0 110.829 -172.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -100.68 171.47 7.68 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 105.291 -2.115 . . . . 0.0 105.291 174.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.12 -36.18 39.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.468 0.576 . . . . 0.0 111.5 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -75.81 -39.98 55.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.219 0.533 . . . . 0.0 110.66 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 133.51 -6.79 4.94 Favored Glycine 0 CA--C 1.493 -1.287 0 C-N-CA 120.499 -0.857 . . . . 0.0 112.053 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -58.37 105.28 0.27 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 176.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 960' ' ' LYS . . . . . 0.567 ' HZ3' ' HB3' ' A' ' 960' ' ' LYS . 7.0 ttpm? -50.84 128.24 20.5 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.718 0.771 . . . . 0.0 111.525 176.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -115.39 -172.4 2.14 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.361 -1.29 . . . . 0.0 108.089 -177.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -82.0 159.05 23.61 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.62 152.24 72.35 Favored Pre-proline 0 N--CA 1.433 -1.286 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 177.262 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 964' ' ' PRO . . . . . 0.548 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 6.1 Cg_exo -45.5 -35.41 12.24 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 124.441 3.427 . . . . 0.0 114.917 -178.353 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 19.5 m -75.26 -46.87 30.9 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -69.0 -5.09 19.6 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.905 0.882 . . . . 0.0 112.414 174.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 967' ' ' LEU . . . . . 0.452 HD12 ' CH2' ' A' ' 980' ' ' TRP . 13.9 mt -90.85 114.7 27.18 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.947 0.403 . . . . 0.0 110.271 -178.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 34.5 p -117.26 172.95 6.96 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.21 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 969' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 6.2 p -95.6 141.43 23.18 Favored Pre-proline 0 C--N 1.319 -0.719 0 CA-C-O 120.938 0.399 . . . . 0.0 111.375 -178.38 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 970' ' ' PRO . . . . . 0.549 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 42.0 Cg_endo -84.55 170.34 10.4 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.368 2.712 . . . . 0.0 112.716 -178.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -64.36 102.7 0.4 Allowed 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 122.05 1.833 . . . . 0.0 110.415 174.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 972' ' ' GLY . . . . . 0.642 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 126.13 -7.12 7.67 Favored Glycine 0 N--CA 1.433 -1.507 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 973' ' ' TRP . . . . . 0.549 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.2 m95 -135.62 138.19 42.66 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 122.246 1.022 . . . . 0.0 111.395 -177.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 974' ' ' GLU . . . . . 0.501 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 9.4 tp10 -129.53 145.6 51.44 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 126.55 1.94 . . . . 0.0 108.932 -171.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 975' ' ' TRP . . . . . 0.67 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 89.2 m95 -84.73 153.85 22.79 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.826 0.822 . . . . 0.0 112.03 174.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 976' ' ' GLU . . . . . 0.717 ' HB2' ' HD2' ' A' 1028 ' ' LYS . 40.3 tt0 -129.01 -37.27 1.71 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.215 177.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -74.54 151.99 39.4 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.022 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.24 -30.2 18.68 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -165.4 141.34 5.32 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.524 0.602 . . . . 0.0 111.749 -173.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 980' ' ' TRP . . . . . 0.554 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 36.2 m95 -63.21 123.88 19.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.055 -0.975 . . . . 0.0 108.537 -178.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 981' ' ' SER . . . . . 0.727 ' O ' ' HA ' ' A' 1023 ' ' LEU . 15.0 m -116.29 -165.51 1.06 Allowed 'General case' 0 C--O 1.203 -1.36 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 -175.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -119.69 148.22 43.65 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 120.604 1.547 . . . . 0.0 110.624 177.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -96.19 116.14 28.53 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.078 0.466 . . . . 0.0 109.83 -174.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.576 ' HA ' HG21 ' A' ' 988' ' ' VAL . 26.9 pt -106.26 15.83 6.98 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.452 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -96.7 38.41 1.22 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.259 1.028 . . . . 0.0 108.8 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 40.4 mtt180 -140.82 -176.74 4.78 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 -175.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.01 85.73 6.68 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 171.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 988' ' ' VAL . . . . . 0.576 HG21 ' HA ' ' A' ' 984' ' ' ILE . 23.0 m -135.83 150.79 28.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.967 -176.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 989' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' 1011 ' ' ALA . 21.2 t70 -52.81 169.09 0.1 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.823 171.203 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -55.32 -34.08 63.89 Favored 'General case' 0 CA--C 1.507 -0.701 0 C-N-CA 123.369 0.668 . . . . 0.0 111.869 178.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -95.97 11.73 32.92 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.51 -177.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 69.62 77.72 0.41 Allowed Glycine 0 N--CA 1.432 -1.581 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.687 -179.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -147.0 129.11 15.58 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 994' ' ' GLU . . . . . 0.509 ' HB2' ' HB3' ' A' 1008 ' ' TRP . 3.7 pt-20 -103.24 154.02 19.78 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 177.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 995' ' ' TYR . . . . . 0.857 ' HB3' ' HA ' ' A' 1011 ' ' ALA . 0.5 OUTLIER -110.02 127.8 55.03 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.502 -172.47 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 996' ' ' GLY . . . . . 0.457 ' HA2' ' O ' ' A' 1007 ' ' SER . . . -127.29 141.21 12.45 Favored Glycine 0 N--CA 1.422 -2.297 0 CA-C-N 113.95 -1.477 . . . . 0.0 109.731 176.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 997' ' ' ILE . . . . . 0.611 HG21 ' HA ' ' A' 1016 ' ' HIS . 1.0 OUTLIER -121.41 138.7 50.91 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 C-N-CA 122.387 0.275 . . . . 0.0 110.507 -179.808 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.1 t -145.01 150.26 36.57 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.4 mp -108.11 100.64 37.66 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 176.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1000 ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 48.9 Cg_endo -70.5 134.27 26.05 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.343 2.028 . . . . 0.0 113.42 -175.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1001 ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.7 Cg_endo -94.81 150.04 10.41 Favored 'Cis proline' 0 N--CA 1.445 -1.339 0 C-N-CA 122.919 -1.701 . . . . 0.0 113.572 -1.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 27.9 t70 -149.43 -86.49 0.08 Allowed 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 112.964 -1.925 . . . . 0.0 107.164 176.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1003 ' ' HIS . . . . . 0.417 ' HB2' ' H ' ' A' 1004 ' ' LYS . 31.9 m-70 -158.87 -82.81 0.05 OUTLIER 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 170.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1004 ' ' LYS . . . . . 0.417 ' H ' ' HB2' ' A' 1003 ' ' HIS . 63.6 mttp -150.92 160.76 31.64 Favored Pre-proline 0 N--CA 1.439 -1.015 0 CA-C-N 113.937 -1.483 . . . . 0.0 109.073 177.426 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -56.28 143.61 85.02 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.801 2.334 . . . . 0.0 111.052 168.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -124.75 12.21 8.51 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 122.321 1.058 . . . . 0.0 108.174 -175.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1007 ' ' SER . . . . . 0.457 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 33.2 t -135.96 126.28 26.58 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 114.173 -1.376 . . . . 0.0 107.755 -173.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1008 ' ' TRP . . . . . 0.61 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 55.2 m95 -136.74 132.54 34.97 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 124.211 0.944 . . . . 0.0 108.489 -178.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.654 HG11 ' H ' ' A' 1010 ' ' ALA . 3.8 t -151.18 -178.08 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 -171.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1010 ' ' ALA . . . . . 0.654 ' H ' HG11 ' A' 1009 ' ' VAL . . . -65.53 109.71 2.45 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 119.016 0.825 . . . . 0.0 109.64 175.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1011 ' ' ALA . . . . . 0.857 ' HA ' ' HB3' ' A' ' 995' ' ' TYR . . . -52.73 108.53 0.32 Allowed 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 124.069 0.948 . . . . 0.0 112.234 -178.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1012 ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' A' 1013 ' ' LYS . 13.1 pt-20 -128.6 -48.29 1.27 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 178.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1013 ' ' LYS . . . . . 0.443 ' N ' ' HG3' ' A' 1012 ' ' GLU . 15.4 ptmt -78.06 147.56 34.68 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -168.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 24.7 ttt -62.49 -40.72 97.6 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 175.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -68.62 2.92 2.11 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -175.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1016 ' ' HIS . . . . . 0.655 ' CG ' ' HB2' ' A' ' 995' ' ' TYR 0.315 14.2 p-80 -82.84 128.13 34.12 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 116.0 -2.28 . . . . 0.0 111.202 174.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 73.7 p -101.42 -11.51 19.31 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.245 -166.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -139.95 143.69 36.68 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -176.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -142.5 152.58 42.82 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 175.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1020 ' ' ARG . . . . . 0.665 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 2.2 ptp180 -155.32 167.51 30.13 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 175.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1021 ' ' ARG . . . . . 0.617 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 27.7 ptt180 -150.15 153.56 36.55 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.061 175.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1022 ' ' ARG . . . . . 0.894 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 26.7 ttm180 -86.65 115.19 23.95 Favored 'General case' 0 N--CA 1.427 -1.596 0 O-C-N 123.864 0.727 . . . . 0.0 109.479 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1023 ' ' LEU . . . . . 0.727 ' HA ' ' O ' ' A' ' 981' ' ' SER . 76.1 mt -85.94 127.32 34.59 Favored 'General case' 0 N--CA 1.421 -1.88 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 169.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1024 ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 10.2 m -104.08 133.36 48.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.491 -173.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1025 ' ' ARG . . . . . 0.536 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.9 tpt180 -141.04 102.52 4.27 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.247 171.296 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1026 ' ' LYS . . . . . 0.735 ' HZ3' ' HG3' ' A' ' 929' ' ' GLU . 0.5 OUTLIER -76.23 145.54 39.67 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 -179.043 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 1027 ' ' ARG . . . . . 0.67 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 5.9 ptm180 -136.39 157.84 45.85 Favored 'General case' 0 C--O 1.208 -1.092 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 -171.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1028 ' ' LYS . . . . . 0.717 ' HD2' ' HB2' ' A' ' 976' ' ' GLU . 21.2 ptmt -141.91 151.34 42.55 Favored 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -174.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1029 ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.6 ttmt -89.49 -20.33 23.98 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-O 123.304 1.526 . . . . 0.0 106.955 177.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1030 ' ' ASP . . . . . 0.429 ' HB2' ' HE2' ' A' 1028 ' ' LYS . 33.9 t70 54.93 -0.49 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 111.402 -2.635 . . . . 0.0 113.101 -172.29 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1031 ' ' LEU . . . . . 0.563 ' H ' ' C ' ' A' 1029 ' ' LYS . 12.2 tp 66.35 6.11 4.11 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 126.489 1.916 . . . . 0.0 110.582 -178.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 18.1 p -105.83 -8.19 17.87 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-O 121.947 0.879 . . . . 0.0 109.42 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1033 ' ' GLN . . . . . 0.501 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 0.8 OUTLIER -105.87 0.95 26.38 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.265 -179.512 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 1034 ' ' THR . . . . . 0.546 ' HB ' ' HD3' ' A' 1029 ' ' LYS . 33.2 m -151.57 89.08 1.46 Allowed 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 177.153 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -101.57 -176.34 3.11 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.081 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 48.2 t -74.34 108.01 6.85 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 13.5 t -76.23 123.17 25.46 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 175.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 17.0 p -73.61 148.69 42.65 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -173.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -80.69 -36.62 32.04 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 175.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 . . . . . 0 C--O 1.248 0.991 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 177.636 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . 0.263 95.6 m-70 . . . . . 0 CA--C 1.479 -1.755 0 N-CA-C 104.918 -2.253 . . . . 0.0 104.918 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 928' ' ' THR . . . . . 0.526 HG22 ' HH2' ' A' ' 973' ' ' TRP . 1.5 m 62.76 89.41 0.09 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 125.301 1.625 . . . . 0.0 108.196 -171.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.564 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.5 OUTLIER -128.69 128.87 44.94 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 106.816 -1.549 . . . . 0.0 106.816 174.754 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.483 ' O ' ' HG2' ' A' 1027 ' ' ARG . 87.2 t80 -121.78 136.3 54.93 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 121.495 -0.753 . . . . 0.0 109.058 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.594 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 23.4 m -69.57 120.21 15.01 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 176.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -94.98 146.81 23.99 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.768 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.3 pt-20 -152.86 158.08 41.65 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 118.436 0.562 . . . . 0.0 111.229 -169.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 3.7 p -160.53 129.37 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.408 0.623 . . . . 0.0 111.137 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.639 ' HA ' ' O ' ' A' 1021 ' ' ARG . 50.5 m-85 -88.94 112.66 23.59 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.786 -176.599 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 936' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -85.81 142.8 28.67 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 937' ' ' ASN . . . . . 1.067 ' HB3' ' HB3' ' A' 1020 ' ' ARG . 0.0 OUTLIER -144.44 162.22 37.07 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -178.329 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.603 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 44.8 mt-10 -131.18 162.2 30.48 Favored 'General case' 0 C--O 1.246 0.91 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 16.6 t -135.16 146.25 48.57 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.203 176.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.59 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 18.1 ptt180 -152.58 162.42 41.25 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -176.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -67.49 152.58 96.08 Favored Pre-proline 0 C--N 1.31 -1.141 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 171.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -56.89 94.42 0.06 OUTLIER 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 122.1 1.866 . . . . 0.0 112.98 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 94.07 65.44 1.03 Allowed Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 108.071 -2.012 . . . . 0.0 108.071 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -159.33 -156.4 8.06 Favored Glycine 0 N--CA 1.435 -1.418 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.349 -173.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -105.27 125.17 50.69 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.321 -0.94 . . . . 0.0 110.04 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.603 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 56.5 m95 -80.14 147.89 31.18 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-O 121.619 0.724 . . . . 0.0 109.9 -177.001 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -128.66 171.33 8.81 Favored Pre-proline 0 C--N 1.298 -1.667 0 N-CA-C 103.475 -2.787 . . . . 0.0 103.475 174.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -59.17 135.97 69.56 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 CA-C-N 121.245 1.48 . . . . 0.0 109.801 175.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -58.9 174.06 0.38 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.976 0.893 . . . . 0.0 112.338 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -69.63 -38.47 77.2 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.189 -1.368 . . . . 0.0 107.494 -178.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -122.4 104.23 9.26 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 104.64 -2.356 . . . . 0.0 104.64 170.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 17.5 m -68.02 -52.84 30.9 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -172.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -97.58 125.2 42.17 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.175 173.435 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 13.0 p -140.9 173.28 11.64 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.681 -171.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -94.68 167.07 11.69 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 171.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.0 -28.84 18.4 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.765 0.711 . . . . 0.0 112.2 177.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -82.05 -39.76 23.01 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.22 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 139.86 -10.75 3.12 Favored Glycine 0 CA--C 1.498 -0.991 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.888 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -60.51 109.23 0.96 Allowed 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 121.193 0.52 . . . . 0.0 110.494 177.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 960' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' A' ' 961' ' ' ALA . 9.5 tmtt? -47.52 126.57 10.04 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.581 -1.645 . . . . 0.0 110.698 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.434 ' N ' ' HD3' ' A' ' 960' ' ' LYS . . . -122.74 173.57 7.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.731 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -69.08 160.87 30.21 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.874 0.369 . . . . 0.0 110.337 178.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.95 153.95 41.88 Favored Pre-proline 0 N--CA 1.435 -1.199 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -177.326 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.549 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.4 Cg_exo -47.18 -33.16 15.18 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 124.51 3.473 . . . . 0.0 115.866 -178.06 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.2 p -71.22 -45.0 64.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.879 0.847 . . . . 0.0 110.182 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -64.47 -27.43 68.98 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.42 -1.263 . . . . 0.0 110.285 175.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 81.2 mt -74.36 110.66 8.82 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 122.072 0.939 . . . . 0.0 110.11 176.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.3 p -129.01 165.11 21.79 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.99 -172.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 12.0 p -81.09 128.2 71.69 Favored Pre-proline 0 N--CA 1.441 -0.916 0 CA-C-O 121.239 0.542 . . . . 0.0 110.638 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.654 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 58.8 Cg_endo -82.27 165.73 16.57 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.562 2.174 . . . . 0.0 109.722 175.284 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -59.23 112.19 1.15 Allowed 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 121.551 1.501 . . . . 0.0 110.112 173.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.414 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . 114.04 -4.18 23.97 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.83 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.654 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 92.9 m95 -126.18 132.9 51.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 122.225 1.012 . . . . 0.0 111.793 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.669 ' HB2' HE22 ' A' 1033 ' ' GLN . 8.1 tp10 -112.22 129.45 56.26 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 112.797 -2.001 . . . . 0.0 108.162 -175.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.52 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 94.1 m95 -70.85 138.81 50.58 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.644 -1.222 . . . . 0.0 111.129 172.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 976' ' ' GLU . . . . . 0.606 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 9.8 tp10 -100.88 -47.59 4.74 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.003 -0.999 . . . . 0.0 108.543 -177.233 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 977' ' ' ASP . . . . . 0.588 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.8 m-20 -85.88 161.09 19.23 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.155 -177.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -93.17 108.97 20.47 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.377 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 979' ' ' ALA . . . . . 0.509 ' C ' ' HD3' ' A' 1025 ' ' ARG . . . 55.49 178.05 0.03 OUTLIER 'General case' 0 C--O 1.234 0.254 0 CA-C-O 122.72 1.248 . . . . 0.0 113.491 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.626 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 51.9 m95 -88.09 118.45 27.67 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 113.606 -1.634 . . . . 0.0 108.066 177.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 981' ' ' SER . . . . . 0.687 ' O ' ' HA ' ' A' 1023 ' ' LEU . 34.7 m -110.2 -165.05 0.97 Allowed 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 -177.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -112.89 145.41 40.75 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 121.242 1.837 . . . . 0.0 109.432 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.481 ' HB2' HG13 ' A' 1024 ' ' VAL . 55.3 t0 -86.56 120.15 27.57 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -175.035 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.3 pp -116.24 15.45 7.72 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.349 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -99.12 30.04 3.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 123.036 1.398 . . . . 0.0 108.257 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.507 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 70.3 mtp85 -138.68 174.05 10.94 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.584 -177.088 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -80.74 79.62 7.35 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 171.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.619 HG12 ' HG2' ' A' ' 994' ' ' GLU . 25.7 m -135.84 161.09 38.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.97 -175.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.34 168.65 0.34 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.633 0.583 . . . . 0.0 110.553 171.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -54.73 -34.66 62.77 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-O 120.903 0.383 . . . . 0.0 111.314 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -101.03 7.36 43.47 Favored 'General case' 0 N--CA 1.427 -1.618 0 C-N-CA 119.004 -1.079 . . . . 0.0 111.469 -178.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 100.87 -20.8 46.36 Favored Glycine 0 C--O 1.224 -0.494 0 CA-C-N 116.122 -0.49 . . . . 0.0 113.803 173.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 83.1 m95 -54.19 121.7 8.72 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.619 ' HG2' HG12 ' A' ' 988' ' ' VAL . 22.6 mt-10 -99.37 153.63 18.83 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.039 177.193 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.733 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 27.6 t80 -79.01 94.27 5.26 Favored 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 126.783 2.033 . . . . 0.0 111.918 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -110.17 96.53 0.94 Allowed Glycine 0 N--CA 1.435 -1.423 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 177.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.591 HD12 ' HB3' ' A' 1015 ' ' TYR . 1.1 tt -98.42 130.1 47.73 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.194 0 O-C-N 122.139 -0.624 . . . . 0.0 110.197 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 7.1 m -108.12 85.45 2.12 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.989 -178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 16.2 pt -78.68 121.28 83.37 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.21 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 38.8 Cg_endo -69.94 135.67 30.62 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.05 1.833 . . . . 0.0 111.373 178.132 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1001 ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.0 Cg_endo -92.63 144.84 11.2 Favored 'Cis proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.23 -1.571 . . . . 0.0 114.331 -0.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 22.7 t0 163.33 155.64 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 112.176 -2.284 . . . . 0.0 105.994 177.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -99.55 -34.92 10.05 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.022 0.439 . . . . 0.0 110.339 -175.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1004 ' ' LYS . . . . . 0.548 ' H ' ' HD2' ' A' 1004 ' ' LYS . 0.0 OUTLIER -123.55 154.0 66.26 Favored Pre-proline 0 C--N 1.317 -0.829 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.172 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -58.49 127.75 25.83 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.25 2.634 . . . . 0.0 110.291 163.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 20.5 pttm -117.88 13.32 14.02 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.196 0.998 . . . . 0.0 109.608 178.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 29.9 t -143.54 136.1 27.24 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 113.908 -1.496 . . . . 0.0 107.766 -178.1 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.599 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 62.9 m95 -134.09 140.15 46.42 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 124.478 1.111 . . . . 0.0 108.966 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.522 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 92.8 t -140.51 157.77 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -177.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -83.03 8.76 11.88 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -121.23 134.78 55.2 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 121.278 -0.888 . . . . 0.0 111.603 -175.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.665 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.7 tp10 -69.56 105.1 2.54 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.526 ' H ' ' CE1' ' A' 1016 ' ' HIS . 95.0 mttt -109.26 147.15 33.08 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.743 -1.571 . . . . 0.0 108.47 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 26.5 ptt? -56.27 -36.09 68.19 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -178.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1015 ' ' TYR . . . . . 0.591 ' HB3' HD12 ' A' ' 997' ' ' ILE . 58.9 m-85 -60.93 -4.27 0.97 Allowed 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.733 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 2.6 m80 -54.67 108.03 0.35 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.63 -25.44 16.77 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 123.585 1.659 . . . . 0.0 106.912 173.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -141.71 150.73 42.22 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 111.865 -2.425 . . . . 0.0 109.466 -177.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1019 ' ' ARG . . . . . 0.515 ' HB3' ' CD2' ' A' 1016 ' ' HIS . 35.2 ptt180 -151.87 141.77 22.03 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 171.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1020 ' ' ARG . . . . . 1.067 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . 4.9 ptp180 -149.63 161.88 41.31 Favored 'General case' 0 CA--C 1.481 -1.687 0 C-N-CA 118.532 -1.267 . . . . 0.0 109.977 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.639 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.9 ptt180 -148.0 149.39 32.05 Favored 'General case' 0 C--N 1.298 -1.673 0 C-N-CA 119.431 -0.907 . . . . 0.0 110.969 -177.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.768 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 37.2 ttm180 -83.83 115.09 22.08 Favored 'General case' 0 N--CA 1.423 -1.806 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.455 -177.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.687 ' HA ' ' O ' ' A' ' 981' ' ' SER . 72.4 mt -80.44 129.66 34.66 Favored 'General case' 0 N--CA 1.425 -1.718 0 N-CA-C 105.179 -2.156 . . . . 0.0 105.179 166.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.481 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.6 m -111.83 133.63 56.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 CA-C-O 121.733 0.778 . . . . 0.0 112.721 -174.017 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.557 ' HG3' ' HB2' ' A' ' 977' ' ' ASP . 14.6 ttp180 -150.26 101.66 3.01 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 112.926 -1.943 . . . . 0.0 109.373 166.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.606 ' HE2' ' HG2' ' A' ' 976' ' ' GLU . 0.0 OUTLIER -79.43 154.21 29.11 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 -178.29 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.52 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 7.5 ptm180 -136.4 165.75 25.07 Favored 'General case' 0 CA--C 1.488 -1.432 0 N-CA-C 105.076 -2.194 . . . . 0.0 105.076 -170.024 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 30.4 ttmt -149.9 142.6 24.6 Favored 'General case' 0 C--N 1.281 -2.403 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 -172.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1029 ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -91.37 -13.2 32.89 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 123.568 1.651 . . . . 0.0 107.581 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1030 ' ' ASP . . . . . 0.401 ' H ' ' HG2' ' A' 1028 ' ' LYS . 25.0 t0 52.69 23.35 2.64 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 111.454 -2.612 . . . . 0.0 110.225 -173.249 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 25.4 tp 66.38 -47.32 0.43 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.224 2.21 . . . . 0.0 113.284 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 14.6 t -79.02 -21.7 46.56 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -171.023 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.669 HE22 ' HB2' ' A' ' 974' ' ' GLU . 43.2 mt-30 . . . . . 0 N--CA 1.463 0.211 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -175.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 927' ' ' HIS . . . . . 0.543 ' HB2' ' OE1' ' A' ' 929' ' ' GLU . 79.7 m-70 . . . . . 0 CA--C 1.5 -0.957 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 928' ' ' THR . . . . . 0.471 ' HB ' ' HB3' ' A' 1029 ' ' LYS . 4.7 m 64.19 87.89 0.11 Allowed 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -167.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.709 ' HB3' ' HD3' ' A' 1028 ' ' LYS . 0.8 OUTLIER -121.67 168.02 12.26 Favored 'General case' 0 C--N 1.27 -2.863 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.544 ' O ' ' HG2' ' A' 1027 ' ' ARG . 81.6 t80 -149.51 124.74 10.14 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -176.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 931' ' ' THR . . . . . . . . . . . . . 70.0 m -78.52 113.83 16.9 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 174.063 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -92.47 163.3 13.89 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 105.715 -1.958 . . . . 0.0 105.715 -174.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.602 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -164.28 142.31 7.01 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 120.265 -0.574 . . . . 0.0 109.791 -172.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.427 HG11 HD11 ' A' ' 967' ' ' LEU . 34.1 m -143.29 126.5 13.31 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 175.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.609 ' HA ' ' O ' ' A' 1021 ' ' ARG . 29.9 m-85 -84.18 149.47 26.13 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.67 -0.644 . . . . 0.0 110.164 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.526 ' O ' ' HA ' ' A' 1020 ' ' ARG . 13.3 tt0 -119.91 121.22 38.55 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -109.28 146.34 34.45 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.15 0.976 . . . . 0.0 112.666 -174.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.557 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 39.6 mt-10 -138.34 160.56 39.18 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 112.909 -1.95 . . . . 0.0 106.54 170.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 15.4 m -145.39 151.48 38.33 Favored 'General case' 0 C--N 1.311 -1.065 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -176.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.598 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 26.9 ptt180 -146.13 160.7 41.57 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.298 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -75.62 163.55 66.52 Favored Pre-proline 0 C--N 1.315 -0.928 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 169.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -68.5 89.22 0.41 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 CA-C-N 120.357 1.163 . . . . 0.0 109.993 172.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 129.41 -1.05 6.04 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 110.262 -1.135 . . . . 0.0 110.262 -174.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 944' ' ' GLY . . . . . 0.598 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -100.99 -171.93 28.77 Favored Glycine 0 CA--C 1.502 -0.749 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 177.227 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -122.5 154.84 37.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 119.204 1.502 . . . . 0.0 107.094 172.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.571 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 24.8 m95 -61.72 135.73 57.72 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.709 0.766 . . . . 0.0 112.302 -173.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -135.56 167.27 23.11 Favored Pre-proline 0 C--N 1.307 -1.256 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -49.16 128.42 19.71 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.496 2.13 . . . . 0.0 112.931 -179.255 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -74.32 -162.31 0.15 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.543 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -89.7 -52.92 4.75 Favored 'General case' 0 CA--C 1.483 -1.603 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -109.17 92.06 3.9 Favored 'General case' 0 N--CA 1.411 -2.382 0 N-CA-C 104.983 -2.229 . . . . 0.0 104.983 -176.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 10.4 m -57.97 -58.06 10.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.672 -172.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 953' ' ' TYR . . . . . 0.487 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 89.1 m-85 -104.97 136.68 43.98 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.062 -0.655 . . . . 0.0 111.37 178.279 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 3.0 p -149.66 -178.08 6.24 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.039 0.936 . . . . 0.0 112.333 -168.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 955' ' ' ASP . . . . . 0.494 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 6.5 t70 -108.95 164.94 11.96 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 173.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -54.4 -29.16 48.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 119.379 0.99 . . . . 0.0 111.494 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -82.41 -8.37 59.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 177.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 100.61 -3.7 56.31 Favored Glycine 0 CA--C 1.501 -0.833 0 C-N-CA 119.918 -1.134 . . . . 0.0 112.133 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 959' ' ' ASP . . . . . 0.494 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 30.6 t70 -59.41 99.15 0.05 Allowed 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 175.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -52.56 129.69 29.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.226 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.11 171.34 8.17 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.666 -176.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -74.53 160.62 30.67 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.1 m -85.67 151.83 56.12 Favored Pre-proline 0 N--CA 1.423 -1.792 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.471 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 2.8 Cg_endo -47.52 -29.89 11.09 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 125.119 3.879 . . . . 0.0 117.729 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 51.1 m -88.23 -35.61 17.21 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 118.98 0.809 . . . . 0.0 109.55 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -65.4 -25.94 67.77 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.009 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.486 HD13 ' CH2' ' A' ' 980' ' ' TRP . 32.9 mt -74.75 122.4 23.22 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.685 0.794 . . . . 0.0 110.351 176.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 24.0 p -124.77 169.53 11.91 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.368 -174.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.569 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 25.6 p -92.7 133.74 28.85 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.26 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.608 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 93.6 Cg_endo -75.79 170.52 20.01 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.328 2.018 . . . . 0.0 110.835 176.051 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -56.67 -19.93 32.54 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.201 2.601 . . . . 0.0 115.227 -176.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.685 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . -116.07 14.98 16.19 Favored Glycine 0 N--CA 1.439 -1.103 0 C-N-CA 120.474 -0.869 . . . . 0.0 112.708 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.608 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 96.4 m95 -129.13 127.78 42.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 118.014 0.907 . . . . 0.0 110.793 178.471 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.455 ' HB2' HE21 ' A' 1033 ' ' GLN . 8.9 tp10 -106.4 118.18 35.97 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.616 2.366 . . . . 0.0 108.528 -173.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.648 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 42.8 m95 -69.55 105.12 2.55 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.107 -1.037 . . . . 0.0 111.135 176.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -71.15 -51.09 26.93 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 174.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -74.43 144.84 44.11 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.774 -172.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.63 -36.53 68.04 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -178.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -166.8 150.27 6.84 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.96 0.41 . . . . 0.0 110.806 -174.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.607 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 35.1 m95 -64.68 120.24 12.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 981' ' ' SER . . . . . 0.712 ' O ' ' HA ' ' A' 1023 ' ' LEU . 19.9 m -115.6 -172.28 2.12 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -174.128 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 982' ' ' TYR . . . . . 0.437 ' CD2' ' HA ' ' A' ' 991' ' ' LYS . 3.7 p90 -109.88 143.78 39.3 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 120.472 1.487 . . . . 0.0 109.695 -177.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.499 ' HB3' ' HD2' ' A' 1022 ' ' ARG . 17.2 t70 -106.16 131.54 53.29 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.365 -171.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.2 pp -109.33 29.63 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.631 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -106.4 30.51 5.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.952 1.358 . . . . 0.0 107.742 -174.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -138.95 -177.1 4.73 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -178.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -86.79 77.68 9.23 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 173.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.506 HG12 ' HB3' ' A' ' 994' ' ' GLU . 30.3 m -137.1 156.67 34.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.529 -172.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -55.02 165.94 0.59 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.792 -1.094 . . . . 0.0 110.995 170.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -52.88 -25.25 11.09 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 123.582 0.753 . . . . 0.0 112.871 176.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 991' ' ' LYS . . . . . 0.444 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 95.4 mttt -106.77 13.03 28.42 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.812 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.32 -13.23 66.97 Favored Glycine 0 C--O 1.224 -0.473 0 CA-C-N 115.967 -0.56 . . . . 0.0 113.383 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.477 ' HE3' ' HG2' ' A' 1019 ' ' ARG . 79.4 m95 -59.31 115.38 3.19 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.506 ' HB3' HG12 ' A' ' 988' ' ' VAL . 4.5 pt-20 -105.41 159.25 16.06 Favored 'General case' 0 C--O 1.257 1.451 0 CA-C-O 121.992 0.901 . . . . 0.0 112.543 176.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.788 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 57.1 t80 -83.08 103.0 12.18 Favored 'General case' 0 C--O 1.209 -1.068 0 C-N-CA 128.019 2.528 . . . . 0.0 113.714 -172.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -127.23 137.99 10.24 Favored Glycine 0 N--CA 1.439 -1.152 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 172.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.49 ' O ' ' HA ' ' A' 1005 ' ' PRO . 0.6 OUTLIER -133.44 149.65 31.41 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 177.13 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 28.8 m -127.82 103.77 7.46 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 121.203 0.525 . . . . 0.0 109.832 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 18.0 pt -95.51 114.18 63.37 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.37 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 33.0 Cg_endo -65.87 138.16 51.98 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 122.518 2.145 . . . . 0.0 112.931 -177.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1001 ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 6.6 Cg_endo -89.92 138.53 12.77 Favored 'Cis proline' 0 N--CA 1.45 -1.071 0 C-N-CA 123.143 -1.607 . . . . 0.0 113.883 -1.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 30.9 t0 165.16 151.19 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 111.604 -2.544 . . . . 0.0 104.664 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1003 ' ' HIS . . . . . 0.403 ' HB2' ' HD2' ' A' 1004 ' ' LYS . 3.5 m-70 -112.22 -35.91 5.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 120.631 1.559 . . . . 0.0 110.588 -175.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1004 ' ' LYS . . . . . 0.403 ' HD2' ' HB2' ' A' 1003 ' ' HIS . 2.0 mptp? -96.84 142.33 24.38 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-O 120.934 0.397 . . . . 0.0 111.772 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.49 ' HA ' ' O ' ' A' ' 997' ' ' ILE . 77.5 Cg_exo -62.66 123.21 11.94 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 N-CA-C 107.405 -1.806 . . . . 0.0 107.405 162.441 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 34.3 mttm -75.5 -12.61 60.27 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.199 0.523 . . . . 0.0 111.783 -175.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 39.3 t -150.07 151.74 33.69 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 -165.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.691 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 59.4 m95 -138.41 131.95 30.65 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 125.457 1.723 . . . . 0.0 107.254 174.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.407 HG12 ' N ' ' A' 1010 ' ' ALA . 21.3 t -150.18 170.56 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -171.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1010 ' ' ALA . . . . . 0.407 ' N ' HG12 ' A' 1009 ' ' VAL . . . -94.37 95.22 8.74 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 176.16 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -169.26 172.51 7.24 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.905 -175.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.644 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.2 OUTLIER -150.7 97.68 2.52 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 122.69 1.233 . . . . 0.0 109.238 176.973 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.586 ' HD3' ' CE1' ' A' ' 995' ' ' TYR . 57.7 mtpt -115.87 144.25 44.29 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 112.869 -1.969 . . . . 0.0 110.084 -176.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 55.5 ttp -46.27 -35.11 4.97 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 124.887 1.275 . . . . 0.0 113.875 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -62.34 -13.0 24.27 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.812 0.339 . . . . 0.0 111.178 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.788 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.4 OUTLIER -48.94 106.14 0.1 Allowed 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.0 177.253 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -18.57 13.91 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.15 175.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -139.73 147.17 40.5 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.169 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1019 ' ' ARG . . . . . 0.477 ' HG2' ' HE3' ' A' ' 993' ' ' TRP . 50.3 ttp180 -147.58 147.63 30.27 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.458 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.589 ' HG2' ' CZ3' ' A' 1008 ' ' TRP . 3.6 ptp180 -155.44 167.78 29.26 Favored 'General case' 0 C--O 1.201 -1.471 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.935 176.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.609 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 28.1 ptt180 -149.93 156.31 41.51 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 123.713 0.633 . . . . 0.0 109.753 177.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.602 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 34.5 ttm180 -88.69 128.25 35.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 117.794 0.27 . . . . 0.0 110.612 177.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.712 ' HA ' ' O ' ' A' ' 981' ' ' SER . 87.2 mt -101.67 128.28 48.04 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 106.924 -1.509 . . . . 0.0 106.924 168.224 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 4.5 m -107.44 139.1 30.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.14 0 CA-C-O 121.543 0.687 . . . . 0.0 111.93 -174.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.514 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.1 tpt180 -135.61 104.41 5.79 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.1 171.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.722 ' HE2' ' HE3' ' A' 1028 ' ' LYS . 0.9 OUTLIER -72.4 136.76 46.15 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.046 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.648 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.4 ptm180 -138.03 144.46 41.05 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -172.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.722 ' HE3' ' HE2' ' A' 1026 ' ' LYS . 30.4 mmtp -108.61 150.3 27.71 Favored 'General case' 0 CA--C 1.468 -2.2 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.822 -175.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 35.1 ttmt -99.26 -16.46 18.5 Favored 'General case' 0 C--N 1.275 -2.656 0 N-CA-C 103.996 -2.594 . . . . 0.0 103.996 161.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1030 ' ' ASP . . . . . 0.462 ' C ' ' H ' ' A' 1032 ' ' THR . 8.6 t70 49.27 16.1 0.14 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 111.217 -2.72 . . . . 0.0 111.376 -174.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 29.5 tp 55.74 -37.58 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 127.864 2.465 . . . . 0.0 113.247 -172.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1032 ' ' THR . . . . . 0.462 ' H ' ' C ' ' A' 1030 ' ' ASP . 9.0 t -74.79 -14.08 60.66 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.405 1.082 . . . . 0.0 112.878 -178.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.685 ' HB3' ' HA2' ' A' ' 972' ' ' GLY . 11.5 mm-40 . . . . . 0 N--CA 1.483 1.179 0 CA-C-N 118.999 0.818 . . . . 0.0 109.908 177.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 . . . . . 0 CA--C 1.495 -1.136 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.16 124.01 47.01 Favored 'General case' 0 N--CA 1.415 -2.223 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 163.547 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.485 ' HB2' ' HE3' ' A' 1026 ' ' LYS . 0.1 OUTLIER -141.67 133.0 26.56 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 171.194 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.425 ' O ' ' HG2' ' A' 1027 ' ' ARG . 73.2 t80 -128.36 135.65 49.85 Favored 'General case' 0 C--N 1.295 -1.771 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 -176.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.594 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 34.0 m -77.5 124.45 27.92 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -105.06 159.4 15.86 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 105.153 -2.166 . . . . 0.0 105.153 -173.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.781 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 11.9 pt-20 -151.1 152.55 33.55 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.105 -175.497 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.619 ' O ' ' HA ' ' A' 1022 ' ' ARG . 8.6 p -137.03 178.63 4.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 N-CA-C 106.438 -1.689 . . . . 0.0 106.438 176.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.54 ' HA ' ' O ' ' A' 1021 ' ' ARG . 49.8 m-85 -142.79 113.11 7.23 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 118.755 0.707 . . . . 0.0 110.761 -174.354 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.567 ' O ' ' HA ' ' A' 1020 ' ' ARG . 31.3 tt0 -79.3 127.42 32.04 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.944 0.778 . . . . 0.0 110.046 173.326 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 937' ' ' ASN . . . . . 0.451 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 33.5 m-80 -118.53 152.41 36.02 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.632 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 43.5 mt-10 -140.86 162.11 36.21 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 171.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 24.7 p -137.62 142.37 41.23 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.54 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 15.0 ptt180 -151.63 160.05 43.8 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 123.779 0.832 . . . . 0.0 108.92 -178.047 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -66.29 161.23 59.33 Favored Pre-proline 0 C--N 1.311 -1.087 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 171.113 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.64 97.76 0.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 121.554 1.503 . . . . 0.0 111.396 175.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 89.27 62.56 1.34 Allowed Glycine 0 N--CA 1.441 -0.983 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 -178.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -156.25 -159.65 9.54 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 121.096 -0.573 . . . . 0.0 111.929 -175.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -103.24 133.08 48.92 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 123.989 0.464 . . . . 0.0 110.263 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.632 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 42.2 m95 -80.78 147.41 30.5 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-O 121.3 0.571 . . . . 0.0 109.876 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -127.56 151.29 74.91 Favored Pre-proline 0 C--N 1.296 -1.758 0 N-CA-C 103.018 -2.956 . . . . 0.0 103.018 170.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -49.35 140.15 27.3 Favored 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 122.426 2.084 . . . . 0.0 111.66 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.64 -178.17 0.38 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.435 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -89.73 -40.11 12.72 Favored 'General case' 0 CA--C 1.473 -1.995 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -120.18 88.15 2.88 Favored 'General case' 0 N--CA 1.399 -3.023 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 31.8 m -64.64 -57.79 8.09 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.715 -1.13 . . . . 0.0 112.384 -170.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -92.77 129.27 38.74 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.725 0.774 . . . . 0.0 111.436 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 954' ' ' THR . . . . . 0.572 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 12.9 p -149.61 178.44 8.84 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.133 -169.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -99.27 172.99 7.0 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 105.567 -2.012 . . . . 0.0 105.567 173.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -53.07 -31.55 42.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.931 0.787 . . . . 0.0 111.437 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 957' ' ' ASN . . . . . 0.416 HD21 ' HB2' ' A' ' 959' ' ' ASP . 5.3 p30 -84.16 -7.78 59.27 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.588 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 958' ' ' GLY . . . . . 0.572 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 74.76 56.52 4.9 Favored Glycine 0 CA--C 1.49 -1.525 0 C-N-CA 120.194 -1.003 . . . . 0.0 111.27 -174.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 959' ' ' ASP . . . . . 0.416 ' HB2' HD21 ' A' ' 957' ' ' ASN . 11.3 t70 -105.17 109.66 21.73 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.499 -3.149 . . . . 0.0 102.499 174.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -46.58 115.95 1.18 Allowed 'General case' 0 C--N 1.319 -0.748 0 O-C-N 124.481 1.113 . . . . 0.0 111.164 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -122.42 -177.26 3.57 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.858 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 962' ' ' ALA . . . . . 0.617 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -80.52 161.62 24.74 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 176.779 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.0 m -80.69 159.94 68.01 Favored Pre-proline 0 C--N 1.314 -0.95 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.699 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 41.7 Cg_exo -46.38 -33.8 13.16 Favored 'Trans proline' 0 N--CA 1.478 0.56 0 C-N-CA 123.674 2.916 . . . . 0.0 115.047 -178.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 2.5 p -72.57 -47.51 47.49 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.507 0.67 . . . . 0.0 110.086 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 966' ' ' GLU . . . . . 0.617 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 40.0 mt-10 -64.84 -32.86 74.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.112 -1.403 . . . . 0.0 110.488 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.509 HD13 ' CH2' ' A' ' 980' ' ' TRP . 14.5 mt -60.9 110.41 1.33 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.923 0.868 . . . . 0.0 111.175 178.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 18.7 p -104.64 164.35 11.82 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.282 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 14.2 p -97.98 136.04 21.22 Favored Pre-proline 0 N--CA 1.442 -0.835 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.421 175.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.604 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 77.8 Cg_endo -71.76 175.57 9.44 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 123.683 2.922 . . . . 0.0 110.492 177.049 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.53 -46.59 30.76 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.643 2.228 . . . . 0.0 114.011 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 972' ' ' GLY . . . . . . . . . . . . . . . -72.11 -51.96 12.58 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.732 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.604 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 96.6 m95 -72.01 144.31 48.86 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -177.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.533 ' HB3' ' O ' ' A' 1028 ' ' LYS . 2.6 tp10 -133.47 156.51 47.6 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 113.297 -1.774 . . . . 0.0 106.455 -177.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.493 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 82.6 m95 -89.56 152.11 21.59 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.616 -0.678 . . . . 0.0 110.703 172.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -131.1 -33.78 1.5 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.54 0.686 . . . . 0.0 109.396 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 977' ' ' ASP . . . . . 0.454 ' HB3' ' HD2' ' A' 1025 ' ' ARG . 8.2 t0 -71.44 151.49 43.95 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.83 -47.49 74.84 Favored 'General case' 0 C--N 1.318 -0.788 0 O-C-N 123.527 0.517 . . . . 0.0 111.253 -176.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -164.72 171.97 13.64 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -174.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.699 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 31.6 m95 -84.86 87.13 7.31 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.884 0.849 . . . . 0.0 109.14 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 3.2 m -93.45 145.43 24.5 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.715 -1.129 . . . . 0.0 108.575 -176.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 982' ' ' TYR . . . . . 0.463 ' HA ' ' O ' ' A' 1022 ' ' ARG . 3.5 p90 -73.39 136.03 44.31 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 121.919 0.866 . . . . 0.0 110.722 -176.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.577 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 4.4 t70 -82.92 141.02 32.49 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 113.668 -1.606 . . . . 0.0 111.746 -172.708 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.5 pp -132.29 5.63 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.442 176.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 985' ' ' ASN . . . . . 0.571 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 17.1 m120 -92.31 18.91 7.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.042 0.449 . . . . 0.0 111.845 -175.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.577 ' HD3' ' OD2' ' A' ' 983' ' ' ASP . 8.2 mpt_? -143.87 -178.27 5.84 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 106.344 -1.725 . . . . 0.0 106.344 -178.42 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.15 83.73 2.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 118.71 0.687 . . . . 0.0 112.008 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.411 HG12 ' HG2' ' A' ' 994' ' ' GLU . 15.8 m -143.65 157.63 16.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 C-N-CA 124.666 1.186 . . . . 0.0 107.966 178.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -55.22 173.01 0.11 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.599 0.36 . . . . 0.0 110.765 175.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.59 -31.4 72.61 Favored 'General case' 0 CA--C 1.492 -1.265 0 O-C-N 121.282 -0.886 . . . . 0.0 110.422 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 991' ' ' LYS . . . . . 0.441 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 24.4 mtmm -92.6 0.3 57.41 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.038 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.7 -21.16 41.58 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 112.257 -0.337 . . . . 0.0 112.257 175.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.441 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 81.6 m95 -50.6 124.96 11.89 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.411 ' HG2' HG12 ' A' ' 988' ' ' VAL . 23.7 mt-10 -99.1 157.63 16.22 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.871 -1.059 . . . . 0.0 109.287 176.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.918 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 86.5 t80 -82.63 86.38 6.84 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 113.366 -1.743 . . . . 0.0 109.096 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 996' ' ' GLY . . . . . 0.472 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -109.66 84.04 0.35 Allowed Glycine 0 CA--C 1.49 -1.484 0 C-N-CA 120.137 -1.03 . . . . 0.0 111.369 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.47 HD11 HD11 ' A' ' 999' ' ' ILE . 0.4 OUTLIER -92.16 131.92 37.93 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 CA-C-O 121.696 0.76 . . . . 0.0 110.722 -176.37 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 998' ' ' THR . . . . . 0.443 ' OG1' ' HG3' ' A' 1005 ' ' PRO . 4.0 m -132.07 121.88 24.54 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.47 HD11 HD11 ' A' ' 997' ' ' ILE . 59.3 mt -115.24 98.25 50.08 Favored Pre-proline 0 C--N 1.316 -0.859 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -175.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 26.3 Cg_endo -62.27 132.23 37.82 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.403 2.069 . . . . 0.0 113.405 -176.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1001 ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 1.2 Cg_endo -79.46 143.92 70.26 Favored 'Cis proline' 0 CA--C 1.51 -0.698 0 C-N-CA 123.117 -1.618 . . . . 0.0 112.293 -1.364 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 5.8 t0 -147.2 -174.8 4.61 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 113.764 -1.562 . . . . 0.0 107.883 -173.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -116.16 -61.77 1.68 Allowed 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.112 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -160.52 157.85 24.5 Favored Pre-proline 0 C--N 1.315 -0.901 0 N-CA-C 101.907 -3.368 . . . . 0.0 101.907 -177.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.443 ' HG3' ' OG1' ' A' ' 998' ' ' THR . 53.7 Cg_exo -59.12 121.11 9.39 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 CA-C-N 122.172 1.811 . . . . 0.0 109.864 174.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 60.6 mttt -66.04 -29.02 69.3 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -177.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.0 t -145.29 140.65 27.94 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 114.438 -1.256 . . . . 0.0 109.286 -165.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.546 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 63.8 m95 -126.12 138.66 53.7 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 125.213 1.57 . . . . 0.0 107.322 176.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.711 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 34.5 t -139.87 166.83 20.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 -176.521 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1010 ' ' ALA . . . . . 0.44 ' H ' HG12 ' A' 1009 ' ' VAL . . . -92.98 24.41 3.71 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -171.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -135.85 137.28 41.33 Favored 'General case' 0 C--N 1.315 -0.917 0 O-C-N 121.39 -0.819 . . . . 0.0 111.06 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.417 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -92.57 132.41 36.87 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 175.851 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.509 ' H ' ' CD2' ' A' 1016 ' ' HIS . 96.2 mttt -152.53 176.83 11.28 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 -171.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.56 6.39 17.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.67 0.747 . . . . 0.0 111.008 -178.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -90.99 7.92 37.92 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 122.481 1.134 . . . . 0.0 108.243 175.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.918 ' CE1' ' HA ' ' A' ' 995' ' ' TYR . 9.9 m-70 -88.12 172.29 9.62 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 114.168 -1.378 . . . . 0.0 111.812 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -158.0 -35.77 0.07 Allowed 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 112.3 -2.227 . . . . 0.0 106.266 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1018 ' ' HIS . . . . . 0.472 ' HB2' ' O ' ' A' ' 996' ' ' GLY . 35.1 m170 -132.08 151.65 51.65 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 170.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 34.4 ptt180 -149.05 148.44 29.72 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 173.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.567 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.7 ptp180 -151.34 152.18 32.79 Favored 'General case' 0 CA--C 1.482 -1.657 0 C-N-CA 117.672 -1.611 . . . . 0.0 110.804 176.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.54 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 25.0 ptt180 -128.08 142.83 51.09 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.624 -177.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.781 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 32.8 ttm180 -78.43 123.32 26.9 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 114.243 -1.344 . . . . 0.0 110.27 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1023 ' ' LEU . . . . . . . . . . . . . 17.5 mt -103.88 129.85 51.42 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 103.978 -2.601 . . . . 0.0 103.978 168.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.445 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 17.0 m -105.87 133.68 49.56 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 O-C-N 123.63 0.582 . . . . 0.0 111.316 -172.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.454 ' HD2' ' HB3' ' A' ' 977' ' ' ASP . 13.4 tpt180 -135.52 103.98 5.66 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 172.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.6 OUTLIER -70.39 138.36 51.24 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.843 -1.54 . . . . 0.0 106.843 177.9 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.493 HH21 ' HD2' ' A' ' 970' ' ' PRO . 15.0 ptm180 -131.21 143.36 50.53 Favored 'General case' 0 CA--C 1.488 -1.439 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 -173.016 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.533 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 28.7 ttmt -132.77 134.35 44.6 Favored 'General case' 0 C--N 1.281 -2.371 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -175.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.583 ' C ' ' H ' ' A' 1031 ' ' LEU . 36.3 ttmt -84.17 -22.19 31.06 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 122.795 1.284 . . . . 0.0 107.815 -177.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 34.3 t70 65.6 -33.53 0.17 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 127.928 2.491 . . . . 0.0 112.566 -173.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1031 ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' 1029 ' ' LYS . 21.9 tp 87.55 9.92 0.15 Allowed 'General case' 0 C--N 1.309 -1.16 0 C-N-CA 128.698 2.799 . . . . 0.0 109.718 174.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 4.4 m -112.69 -8.93 13.76 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 17.6 tt0 . . . . . 0 N--CA 1.439 -1.013 0 CA-C-N 113.534 -1.666 . . . . 0.0 109.654 -174.76 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 927' ' ' HIS . . . . . 0.473 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 25.2 m-70 . . . . . 0 CA--C 1.503 -0.864 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.65 122.03 45.21 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 160.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.755 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.0 OUTLIER -108.66 175.45 5.46 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.197 175.1 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.742 ' O ' ' HG2' ' A' 1027 ' ' ARG . 85.3 t80 -159.82 119.49 2.91 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 176.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.43 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 27.9 m -73.14 123.26 23.26 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 171.157 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 932' ' ' ASP . . . . . 0.69 ' HB2' ' HD2' ' A' 1027 ' ' ARG . 8.5 t70 -100.33 155.86 17.56 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -155.51 147.96 23.91 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.507 -171.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.537 HG22 ' H ' ' A' ' 935' ' ' TYR . 8.1 p -144.48 -179.53 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 N-CA-C 105.589 -2.004 . . . . 0.0 105.589 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.551 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 67.8 m-85 -136.69 150.81 48.67 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -178.186 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.572 ' O ' ' HA ' ' A' 1020 ' ' ARG . 7.3 tt0 -122.93 122.36 38.39 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 937' ' ' ASN . . . . . 0.52 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 29.4 m-80 -113.11 142.57 45.6 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 122.32 1.057 . . . . 0.0 112.833 -173.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.618 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 35.7 mt-10 -135.63 161.93 34.15 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 112.672 -2.058 . . . . 0.0 105.664 171.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 939' ' ' SER . . . . . 0.476 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 34.9 p -149.56 158.97 44.66 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 118.65 0.659 . . . . 0.0 112.404 -175.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' 1017 ' ' THR . 37.5 ptt180 -156.77 159.52 38.37 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.731 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -75.94 165.26 54.59 Favored Pre-proline 0 C--N 1.311 -1.095 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 168.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -62.68 84.61 0.11 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 121.424 1.416 . . . . 0.0 110.643 171.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 132.49 -2.2 4.93 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -175.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 944' ' ' GLY . . . . . 0.512 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -96.42 -172.33 35.11 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 108.048 -2.021 . . . . 0.0 108.048 177.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -127.57 161.58 28.48 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 120.112 1.956 . . . . 0.0 105.803 170.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.658 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 54.6 m95 -64.07 134.8 55.62 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 122.282 1.039 . . . . 0.0 113.463 -169.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -136.27 175.62 3.41 Favored Pre-proline 0 C--N 1.309 -1.171 0 N-CA-C 104.391 -2.448 . . . . 0.0 104.391 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.86 126.92 24.14 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.707 1.605 . . . . 0.0 111.814 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 949' ' ' ALA . . . . . 0.476 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -80.84 15.01 1.92 Allowed 'General case' 0 C--O 1.239 0.532 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -178.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 78.37 -62.19 0.35 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 125.293 1.437 . . . . 0.0 108.623 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.83 83.77 2.79 Favored 'General case' 0 N--CA 1.417 -2.098 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.3 m -72.26 -58.72 3.18 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.694 -171.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 953' ' ' TYR . . . . . 0.551 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 88.3 m-85 -97.88 123.93 42.07 Favored 'General case' 0 C--N 1.309 -1.196 0 C-N-CA 119.053 -1.059 . . . . 0.0 110.095 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 954' ' ' THR . . . . . 0.435 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 76.5 p -136.35 171.41 14.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.359 -170.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -95.75 176.93 5.95 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 105.685 -1.969 . . . . 0.0 105.685 175.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.64 -24.42 5.54 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 178.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 957' ' ' ASN . . . . . 0.431 HD22 ' HB2' ' A' ' 959' ' ' ASP . 5.9 p30 -96.66 -4.03 41.64 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.655 -0.653 . . . . 0.0 111.35 178.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 958' ' ' GLY . . . . . 0.435 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 93.53 -1.49 69.21 Favored Glycine 0 CA--C 1.499 -0.96 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.165 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 959' ' ' ASP . . . . . 0.431 ' HB2' HD22 ' A' ' 957' ' ' ASN . 7.0 t70 -57.55 104.73 0.19 Allowed 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -51.94 133.62 32.28 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.876 0.846 . . . . 0.0 110.908 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -128.63 -173.94 3.1 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.767 -1.106 . . . . 0.0 108.991 -176.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 962' ' ' ALA . . . . . 0.47 ' HB1' ' HB3' ' A' ' 966' ' ' GLU . . . -75.99 157.81 32.64 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 176.562 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.5 m -77.52 156.96 80.65 Favored Pre-proline 0 N--CA 1.441 -0.92 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.653 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 52.4 Cg_exo -51.31 -20.12 7.68 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.457 2.772 . . . . 0.0 114.614 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.3 p -70.81 -57.8 4.27 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 966' ' ' GLU . . . . . 0.47 ' HB3' ' HB1' ' A' ' 962' ' ' ALA . 35.2 tt0 -69.09 -27.83 65.96 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.229 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 964' ' ' PRO . 31.6 mt -59.81 110.75 1.23 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 24.3 p -116.34 177.54 4.65 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.688 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.534 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 9.0 p -101.64 143.19 26.1 Favored Pre-proline 0 C--N 1.307 -1.28 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.676 178.15 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.607 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 97.4 Cg_endo -74.56 -179.37 4.77 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.029 2.486 . . . . 0.0 109.418 172.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.35 -51.78 9.75 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.922 1.748 . . . . 0.0 114.457 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.439 ' O ' ' HG2' ' A' 1033 ' ' GLN . . . -74.31 -46.24 21.47 Favored Glycine 0 N--CA 1.442 -0.961 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.992 -177.433 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.607 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 99.2 m95 -69.23 130.43 42.62 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.458 ' HB3' ' O ' ' A' 1028 ' ' LYS . 6.5 tp10 -118.66 143.42 46.84 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 126.499 1.92 . . . . 0.0 109.748 -173.112 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -88.55 152.64 21.72 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.551 0.691 . . . . 0.0 111.446 173.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -137.86 -36.61 0.61 Allowed 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.673 177.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 977' ' ' ASP . . . . . 0.684 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.4 m-20 -77.62 149.66 34.73 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -174.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -54.81 -51.58 65.37 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 124.782 1.301 . . . . 0.0 113.186 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -168.77 167.76 10.95 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-O 120.877 0.37 . . . . 0.0 110.321 -175.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.653 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 33.5 m95 -74.72 114.71 13.47 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 177.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 2.6 p -123.95 149.23 46.18 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -172.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 982' ' ' TYR . . . . . 0.596 ' HA ' ' O ' ' A' 1022 ' ' ARG . 1.0 OUTLIER -74.21 129.54 38.01 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.577 0.703 . . . . 0.0 111.28 -172.797 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -87.75 135.26 33.45 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.806 -170.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 26.3 pt -115.68 24.79 4.62 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.985 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 985' ' ' ASN . . . . . 0.622 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 25.3 t-20 -101.44 15.64 28.18 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.783 0.802 . . . . 0.0 110.369 -175.285 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.622 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 8.7 mpt_? -138.24 -176.74 4.55 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 -174.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -78.01 75.63 4.54 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.953 0.883 . . . . 0.0 109.443 176.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 27.6 m -141.53 152.21 19.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.111 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -55.32 169.37 0.28 Allowed 'General case' 0 C--N 1.323 -0.567 0 O-C-N 123.89 0.744 . . . . 0.0 111.113 173.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -52.58 -32.24 40.17 Favored 'General case' 0 CA--C 1.493 -1.25 0 CA-C-O 121.65 0.738 . . . . 0.0 111.751 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 991' ' ' LYS . . . . . 0.444 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 70.9 mmtt -104.2 15.17 28.95 Favored 'General case' 0 N--CA 1.417 -2.085 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.95 -176.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 89.48 -15.81 57.76 Favored Glycine 0 C--O 1.226 -0.399 0 CA-C-N 115.587 -0.733 . . . . 0.0 113.028 174.078 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.683 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 82.0 m95 -58.78 109.53 0.83 Allowed 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -177.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.91 160.27 14.51 Favored 'General case' 0 C--O 1.254 1.301 0 C-N-CA 123.756 0.823 . . . . 0.0 110.952 173.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.663 ' HE1' ' HB ' ' A' ' 997' ' ' ILE . 0.3 OUTLIER -75.7 102.77 5.51 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 125.435 1.494 . . . . 0.0 112.09 -172.454 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 996' ' ' GLY . . . . . 0.44 ' HA2' ' HB3' ' A' 1005 ' ' PRO . . . -107.72 88.8 0.55 Allowed Glycine 0 CA--C 1.492 -1.405 0 C-N-CA 119.051 -1.547 . . . . 0.0 112.261 173.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.663 ' HB ' ' HE1' ' A' ' 995' ' ' TYR . 2.5 tt -97.24 127.64 49.28 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.082 0 O-C-N 121.341 -1.093 . . . . 0.0 110.198 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 20.7 m -118.42 82.9 1.92 Allowed 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 23.3 pt -104.4 130.81 22.63 Favored Pre-proline 0 C--N 1.316 -0.88 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.291 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 36.5 Cg_endo -64.54 145.29 87.15 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.703 2.269 . . . . 0.0 112.754 -178.553 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1001 ' ' PRO . . . . . 0.434 ' O ' ' HB2' ' A' 1002 ' ' ASP . 7.9 Cg_endo -91.26 135.55 9.03 Favored 'Cis proline' 0 N--CA 1.446 -1.323 0 C-N-CA 123.024 -1.657 . . . . 0.0 112.844 -2.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1002 ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' 1001 ' ' PRO . 3.7 t70 158.69 170.37 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 111.523 -2.581 . . . . 0.0 105.822 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -149.81 33.97 0.68 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 118.646 0.657 . . . . 0.0 109.943 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 90.1 mttt -159.92 127.96 2.85 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.671 -176.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.711 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 32.8 Cg_exo -68.56 124.26 11.39 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 121.521 1.481 . . . . 0.0 109.984 172.098 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 45.8 pttt -123.35 8.16 9.06 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -174.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.3 t -138.83 116.48 11.4 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.711 ' CZ2' ' HB2' ' A' 1005 ' ' PRO . 62.0 m95 -121.96 134.49 54.83 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.939 -171.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 15.4 m -156.29 178.08 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 -175.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -94.98 104.64 16.52 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 175.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -169.71 176.38 4.91 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.255 0.347 . . . . 0.0 110.34 -176.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.62 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 10.2 tp10 -163.13 104.4 0.99 Allowed 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 122.221 1.01 . . . . 0.0 108.608 176.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' A' 1016 ' ' HIS . 73.0 mttt -135.62 157.45 46.85 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 113.667 -1.606 . . . . 0.0 109.263 -176.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 49.0 ttp -48.26 -41.64 28.31 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 125.137 1.375 . . . . 0.0 114.339 -177.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -59.23 -16.16 19.39 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.658 ' HB3' ' CH2' ' A' ' 946' ' ' TRP . 7.6 m80 -53.53 100.01 0.03 OUTLIER 'General case' 0 CA--C 1.511 -0.542 0 O-C-N 123.635 0.585 . . . . 0.0 111.345 172.616 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1017 ' ' THR . . . . . 0.528 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.0 OUTLIER -96.88 -22.72 16.72 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 122.845 1.307 . . . . 0.0 108.178 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -139.68 157.89 45.03 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 113.437 -1.711 . . . . 0.0 108.237 -178.134 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1019 ' ' ARG . . . . . 0.683 ' HG2' ' CE3' ' A' ' 993' ' ' TRP . 44.8 ttp180 -157.82 148.44 20.85 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.05 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 5.4 ptp180 -152.1 166.34 31.96 Favored 'General case' 0 CA--C 1.487 -1.478 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.643 178.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.502 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 33.6 ptt180 -145.45 150.02 35.76 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.747 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.596 ' O ' ' HA ' ' A' ' 982' ' ' TYR . 41.4 ttm180 -87.22 120.91 28.99 Favored 'General case' 0 N--CA 1.437 -1.112 0 O-C-N 123.212 0.32 . . . . 0.0 110.758 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.568 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 86.1 mt -97.61 124.38 41.88 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 170.142 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.557 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 16.4 m -109.45 141.88 23.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 CA-C-O 121.823 0.82 . . . . 0.0 111.512 -175.376 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.543 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.4 tpt180 -134.45 104.78 6.25 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 113.662 -1.608 . . . . 0.0 107.936 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.684 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -75.19 146.62 41.09 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -178.35 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.742 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 13.1 ptm180 -147.35 171.37 15.55 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -170.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.755 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 15.5 ptpt -158.58 152.4 23.5 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 178.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.56 ' C ' ' H ' ' A' 1031 ' ' LEU . 38.1 ttmt -84.23 -10.72 57.45 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 122.812 1.291 . . . . 0.0 107.682 -176.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1030 ' ' ASP . . . . . 0.478 ' HB3' ' HB2' ' A' 1033 ' ' GLN . 32.0 t70 72.23 -20.47 0.25 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 112.011 -2.359 . . . . 0.0 112.717 178.277 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1031 ' ' LEU . . . . . 0.56 ' H ' ' C ' ' A' 1029 ' ' LYS . 19.7 tp 78.17 -12.86 1.02 Allowed 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 127.78 2.432 . . . . 0.0 112.202 177.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 6.7 t -135.36 9.58 3.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 122.167 0.984 . . . . 0.0 108.822 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.478 ' HB2' ' HB3' ' A' 1030 ' ' ASP . 10.2 tp60 . . . . . 0 N--CA 1.438 -1.067 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 174.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 927' ' ' HIS . . . . . 0.466 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 9.6 m-70 . . . . . 0 CA--C 1.51 -0.571 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.5 m -166.18 115.54 0.95 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 101.404 -3.554 . . . . 0.0 101.404 169.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.531 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 1.4 pm0 -142.92 136.04 28.2 Favored 'General case' 0 C--N 1.286 -2.193 0 CA-C-N 119.684 1.129 . . . . 0.0 109.005 177.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.459 ' O ' ' HG2' ' A' 1027 ' ' ARG . 79.2 t80 -137.64 137.75 38.76 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -177.422 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.639 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 17.1 m -76.3 133.65 39.97 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.345 0.117 . . . . 0.0 110.995 178.51 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -111.08 163.82 13.47 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.541 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 10.6 pt-20 -151.24 150.74 30.94 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -173.462 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' 1022 ' ' ARG . 7.1 p -138.82 175.39 8.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 N-CA-C 106.191 -1.781 . . . . 0.0 106.191 175.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.7 ' HA ' ' O ' ' A' 1021 ' ' ARG . 68.2 m-85 -139.43 146.47 40.14 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -175.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.73 ' O ' ' HA ' ' A' 1020 ' ' ARG . 30.0 tt0 -121.59 120.33 34.5 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -174.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 937' ' ' ASN . . . . . 0.525 ' HA ' ' O ' ' A' 1019 ' ' ARG . 26.2 m-80 -109.14 140.43 42.74 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.361 1.077 . . . . 0.0 112.891 -172.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.581 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 66.1 mt-10 -133.83 158.68 42.78 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 104.345 -2.465 . . . . 0.0 104.345 170.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 17.4 m -142.56 151.8 41.94 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 119.017 0.826 . . . . 0.0 111.48 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.662 ' O ' ' HA ' ' A' 1017 ' ' THR . 32.1 ptt180 -148.98 159.52 44.14 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.568 178.241 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -79.68 164.46 53.37 Favored Pre-proline 0 C--N 1.302 -1.499 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 171.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -64.04 91.44 0.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 121.123 1.215 . . . . 0.0 109.909 172.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 123.95 0.53 9.0 Favored Glycine 0 N--CA 1.44 -1.065 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 -175.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 944' ' ' GLY . . . . . 0.566 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -101.26 -175.08 28.82 Favored Glycine 0 CA--C 1.505 -0.586 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 178.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -119.37 166.7 12.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.977 1.889 . . . . 0.0 105.989 169.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.581 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 40.8 m95 -71.72 138.73 48.72 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-O 122.146 0.974 . . . . 0.0 112.408 -171.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -129.16 174.32 4.69 Favored Pre-proline 0 C--N 1.307 -1.251 0 N-CA-C 103.736 -2.691 . . . . 0.0 103.736 175.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -56.74 133.29 57.06 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 CA-C-N 121.364 1.523 . . . . 0.0 111.335 174.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.86 -170.88 0.12 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.681 0.753 . . . . 0.0 112.456 177.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.51 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.0 OUTLIER -91.51 -36.82 13.51 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -178.012 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -120.43 105.65 11.07 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 104.912 -2.255 . . . . 0.0 104.912 169.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.1 m -66.62 -64.3 0.88 Allowed 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.101 -176.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 953' ' ' TYR . . . . . 0.628 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 73.4 m-85 -93.02 135.56 34.08 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 118.834 -1.146 . . . . 0.0 110.446 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 954' ' ' THR . . . . . 0.436 ' HA ' ' H ' ' A' ' 961' ' ' ALA . 77.0 p -147.2 -177.27 5.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -174.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -103.29 -178.05 3.55 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 170.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.59 -26.08 12.44 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 176.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -87.52 -51.33 5.97 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 121.907 -0.496 . . . . 0.0 110.869 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 146.05 -7.63 1.43 Allowed Glycine 0 CA--C 1.493 -1.344 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.741 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.96 108.64 1.25 Allowed 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 175.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 960' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 961' ' ' ALA . 50.7 tttm -47.19 119.94 2.88 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.598 1.186 . . . . 0.0 110.526 178.123 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.479 ' O ' ' HG2' ' A' ' 960' ' ' LYS . . . -90.2 175.4 7.15 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 962' ' ' ALA . . . . . 0.529 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -72.44 -52.82 14.2 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.148 -1.021 . . . . 0.0 112.683 -175.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 57.1 p 138.48 156.53 0.0 OUTLIER Pre-proline 0 C--N 1.309 -1.191 0 C-N-CA 126.913 2.085 . . . . 0.0 109.919 -171.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.482 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 4.8 Cg_endo -58.92 -26.34 80.68 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 121.879 1.719 . . . . 0.0 112.291 172.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 50.7 m -74.19 -53.31 10.1 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 175.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 966' ' ' GLU . . . . . 0.529 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 33.3 mt-10 -75.42 5.26 6.0 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.437 ' HA ' HD13 ' A' ' 967' ' ' LEU . 0.4 OUTLIER -96.79 111.94 23.9 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 172.205 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 18.7 p -110.74 174.31 5.92 Favored 'General case' 0 C--N 1.296 -1.761 0 CA-C-O 121.221 0.534 . . . . 0.0 111.491 -174.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.421 ' HA ' ' NH2' ' A' 1027 ' ' ARG . 16.1 p -108.73 128.85 24.77 Favored Pre-proline 0 N--CA 1.436 -1.152 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 173.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.647 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 73.5 Cg_endo -73.49 166.02 30.93 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.995 2.464 . . . . 0.0 110.337 177.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -49.64 -30.75 22.91 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.111 2.54 . . . . 0.0 114.13 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.689 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -107.31 23.17 27.54 Favored Glycine 0 N--CA 1.437 -1.235 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.577 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.647 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 75.7 m95 -135.74 132.84 37.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 117.629 0.714 . . . . 0.0 110.335 172.42 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.617 ' HB3' ' O ' ' A' 1028 ' ' LYS . 3.9 tp10 -111.54 142.15 44.2 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.547 ' CE3' ' HG2' ' A' 1025 ' ' ARG . 75.7 m95 -76.3 138.56 40.6 Favored 'General case' 0 C--N 1.298 -1.663 0 C-N-CA 118.014 -1.474 . . . . 0.0 111.106 170.234 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 976' ' ' GLU . . . . . 0.46 ' CG ' ' HB3' ' A' 1026 ' ' LYS . 4.2 pt-20 -108.92 -34.66 6.57 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 977' ' ' ASP . . . . . 0.425 ' HB3' ' HG3' ' A' 1025 ' ' ARG . 5.5 t0 -87.16 159.39 18.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 175.11 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -89.58 -31.99 17.33 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.647 -172.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -157.14 170.28 22.86 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 -174.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.555 ' HA ' ' O ' ' A' 1024 ' ' VAL . 23.6 m95 -94.73 110.07 21.96 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 175.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 50.0 m -124.57 158.94 31.8 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -178.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 982' ' ' TYR . . . . . 0.459 ' HA ' ' O ' ' A' 1022 ' ' ARG . 6.6 p90 -74.65 144.82 43.65 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -167.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -95.53 120.95 36.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.217 -176.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.45 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.6 pp -105.62 9.4 9.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.907 -177.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -94.46 39.68 1.09 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.793 1.282 . . . . 0.0 107.921 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.419 HH21 ' CD ' ' A' ' 994' ' ' GLU . 57.6 mtp85 -145.47 176.88 9.26 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -175.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -77.86 85.5 4.12 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 174.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.45 HG21 ' HA ' ' A' ' 984' ' ' ILE . 20.5 m -127.08 -173.34 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.933 -178.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -96.7 -174.15 2.93 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -66.22 -34.01 77.06 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.42 0.628 . . . . 0.0 109.404 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -91.31 6.12 46.55 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.124 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 992' ' ' GLY . . . . . 0.445 ' HA2' ' HB ' ' A' ' 988' ' ' VAL . . . 67.35 80.34 0.2 Allowed Glycine 0 C--O 1.215 -1.089 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -179.681 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.511 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 98.2 m95 -151.98 145.25 24.69 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.474 ' HB2' ' HB3' ' A' 1008 ' ' TRP . 4.9 pt-20 -119.4 157.29 28.5 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 122.33 1.062 . . . . 0.0 113.83 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.754 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 6.8 t80 -74.21 101.84 4.11 Favored 'General case' 0 C--O 1.209 -1.067 0 C-N-CA 128.686 2.795 . . . . 0.0 112.689 -173.36 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 996' ' ' GLY . . . . . 0.413 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -119.82 111.7 2.07 Favored Glycine 0 N--CA 1.434 -1.479 0 C-N-CA 119.63 -1.271 . . . . 0.0 111.299 173.382 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.608 HG22 ' HA ' ' A' 1016 ' ' HIS . 10.3 pt -121.54 145.12 28.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 175.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 13.6 t -139.04 140.39 38.09 Favored 'General case' 0 N--CA 1.425 -1.711 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 176.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.474 ' O ' HD12 ' A' ' 999' ' ' ILE . 2.3 pp -107.38 130.23 23.14 Favored Pre-proline 0 C--N 1.306 -1.306 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.087 -179.34 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 55.9 Cg_endo -71.69 139.98 34.88 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.345 2.03 . . . . 0.0 112.815 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1001 ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 5.7 Cg_endo -92.85 156.63 19.99 Favored 'Cis proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.747 -1.772 . . . . 0.0 112.028 -3.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 12.3 t70 -168.77 -93.98 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.001 175.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 167.83 -75.64 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.5 0 C-N-CA 125.057 1.343 . . . . 0.0 109.335 -177.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -129.14 141.06 40.48 Favored Pre-proline 0 C--N 1.317 -0.823 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -171.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.442 ' HG2' ' HB2' ' A' 1018 ' ' HIS . 80.4 Cg_exo -54.45 143.66 65.72 Favored 'Trans proline' 0 CA--C 1.511 -0.628 0 C-N-CA 123.326 2.684 . . . . 0.0 110.3 167.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 43.9 mmtt -106.16 -45.23 4.37 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 -176.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 14.4 m -97.35 144.69 26.86 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 112.624 -2.08 . . . . 0.0 111.359 -169.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.725 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 66.0 m95 -135.22 136.09 41.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.797 1.239 . . . . 0.0 107.862 -178.211 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.541 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 57.4 t -146.77 173.39 2.64 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.745 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -172.147 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1010 ' ' ALA . . . . . 0.448 ' N ' HG12 ' A' 1009 ' ' VAL . . . -78.91 -18.79 53.26 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -177.132 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -92.9 107.68 19.41 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -169.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.434 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 18.2 tp10 -72.19 121.59 19.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.914 0.864 . . . . 0.0 109.78 171.25 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.455 ' H ' ' CE1' ' A' 1016 ' ' HIS . 28.6 mtpp -124.09 152.85 42.24 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.811 -174.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 51.6 ttp -57.34 -37.99 73.41 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 124.212 0.945 . . . . 0.0 112.4 178.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -72.55 19.76 0.08 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.754 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.9 OUTLIER -69.77 175.07 4.52 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-O 122.174 0.987 . . . . 0.0 112.473 174.914 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 1017 ' ' THR . . . . . 0.662 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.7 OUTLIER -158.52 -35.44 0.07 Allowed 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 113.307 -1.77 . . . . 0.0 109.102 -172.924 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 1018 ' ' HIS . . . . . 0.442 ' HB2' ' HG2' ' A' 1005 ' ' PRO . 0.2 OUTLIER -138.58 147.48 43.05 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.72 -178.675 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 1019 ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 937' ' ' ASN . 40.3 ttp180 -145.91 143.7 29.72 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 177.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.73 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.6 ptp180 -150.88 165.92 32.14 Favored 'General case' 0 C--O 1.2 -1.502 0 O-C-N 123.881 0.738 . . . . 0.0 109.362 176.259 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.7 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.1 ptt180 -144.59 148.55 34.51 Favored 'General case' 0 C--N 1.295 -1.788 0 O-C-N 123.613 0.57 . . . . 0.0 110.693 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.541 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 37.2 ttm180 -84.48 119.48 25.2 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 123.924 0.765 . . . . 0.0 110.254 178.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.415 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 69.4 mt -97.99 126.64 43.49 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 168.056 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.555 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 11.1 m -104.75 143.55 16.02 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.656 0 CA-C-O 121.01 0.433 . . . . 0.0 111.716 -174.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.547 ' HG2' ' CE3' ' A' ' 975' ' ' TRP . 0.5 OUTLIER -148.09 113.66 5.66 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.133 167.797 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.639 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.5 tmtp? -77.56 154.09 32.71 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 177.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 11.4 ptm180 -142.37 153.21 43.6 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 -176.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.617 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 36.3 ttmt -142.08 136.64 30.34 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 -172.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.689 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.0 ttmt -90.23 -24.65 20.9 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 123.057 1.408 . . . . 0.0 107.586 -177.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1030 ' ' ASP . . . . . 0.466 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 16.2 t0 54.7 12.33 0.55 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 112.23 -2.259 . . . . 0.0 111.043 -170.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 19.0 tp 66.71 -42.18 0.4 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.339 2.256 . . . . 0.0 112.229 -176.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 14.9 p -97.61 30.49 2.91 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -175.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.555 ' CD ' ' HB2' ' A' ' 974' ' ' GLU . 4.3 mm100 . . . . . 0 N--CA 1.472 0.638 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.304 173.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 927' ' ' HIS . . . . . 0.442 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 16.8 m-70 . . . . . 0 CA--C 1.506 -0.718 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.64 120.75 5.27 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 101.71 -3.441 . . . . 0.0 101.71 165.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.531 ' HG3' ' HE2' ' A' 1026 ' ' LYS . 0.5 OUTLIER -145.27 150.26 36.34 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 176.18 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.571 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.1 t80 -143.21 140.13 30.58 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 175.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 27.8 m -77.91 127.78 32.91 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.789 -0.764 . . . . 0.0 109.886 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -96.55 149.34 21.87 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 104.627 -2.361 . . . . 0.0 104.627 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -150.03 151.49 33.36 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 118.694 0.679 . . . . 0.0 110.721 -172.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.583 HG22 ' H ' ' A' ' 935' ' ' TYR . 9.8 p -147.8 -178.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 N-CA-C 105.026 -2.213 . . . . 0.0 105.026 176.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.583 ' H ' HG22 ' A' ' 934' ' ' VAL . 77.0 m-85 -141.13 151.12 43.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.678 ' O ' ' HA ' ' A' 1020 ' ' ARG . 32.6 tt0 -119.74 113.47 20.68 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 -174.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -105.0 147.13 28.13 Favored 'General case' 0 C--N 1.313 -1.012 0 O-C-N 123.679 0.612 . . . . 0.0 110.684 -176.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.639 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 41.7 mt-10 -142.88 159.43 42.24 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 170.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 939' ' ' SER . . . . . 0.675 ' HB3' ' CD2' ' A' 1018 ' ' HIS . 12.8 p -141.7 145.81 35.32 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' 1017 ' ' THR . 22.9 ptt180 -148.36 161.44 41.56 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 124.59 1.156 . . . . 0.0 107.949 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -67.28 158.21 82.61 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 172.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.96 88.95 0.07 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 121.656 1.571 . . . . 0.0 111.16 174.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 103.07 71.06 0.86 Allowed Glycine 0 N--CA 1.43 -1.712 0 N-CA-C 108.153 -1.979 . . . . 0.0 108.153 -175.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.04 -146.75 4.81 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.731 -174.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -129.79 132.23 46.46 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 124.475 1.11 . . . . 0.0 110.311 -176.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.639 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 40.9 m95 -76.13 151.91 36.86 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 121.792 0.806 . . . . 0.0 112.052 -173.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -143.79 153.13 57.36 Favored Pre-proline 0 C--N 1.307 -1.271 0 N-CA-C 103.807 -2.664 . . . . 0.0 103.807 176.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -49.2 126.26 15.14 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.667 2.244 . . . . 0.0 112.626 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -75.61 23.87 0.12 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -171.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 79.3 -61.03 0.34 Allowed 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.738 1.615 . . . . 0.0 109.196 177.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -100.88 73.74 1.58 Allowed 'General case' 0 N--CA 1.415 -2.199 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 25.4 m -63.1 -60.42 3.46 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.414 -173.097 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 953' ' ' TYR . . . . . 0.564 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 68.4 m-85 -93.49 123.28 36.69 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 119.661 -0.816 . . . . 0.0 111.265 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 15.6 p -142.66 173.88 11.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 113.962 -1.472 . . . . 0.0 110.702 -170.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 955' ' ' ASP . . . . . 0.475 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 13.0 t70 -92.42 170.07 10.06 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 104.854 -2.276 . . . . 0.0 104.854 170.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.99 -30.89 27.03 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 118.591 0.632 . . . . 0.0 111.526 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -91.44 8.44 36.32 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 89.35 -7.49 81.9 Favored Glycine 0 CA--C 1.503 -0.718 0 C-N-CA 120.14 -1.029 . . . . 0.0 114.033 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 959' ' ' ASP . . . . . 0.475 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 20.3 t70 -52.89 101.76 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 172.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -54.9 125.86 22.01 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.885 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -125.76 175.86 7.33 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.741 -177.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 962' ' ' ALA . . . . . 0.595 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -70.38 160.23 32.7 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 963' ' ' SER . . . . . 0.41 ' HB3' ' HD2' ' A' ' 964' ' ' PRO . 7.2 m -89.23 159.93 43.79 Favored Pre-proline 0 N--CA 1.427 -1.624 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.62 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.4 Cg_exo -47.66 -28.94 10.02 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.184 3.256 . . . . 0.0 116.771 -174.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 25.0 m -76.32 -43.17 42.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 119.041 0.837 . . . . 0.0 109.79 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 966' ' ' GLU . . . . . 0.595 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 35.5 mt-10 -64.9 -30.08 71.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.056 176.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.443 HD13 ' CH2' ' A' ' 980' ' ' TRP . 77.5 mt -72.34 114.42 10.44 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.909 176.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 41.6 p -121.34 170.33 9.72 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.622 -175.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 5.1 p -87.16 141.52 32.99 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 121.076 0.465 . . . . 0.0 111.356 178.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.595 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 27.8 Cg_endo -87.49 166.4 7.73 Favored 'Trans proline' 0 C--O 1.242 0.713 0 C-N-CA 122.437 2.092 . . . . 0.0 111.256 176.457 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.23 108.56 0.99 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 121.617 1.545 . . . . 0.0 110.292 173.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.688 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 115.53 5.67 18.45 Favored Glycine 0 N--CA 1.44 -1.057 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.874 -176.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.595 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 93.7 m95 -138.98 136.56 35.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 117.784 0.792 . . . . 0.0 111.937 178.005 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.511 ' HB3' ' O ' ' A' 1028 ' ' LYS . 4.8 tp10 -116.19 134.05 55.35 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 125.635 1.574 . . . . 0.0 107.706 -174.027 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.676 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 81.0 m95 -79.66 104.74 10.46 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 118.885 -1.126 . . . . 0.0 109.528 173.598 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -75.84 -42.61 49.16 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.83 143.0 55.98 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.74 -38.21 73.51 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -175.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.03 152.19 7.47 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 120.593 0.235 . . . . 0.0 110.392 -173.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.622 ' HA ' ' O ' ' A' 1024 ' ' VAL . 40.4 m95 -65.5 113.83 4.44 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 1.5 p -122.65 159.78 27.17 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -171.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 17.1 p90 -74.38 141.18 45.14 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 119.515 1.052 . . . . 0.0 111.205 -174.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.438 ' HB3' ' HB3' ' A' 1022 ' ' ARG . 7.8 t70 -81.56 120.8 25.51 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.701 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 12.6 pt -126.37 42.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -110.59 6.35 21.78 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 113.882 -1.508 . . . . 0.0 107.665 -172.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.513 ' HD3' ' NH1' ' A' 1022 ' ' ARG . 52.2 mtm180 -136.06 -176.25 4.25 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.534 -171.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.27 80.5 3.04 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.996 174.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.491 HG11 ' NH2' ' A' ' 986' ' ' ARG . 22.1 m -135.7 162.04 37.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.016 -174.591 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -56.13 173.48 0.16 Allowed 'General case' 0 N--CA 1.468 0.466 0 O-C-N 124.526 1.142 . . . . 0.0 111.207 172.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -53.28 -35.57 60.22 Favored 'General case' 0 CA--C 1.493 -1.246 0 C-N-CA 123.689 0.796 . . . . 0.0 111.671 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 991' ' ' LYS . . . . . 0.466 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 75.6 mmtt -106.46 12.91 29.13 Favored 'General case' 0 N--CA 1.417 -2.101 0 C-N-CA 118.878 -1.129 . . . . 0.0 111.805 -175.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 92.84 -11.46 72.05 Favored Glycine 0 CA--C 1.504 -0.648 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 174.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.509 ' CD2' ' HD2' ' A' 1019 ' ' ARG . 83.1 m95 -54.37 133.29 45.28 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 122.272 1.034 . . . . 0.0 111.848 177.659 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.706 ' HG2' ' O ' ' A' 1020 ' ' ARG . 5.5 pt-20 -117.82 152.04 36.14 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.579 -1.192 . . . . 0.0 109.864 -178.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.726 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 43.2 t80 -69.4 90.99 0.54 Allowed 'General case' 0 C--O 1.201 -1.451 0 CA-C-N 112.43 -2.168 . . . . 0.0 110.862 -175.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 996' ' ' GLY . . . . . 0.614 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -114.18 79.91 0.28 Allowed Glycine 0 N--CA 1.436 -1.361 0 C-N-CA 118.952 -1.594 . . . . 0.0 111.874 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 997' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -92.88 149.56 4.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 C-N-CA 117.123 -1.831 . . . . 0.0 108.355 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 36.9 m -124.71 98.02 5.54 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.758 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 22.2 pt -74.55 130.32 82.05 Favored Pre-proline 0 C--N 1.319 -0.728 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.479 176.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 55.3 Cg_endo -70.51 141.56 42.5 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.914 2.409 . . . . 0.0 113.071 -179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1001 ' ' PRO . . . . . 0.427 ' O ' ' HB2' ' A' 1002 ' ' ASP . 7.4 Cg_endo -91.29 149.84 18.27 Favored 'Cis proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.406 -1.497 . . . . 0.0 111.534 -2.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1002 ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' 1001 ' ' PRO . 2.6 t70 163.69 160.55 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.987 0 O-C-N 124.972 1.42 . . . . 0.0 107.509 -177.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 16.2 p80 -134.61 33.88 3.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.314 0.578 . . . . 0.0 109.7 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 88.3 mttt -158.82 123.54 2.22 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.807 -174.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.465 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 33.4 Cg_exo -71.51 133.11 21.75 Favored 'Trans proline' 0 C--O 1.239 0.543 0 C-N-CA 122.278 1.985 . . . . 0.0 110.476 168.059 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 54.2 mmtt -94.27 -49.61 5.64 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 10.3 t -92.08 148.94 21.79 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.243 -177.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.669 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 58.0 m95 -138.37 137.54 37.41 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 176.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.672 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 33.0 t -144.42 169.78 8.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -172.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1010 ' ' ALA . . . . . 0.419 ' N ' HG12 ' A' 1009 ' ' VAL . . . -79.65 -12.96 59.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -179.217 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -91.81 109.42 20.74 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -174.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.547 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 1.0 OUTLIER -81.85 105.11 12.71 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 172.88 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.508 ' H ' ' CE1' ' A' 1016 ' ' HIS . 61.3 mtpt -107.83 161.92 14.47 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.246 -1.343 . . . . 0.0 112.123 -176.25 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 57.0 ttp -55.15 -44.53 75.21 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.245 -0.889 . . . . 0.0 113.158 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -72.73 18.09 0.1 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.726 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.8 OUTLIER -67.24 114.48 6.0 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.668 172.258 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 1017 ' ' THR . . . . . 0.447 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.0 OUTLIER -93.11 -25.27 17.96 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 122.8 1.286 . . . . 0.0 108.173 176.239 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 1018 ' ' HIS . . . . . 0.675 ' CD2' ' HB3' ' A' ' 939' ' ' SER . 46.2 m80 -141.75 150.5 41.85 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.879 -1.509 . . . . 0.0 109.937 178.659 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1019 ' ' ARG . . . . . 0.509 ' HD2' ' CD2' ' A' ' 993' ' ' TRP . 31.2 ptt180 -141.94 148.84 39.31 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 171.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.706 ' O ' ' HG2' ' A' ' 994' ' ' GLU . 37.7 ttp180 -152.61 165.51 34.97 Favored 'General case' 0 C--N 1.283 -2.283 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 29.0 ptt180 -155.35 159.26 39.8 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 178.213 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.513 ' NH1' ' HD3' ' A' ' 986' ' ' ARG . 38.6 ttm180 -86.46 132.81 33.84 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 45.6 mt -102.35 129.34 48.77 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 104.663 -2.347 . . . . 0.0 104.663 166.559 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.622 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 20.1 m -109.64 141.92 23.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.495 -171.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.502 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.9 tpt180 -141.12 98.52 3.39 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 114.048 -1.433 . . . . 0.0 107.945 172.299 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.531 ' HE2' ' HG3' ' A' ' 929' ' ' GLU . 0.3 OUTLIER -71.62 134.76 46.59 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 -177.55 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.676 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.3 ptm180 -128.68 143.15 50.87 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -172.375 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.511 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.0 ttmt -137.89 139.28 39.76 Favored 'General case' 0 C--N 1.283 -2.307 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -172.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.688 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 32.4 ttmt -91.49 -17.52 25.57 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 123.737 1.732 . . . . 0.0 107.561 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1030 ' ' ASP . . . . . 0.442 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 21.5 t70 53.02 8.99 0.11 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 111.37 -2.65 . . . . 0.0 112.48 -169.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 22.9 tp 69.4 -33.46 0.25 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.207 1.803 . . . . 0.0 111.75 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1032 ' ' THR . . . . . 0.414 ' H ' ' C ' ' A' 1030 ' ' ASP . 12.6 t -79.03 -3.48 45.36 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -175.249 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 . . . . . 0 C--N 1.326 -0.428 0 C-N-CA 119.84 -0.744 . . . . 0.0 111.012 177.675 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 927' ' ' HIS . . . . . 0.458 ' HA ' ' O ' ' A' 1030 ' ' ASP . 13.6 m-70 . . . . . 0 CA--C 1.5 -0.978 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.15 108.99 1.94 Allowed 'General case' 0 N--CA 1.412 -2.35 0 N-CA-C 101.428 -3.545 . . . . 0.0 101.428 169.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.3 OUTLIER -137.39 144.57 42.52 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 178.233 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.497 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.8 t80 -137.39 138.06 39.48 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 105.888 -1.893 . . . . 0.0 105.888 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.632 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 26.9 m -74.08 129.98 38.9 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 176.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 932' ' ' ASP . . . . . 0.535 ' HB2' ' HD2' ' A' 1027 ' ' ARG . 4.6 t70 -102.34 156.26 17.7 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.528 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.0 pt-20 -150.53 153.64 36.16 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.155 0.502 . . . . 0.0 111.324 -172.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.524 ' O ' ' HA ' ' A' 1022 ' ' ARG . 9.4 p -146.53 179.01 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 N-CA-C 106.182 -1.784 . . . . 0.0 106.182 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.52 ' HA ' ' O ' ' A' 1021 ' ' ARG . 28.3 m-85 -144.07 113.95 7.25 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 119.653 1.115 . . . . 0.0 111.297 -174.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 936' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -81.36 132.78 35.35 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 123.57 0.544 . . . . 0.0 110.211 172.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 937' ' ' ASN . . . . . 0.481 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 27.6 m-80 -121.55 155.85 34.13 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 124.385 1.074 . . . . 0.0 113.116 -176.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.678 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 42.4 mt-10 -142.29 152.82 43.36 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 105.252 -2.129 . . . . 0.0 105.252 169.197 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 34.5 m -128.59 144.83 51.23 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 123.488 0.492 . . . . 0.0 111.018 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.493 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 20.7 ptt180 -149.92 161.75 41.68 Favored 'General case' 0 N--CA 1.433 -1.299 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -176.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -66.18 163.15 40.97 Favored Pre-proline 0 C--N 1.312 -1.023 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 172.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -66.64 90.41 0.28 Allowed 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 121.32 1.347 . . . . 0.0 111.271 177.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 97.15 72.19 1.09 Allowed Glycine 0 N--CA 1.434 -1.444 0 N-CA-C 107.88 -2.088 . . . . 0.0 107.88 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.67 -152.57 6.94 Favored Glycine 0 N--CA 1.44 -1.061 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.769 -174.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -108.38 136.29 48.27 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.377 -0.912 . . . . 0.0 109.54 -177.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.678 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 44.8 m95 -85.29 145.81 27.35 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-O 121.782 0.801 . . . . 0.0 109.486 -178.049 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -127.53 169.11 13.08 Favored Pre-proline 0 C--N 1.298 -1.665 0 N-CA-C 104.232 -2.507 . . . . 0.0 104.232 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -57.68 124.24 15.59 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 121.497 1.464 . . . . 0.0 109.599 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.04 10.7 0.05 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -174.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 79.4 -51.39 0.42 Allowed 'General case' 0 CA--C 1.481 -1.691 0 C-N-CA 124.533 1.133 . . . . 0.0 109.577 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -113.22 94.57 4.94 Favored 'General case' 0 N--CA 1.402 -2.84 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.1 m -72.89 -56.94 4.47 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.216 -173.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -94.92 122.4 37.53 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-O 122.164 0.983 . . . . 0.0 111.694 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 77.4 p -137.77 173.09 12.01 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.503 -173.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -95.85 172.63 7.9 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 171.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.96 -32.37 45.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 119.286 0.948 . . . . 0.0 110.843 174.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -80.39 -2.33 45.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.606 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 89.52 -9.12 78.23 Favored Glycine 0 CA--C 1.496 -1.108 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.843 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -51.8 103.44 0.06 Allowed 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 124.532 0.784 . . . . 0.0 110.733 175.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -51.86 121.91 7.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.444 -1.253 . . . . 0.0 108.472 177.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -123.32 -172.95 2.62 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.177 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -82.97 162.15 21.56 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 963' ' ' SER . . . . . 0.462 ' HB3' ' HD2' ' A' ' 964' ' ' PRO . 3.8 m -88.61 157.63 49.33 Favored Pre-proline 0 N--CA 1.43 -1.429 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.662 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 6.9 Cg_exo -43.03 -32.46 2.8 Favored 'Trans proline' 0 CA--C 1.542 0.884 1 C-N-CA 125.607 4.204 . . . . 0.0 117.901 -174.81 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 19.9 m -86.64 -35.25 19.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 122.194 0.997 . . . . 0.0 108.951 -176.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -72.96 -12.14 60.83 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.31 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 28.2 mt -89.35 110.36 21.17 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 21.1 p -114.25 -172.01 2.02 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.921 -174.372 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.588 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 15.4 p -114.96 129.49 25.01 Favored Pre-proline 0 C--N 1.317 -0.825 0 O-C-N 121.96 -0.463 . . . . 0.0 111.172 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.612 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 72.8 Cg_endo -70.69 169.82 19.19 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 123.213 2.609 . . . . 0.0 110.826 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -48.09 -33.56 21.28 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.887 2.391 . . . . 0.0 113.659 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.642 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -110.61 34.01 5.61 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-O 119.233 -0.76 . . . . 0.0 113.76 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.612 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 61.0 m95 -146.24 141.13 27.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.922 0.861 . . . . 0.0 110.878 169.192 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.6 ' HB3' ' O ' ' A' 1028 ' ' LYS . 7.5 tp10 -125.56 147.83 49.13 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 -176.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.467 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 63.6 m95 -75.91 143.54 41.62 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 122.237 1.018 . . . . 0.0 112.875 175.313 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 976' ' ' GLU . . . . . 0.623 ' HG2' ' HB3' ' A' 1028 ' ' LYS . 2.4 mm-40 -109.41 -44.38 3.91 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.564 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -91.51 159.13 16.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.137 -170.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.22 -52.81 60.73 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.067 0.947 . . . . 0.0 112.889 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -162.92 160.27 24.68 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 -173.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.662 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 23.8 m95 -75.38 116.8 16.48 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 20.8 m -125.15 159.91 30.37 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 -175.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -74.98 134.86 41.39 Favored 'General case' 0 C--N 1.298 -1.634 0 C-N-CA 119.34 -0.944 . . . . 0.0 110.629 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.513 ' HB2' HG13 ' A' 1024 ' ' VAL . 39.7 t0 -82.01 124.78 30.09 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.36 -176.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.0 pp -121.89 11.97 5.87 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 121.71 0.767 . . . . 0.0 110.516 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -87.54 23.26 1.97 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.396 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 986' ' ' ARG . 37.8 mtp-105 -146.47 -176.82 5.33 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.151 -174.112 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.38 83.72 7.39 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.49 HG12 ' HG2' ' A' ' 994' ' ' GLU . 27.6 m -135.37 160.49 40.22 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.745 -178.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -55.3 169.11 0.29 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.102 0.561 . . . . 0.0 110.006 169.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -59.62 -33.03 70.97 Favored 'General case' 0 CA--C 1.503 -0.842 0 O-C-N 122.012 -0.43 . . . . 0.0 111.64 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -95.36 4.15 53.68 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 119.851 -0.74 . . . . 0.0 111.046 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.07 -21.79 40.42 Favored Glycine 0 C--O 1.223 -0.571 0 CA-C-N 116.575 -0.284 . . . . 0.0 112.827 175.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.519 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 81.8 m95 -50.92 121.88 6.65 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.49 ' HG2' HG12 ' A' ' 988' ' ' VAL . 19.2 mt-10 -98.96 149.45 22.96 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.556 0.694 . . . . 0.0 110.185 177.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.688 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 55.5 t80 -76.5 87.06 3.22 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 126.304 1.842 . . . . 0.0 109.963 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 996' ' ' GLY . . . . . 0.614 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -112.86 91.44 0.59 Allowed Glycine 0 CA--C 1.485 -1.81 0 C-N-CA 119.966 -1.111 . . . . 0.0 110.359 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.557 HG22 ' HA ' ' A' 1016 ' ' HIS . 9.5 pt -104.48 151.14 7.07 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.521 -175.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.6 t -137.42 135.85 37.29 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 172.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 62.7 mt -117.44 106.21 47.05 Favored Pre-proline 0 C--N 1.313 -0.995 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 20.5 Cg_endo -61.94 137.74 69.29 Favored 'Trans proline' 0 C--O 1.241 0.634 0 C-N-CA 122.618 2.212 . . . . 0.0 112.873 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1001 ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 5.4 Cg_endo -82.9 141.85 44.76 Favored 'Cis proline' 0 N--CA 1.45 -1.06 0 C-N-CA 122.756 -1.768 . . . . 0.0 113.336 0.236 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 28.8 t70 -158.36 -98.62 0.03 OUTLIER 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 112.634 -2.076 . . . . 0.0 108.626 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 9.8 p80 164.08 -45.78 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.719 1.262 . . . . 0.0 113.189 175.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 52.9 mttp -164.86 141.58 4.91 Favored Pre-proline 0 CA--C 1.51 -0.579 0 N-CA-C 106.033 -1.839 . . . . 0.0 106.033 -169.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.42 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 68.1 Cg_exo -50.16 122.33 9.09 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 121.246 1.297 . . . . 0.0 111.409 173.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1006 ' ' LYS . . . . . 0.407 ' H ' ' HG2' ' A' 1006 ' ' LYS . 37.6 pttt -107.2 5.5 27.78 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.784 -175.267 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1007 ' ' SER . . . . . 0.458 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 44.7 t -141.63 138.47 32.57 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -176.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.637 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 49.1 m95 -135.39 135.55 40.73 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.569 ' HB ' ' HB3' ' A' ' 995' ' ' TYR . 81.6 t -143.27 166.37 14.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -172.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -88.63 10.05 21.97 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -122.18 130.97 53.7 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 119.091 0.859 . . . . 0.0 112.927 -175.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.582 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 19.1 tp10 -79.09 112.67 16.52 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 122.064 0.935 . . . . 0.0 108.876 175.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.484 ' H ' ' CE1' ' A' 1016 ' ' HIS . 45.0 mttp -125.11 158.91 32.7 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.929 -1.487 . . . . 0.0 110.7 -175.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 45.0 ttp -53.95 -43.74 70.1 Favored 'General case' 0 C--N 1.311 -1.094 0 O-C-N 124.241 0.963 . . . . 0.0 112.952 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -49.7 -11.19 0.05 Allowed 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 175.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.688 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 16.8 m80 -58.93 154.4 15.38 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.86 1.314 . . . . 0.0 112.007 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -160.31 -34.45 0.05 Allowed 'General case' 0 C--N 1.286 -2.161 0 CA-C-N 111.141 -2.754 . . . . 0.0 105.765 -168.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.97 153.0 46.76 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 113.097 -1.865 . . . . 0.0 108.311 174.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1019 ' ' ARG . . . . . 0.519 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 40.9 ptt180 -160.1 152.57 20.94 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 173.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.551 ' HG2' ' CZ3' ' A' 1008 ' ' TRP . 4.0 ptp180 -152.29 148.64 27.78 Favored 'General case' 0 CA--C 1.486 -1.492 0 C-N-CA 118.352 -1.339 . . . . 0.0 110.309 177.511 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.9 ptt180 -124.65 140.63 52.76 Favored 'General case' 0 C--N 1.293 -1.873 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.927 -177.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.528 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 38.7 ttm180 -81.07 123.12 28.12 Favored 'General case' 0 N--CA 1.422 -1.853 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.725 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 77.2 mt -95.8 127.01 41.46 Favored 'General case' 0 N--CA 1.422 -1.827 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 168.524 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.513 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.1 m -106.55 139.6 27.44 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.386 -174.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.531 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.7 tpt180 -143.19 101.4 3.8 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.186 -1.37 . . . . 0.0 107.845 171.166 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.632 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -71.44 147.46 47.84 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.214 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.535 ' HD2' ' HB2' ' A' ' 932' ' ' ASP . 12.1 ptm180 -140.91 151.46 44.27 Favored 'General case' 0 C--O 1.206 -1.213 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -172.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.827 ' HG2' ' H ' ' A' 1030 ' ' ASP . 30.4 ttmt -138.24 140.26 39.59 Favored 'General case' 0 C--O 1.197 -1.705 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 -174.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 29.3 ttmt -88.92 -4.47 58.45 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.844 0.831 . . . . 0.0 109.557 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1030 ' ' ASP . . . . . 0.827 ' H ' ' HG2' ' A' 1028 ' ' LYS . 2.1 t70 83.15 -68.6 0.06 Allowed 'General case' 0 CA--C 1.498 -1.055 0 CA-C-N 113.041 -1.891 . . . . 0.0 106.25 -173.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1031 ' ' LEU . . . . . 0.438 ' HB2' ' HA ' ' A' ' 927' ' ' HIS . 34.0 tp 149.9 -29.2 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.706 0 O-C-N 127.171 2.795 . . . . 0.0 108.584 173.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 25.6 p -114.67 14.08 17.5 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.675 0.75 . . . . 0.0 111.218 -170.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.528 ' HB2' ' O ' ' A' 1029 ' ' LYS . 29.5 tt0 . . . . . 0 N--CA 1.445 -0.703 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.278 -177.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.487 -1.475 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.4 116.42 32.6 Favored 'General case' 0 N--CA 1.409 -2.495 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 163.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.717 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.5 OUTLIER -126.55 132.24 51.38 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 179.874 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.48 ' O ' ' HG2' ' A' 1027 ' ' ARG . 87.4 t80 -124.52 139.17 54.13 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 20.5 m -74.19 123.39 24.4 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -97.82 150.31 21.41 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 105.048 -2.205 . . . . 0.0 105.048 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.553 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 9.1 pt-20 -143.66 146.89 33.57 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 118.622 0.647 . . . . 0.0 110.899 -175.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.524 HG22 ' H ' ' A' ' 935' ' ' TYR . 11.2 p -135.45 174.72 12.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.58 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 59.5 m-85 -135.54 146.38 47.98 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 118.674 0.67 . . . . 0.0 110.54 -175.527 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.587 ' O ' ' HA ' ' A' 1020 ' ' ARG . 53.2 mt-30 -112.87 116.57 30.23 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 124.567 1.167 . . . . 0.0 108.072 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -101.95 137.64 39.96 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 121.957 0.884 . . . . 0.0 112.312 -177.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 948' ' ' PRO . 29.3 mt-10 -138.43 150.48 46.54 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 113.261 -1.791 . . . . 0.0 106.619 170.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 47.1 t -144.4 154.91 43.47 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.132 -169.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.516 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 36.6 ptt180 -141.83 157.38 45.08 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.319 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -75.91 172.94 8.03 Favored Pre-proline 0 C--N 1.305 -1.353 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -66.73 48.74 0.29 Allowed 'Trans proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.99 2.46 . . . . 0.0 112.259 171.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 943' ' ' GLY . . . . . 0.586 ' HA2' ' SD ' ' A' 1014 ' ' MET . . . 155.98 37.15 0.02 OUTLIER Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.537 -176.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 944' ' ' GLY . . . . . 0.516 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -132.62 -173.39 13.29 Favored Glycine 0 CA--C 1.499 -0.949 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -120.14 165.92 14.12 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 174.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.526 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 34.3 m95 -72.56 124.52 25.4 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-O 121.15 0.5 . . . . 0.0 110.306 -173.017 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -124.97 159.7 57.75 Favored Pre-proline 0 C--N 1.304 -1.388 0 N-CA-C 104.411 -2.44 . . . . 0.0 104.411 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.558 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 88.4 Cg_exo -49.08 138.85 27.42 Favored 'Trans proline' 0 CA--C 1.527 0.152 0 C-N-CA 122.226 1.951 . . . . 0.0 112.493 -178.131 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -76.78 -161.78 0.22 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.585 -178.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -95.84 -38.24 10.38 Favored 'General case' 0 CA--C 1.481 -1.679 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 951' ' ' ASP . . . . . 0.714 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 27.8 m-20 -116.45 100.71 8.06 Favored 'General case' 0 N--CA 1.404 -2.726 0 N-CA-C 104.588 -2.375 . . . . 0.0 104.588 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 7.4 m -60.03 -56.78 17.49 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 123.689 0.618 . . . . 0.0 111.421 -172.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 953' ' ' TYR . . . . . 0.58 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 92.8 m-85 -103.86 135.3 45.65 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-O 121.455 0.645 . . . . 0.0 111.56 -179.234 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 76.7 p -148.98 -176.05 5.19 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -174.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -106.19 -174.22 2.48 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 173.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.6 -31.05 34.46 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 175.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -77.72 -50.24 12.8 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.959 -0.463 . . . . 0.0 111.215 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 133.65 -3.02 4.6 Favored Glycine 0 CA--C 1.494 -1.28 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -177.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -58.35 107.3 0.47 Allowed 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.174 -1.013 . . . . 0.0 109.678 175.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 960' ' ' LYS . . . . . 0.714 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 26.2 tptp -47.16 112.69 0.56 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 113.709 -1.587 . . . . 0.0 110.12 175.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -112.68 178.7 4.2 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.279 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 962' ' ' ALA . . . . . 0.497 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -71.48 155.84 40.13 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 963' ' ' SER . . . . . 0.402 ' HB2' ' HD2' ' A' ' 964' ' ' PRO . 5.9 p -77.81 162.43 67.82 Favored Pre-proline 0 N--CA 1.434 -1.256 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.077 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.415 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 10.3 Cg_endo -58.61 -25.6 75.52 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.779 2.319 . . . . 0.0 112.559 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 1.2 m -68.35 -49.93 56.74 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 966' ' ' GLU . . . . . 0.497 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 47.4 mt-10 -64.66 -33.92 77.08 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.26 -1.336 . . . . 0.0 112.68 177.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.487 HD13 ' CH2' ' A' ' 980' ' ' TRP . 69.4 mt -67.29 112.16 4.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.811 0.815 . . . . 0.0 111.929 -178.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 21.7 p -117.4 171.19 8.15 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.286 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 19.2 p -87.1 138.54 32.57 Favored Pre-proline 0 C--N 1.319 -0.755 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.637 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.6 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 68.9 Cg_endo -82.88 163.61 15.87 Favored 'Trans proline' 0 C--O 1.243 0.734 0 C-N-CA 122.365 2.043 . . . . 0.0 111.083 178.276 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -61.82 102.98 0.26 Allowed 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 121.928 1.752 . . . . 0.0 110.15 173.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.483 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 127.21 -7.64 7.14 Favored Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.468 -0.873 . . . . 0.0 111.159 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.6 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.6 m95 -136.49 139.8 42.57 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.611 0.72 . . . . 0.0 111.105 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 974' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -123.66 136.9 54.75 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 126.26 1.824 . . . . 0.0 108.539 -173.276 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.632 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 91.3 m95 -84.6 158.73 20.79 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 119.436 1.016 . . . . 0.0 110.724 175.1 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -139.99 -36.78 0.49 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.09 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 977' ' ' ASP . . . . . 0.555 ' HB3' ' HD2' ' A' 1025 ' ' ARG . 9.9 t70 -67.43 150.52 48.8 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.372 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -68.32 -43.72 76.97 Favored 'General case' 0 C--N 1.314 -0.941 0 O-C-N 123.161 0.288 . . . . 0.0 111.577 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.07 159.27 12.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.749 0.309 . . . . 0.0 110.494 -172.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.541 ' HA ' ' O ' ' A' 1024 ' ' VAL . 17.1 m95 -76.43 91.45 3.31 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -177.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 18.5 t -103.45 162.11 13.3 Favored 'General case' 0 C--O 1.205 -1.254 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 982' ' ' TYR . . . . . 0.424 ' HA ' ' O ' ' A' 1022 ' ' ARG . 8.2 p90 -73.55 139.27 45.52 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 121.646 0.736 . . . . 0.0 111.801 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.466 ' HB2' HG13 ' A' 1024 ' ' VAL . 26.2 t70 -99.89 130.88 46.12 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.406 -175.251 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.466 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.4 pp -114.85 18.79 7.4 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.884 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.99 34.3 1.39 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -175.167 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.424 ' HB2' HG13 ' A' ' 988' ' ' VAL . 63.1 mtp180 -145.47 179.91 7.1 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -177.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -81.8 82.09 7.6 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 172.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.466 HG21 ' HA ' ' A' ' 984' ' ' ILE . 18.6 m -128.96 -170.79 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.794 -173.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -96.39 -172.23 2.48 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 105.265 -2.124 . . . . 0.0 105.265 -178.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -58.28 -33.42 69.41 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 122.94 0.496 . . . . 0.0 111.155 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -112.12 23.79 13.33 Favored 'General case' 0 N--CA 1.427 -1.601 0 C-N-CA 118.761 -1.176 . . . . 0.0 112.927 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 90.78 -11.91 70.38 Favored Glycine 0 C--O 1.229 -0.212 0 C-N-CA 120.112 -1.042 . . . . 0.0 112.899 173.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.59 ' HA ' ' HB3' ' A' 1021 ' ' ARG . 94.8 m95 -52.18 143.85 13.61 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 175.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.583 ' O ' ' HG3' ' A' 1019 ' ' ARG . 9.6 pt-20 -130.3 143.28 50.68 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 174.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.556 ' CD2' ' HA ' ' A' 1011 ' ' ALA . 1.4 t80 -104.54 115.96 31.25 Favored 'General case' 0 C--N 1.285 -2.226 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.894 -165.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 996' ' ' GLY . . . . . 0.447 ' HA2' ' O ' ' A' 1007 ' ' SER . . . -132.63 144.76 16.68 Favored Glycine 0 N--CA 1.435 -1.383 0 CA-C-O 122.016 0.787 . . . . 0.0 112.354 -177.648 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.684 ' HA ' ' HA ' ' A' 1016 ' ' HIS . 0.1 OUTLIER -93.24 173.66 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.502 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 998' ' ' THR . . . . . 0.405 ' HG1' ' HG3' ' A' 1005 ' ' PRO . 39.6 m -169.17 98.63 0.36 Allowed 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 104.995 -2.224 . . . . 0.0 104.995 178.398 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.448 ' O ' ' HB2' ' A' 1002 ' ' ASP . 68.0 mt -116.11 108.71 45.66 Favored Pre-proline 0 C--N 1.314 -0.969 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 -175.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.03 140.4 78.63 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 123.38 2.72 . . . . 0.0 113.609 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -76.17 150.28 93.33 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.029 -1.655 . . . . 0.0 111.295 -1.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1002 ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.5 t70 -172.15 -153.69 0.08 Allowed 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.14 -0.936 . . . . 0.0 108.899 -172.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.3 m170 -151.87 -82.48 0.09 Allowed 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.44 0.696 . . . . 0.0 110.351 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 80.6 mttt -128.84 154.4 80.05 Favored Pre-proline 0 C--N 1.309 -1.188 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 177.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.405 ' HG3' ' HG1' ' A' ' 998' ' ' THR . 52.4 Cg_exo -55.52 125.34 18.81 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 121.888 1.725 . . . . 0.0 111.305 174.087 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 20.4 pttp -100.06 4.51 44.72 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.313 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1007 ' ' SER . . . . . 0.447 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 48.5 t -142.89 122.99 13.65 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.217 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.488 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 66.8 m95 -122.89 133.15 54.42 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.36 1.464 . . . . 0.0 107.055 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.416 HG23 ' HB3' ' A' ' 995' ' ' TYR . 15.8 m -143.98 -164.98 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -178.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -91.64 -35.31 14.28 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 120.246 1.385 . . . . 0.0 110.045 174.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1011 ' ' ALA . . . . . 0.556 ' HA ' ' CD2' ' A' ' 995' ' ' TYR . . . 171.72 172.66 0.09 Allowed 'General case' 0 CA--C 1.508 -0.64 0 O-C-N 123.81 0.694 . . . . 0.0 111.962 -172.027 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' 1013 ' ' LYS . 10.9 pt-20 160.22 -61.93 0.0 OUTLIER 'General case' 0 C--N 1.345 0.4 0 O-C-N 126.691 2.494 . . . . 0.0 112.626 174.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.431 ' N ' ' HG3' ' A' 1012 ' ' GLU . 59.1 mttp -131.14 149.56 52.54 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -165.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1014 ' ' MET . . . . . 0.586 ' SD ' ' HA2' ' A' ' 943' ' ' GLY . 59.4 ttp -65.02 -23.96 67.36 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.738 -1.574 . . . . 0.0 112.63 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1015 ' ' TYR . . . . . 0.42 ' O ' HG22 ' A' ' 997' ' ' ILE . 60.2 m-85 -61.06 -6.94 2.18 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 175.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.684 ' HA ' ' HA ' ' A' ' 997' ' ' ILE . 46.9 m-70 -90.71 106.08 18.26 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.656 -2.35 . . . . 0.0 104.656 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 17.9 p -100.24 -6.45 26.0 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -169.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -129.45 142.5 50.77 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 122.062 -0.399 . . . . 0.0 110.826 -174.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1019 ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 994' ' ' GLU . 10.4 ttm180 -150.94 146.99 26.63 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 177.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.587 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 3.5 ptp180 -148.55 166.51 28.02 Favored 'General case' 0 C--O 1.199 -1.566 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 177.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.59 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 23.7 ptt180 -146.35 150.85 36.49 Favored 'General case' 0 C--N 1.287 -2.128 0 O-C-N 123.389 0.431 . . . . 0.0 110.005 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.553 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.4 ttm180 -88.91 129.57 35.59 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 123.487 0.492 . . . . 0.0 111.422 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.559 HD21 ' OE1' ' A' ' 936' ' ' GLN . 70.8 mt -104.98 137.71 42.32 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 105.217 -2.142 . . . . 0.0 105.217 165.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.541 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 12.8 m -113.16 141.24 29.52 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 CA-C-O 122.027 0.918 . . . . 0.0 111.958 -176.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.555 ' HD2' ' HB3' ' A' ' 977' ' ' ASP . 11.8 tpt180 -138.7 100.69 4.14 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 113.579 -1.646 . . . . 0.0 106.682 172.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -74.14 146.22 43.67 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -178.186 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.632 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 10.3 ptm180 -142.62 166.65 24.08 Favored 'General case' 0 CA--C 1.493 -1.234 0 N-CA-C 105.842 -1.91 . . . . 0.0 105.842 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.717 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 13.3 ptpt -156.13 155.8 33.16 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-O 121.033 0.445 . . . . 0.0 110.348 -178.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 29.3 ttmt -83.73 -21.65 32.21 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 22.0 t70 44.36 23.51 0.07 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 111.298 -2.683 . . . . 0.0 112.024 -171.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 23.0 tp 66.12 -39.42 0.32 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.097 2.159 . . . . 0.0 113.455 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 9.8 t -69.95 -22.58 63.16 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 123.132 0.573 . . . . 0.0 112.092 -176.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' 1029 ' ' LYS . 18.6 mt-30 . . . . . 0 CA--C 1.509 -0.627 0 C-N-CA 119.018 -1.073 . . . . 0.0 112.489 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 49.4 m-70 . . . . . 0 CA--C 1.488 -1.433 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 928' ' ' THR . . . . . 0.426 ' HB ' ' HE3' ' A' 1029 ' ' LYS . 1.5 m 63.34 87.58 0.11 Allowed 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 124.601 1.188 . . . . 0.0 107.843 -165.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.861 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.4 OUTLIER -102.75 168.19 9.4 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 179.652 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.632 ' O ' ' HG2' ' A' 1027 ' ' ARG . 89.5 t80 -153.98 120.86 5.62 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 10.2 m -79.23 121.64 25.31 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 174.029 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -103.51 146.12 29.01 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 104.944 -2.243 . . . . 0.0 104.944 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.456 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -145.42 147.91 32.74 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 118.331 0.514 . . . . 0.0 110.965 -173.415 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 4.6 p -151.88 134.02 5.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 120.981 0.42 . . . . 0.0 110.085 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' 1021 ' ' ARG . 94.9 m-85 -93.4 152.1 19.33 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -175.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.59 ' HG2' ' CE1' ' A' ' 953' ' ' TYR . 21.5 mt-30 -112.09 113.69 26.1 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 105.434 -2.062 . . . . 0.0 105.434 174.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 937' ' ' ASN . . . . . 0.469 ' HB3' ' HB2' ' A' ' 949' ' ' ALA . 12.2 m-80 -106.34 139.42 40.86 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -176.143 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.61 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 85.3 mt-10 -135.07 152.67 51.89 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 176.779 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 50.5 m -145.34 137.47 25.67 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.163 0.506 . . . . 0.0 111.596 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.549 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 18.3 ptt180 -139.82 161.63 37.11 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 124.446 1.098 . . . . 0.0 108.084 -174.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -65.29 161.56 48.61 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 170.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -66.21 86.73 0.25 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 121.458 1.439 . . . . 0.0 111.912 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 99.85 70.04 0.92 Allowed Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 107.728 -2.149 . . . . 0.0 107.728 -175.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -166.08 -148.04 5.41 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.57 -173.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -110.77 128.4 55.73 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 122.737 0.415 . . . . 0.0 110.984 -176.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.61 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 56.1 m95 -73.53 152.73 40.55 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-O 121.835 0.826 . . . . 0.0 109.695 176.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -133.57 169.18 14.62 Favored Pre-proline 0 C--N 1.3 -1.549 0 N-CA-C 103.452 -2.795 . . . . 0.0 103.452 171.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.2 124.4 16.16 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 N-CA-C 107.959 -1.593 . . . . 0.0 107.959 170.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 949' ' ' ALA . . . . . 0.469 ' HB2' ' HB3' ' A' ' 937' ' ' ASN . . . -37.68 -58.25 0.91 Allowed 'General case' 0 N--CA 1.483 1.215 0 O-C-N 124.877 1.361 . . . . 0.0 113.894 -171.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -168.29 -39.81 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 104.633 -2.358 . . . . 0.0 104.633 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -131.31 160.17 35.75 Favored 'General case' 0 N--CA 1.434 -1.259 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 168.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.0 m -93.65 -57.8 2.46 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 118.205 0.457 . . . . 0.0 110.391 -175.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 953' ' ' TYR . . . . . 0.59 ' CE1' ' HG2' ' A' ' 936' ' ' GLN . 58.3 m-85 -97.46 127.4 43.39 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 122.008 0.909 . . . . 0.0 110.729 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 954' ' ' THR . . . . . 0.495 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 1.1 p -144.0 167.14 23.08 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.31 -170.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -97.63 -173.68 2.7 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 956' ' ' ALA . . . . . 0.494 ' HA ' ' CE1' ' A' ' 935' ' ' TYR . . . -51.25 -27.18 8.54 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 957' ' ' ASN . . . . . 0.563 HD21 ' HB2' ' A' ' 959' ' ' ASP . 23.1 p-10 -92.78 -37.74 12.17 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.293 0.568 . . . . 0.0 111.518 178.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 958' ' ' GLY . . . . . 0.495 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 110.38 52.15 0.6 Allowed Glycine 0 CA--C 1.484 -1.864 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 -173.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 959' ' ' ASP . . . . . 0.563 ' HB2' HD21 ' A' ' 957' ' ' ASN . 17.7 t70 -121.07 106.38 11.51 Favored 'General case' 0 N--CA 1.419 -2.004 0 N-CA-C 100.977 -3.712 . . . . 0.0 100.977 176.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -44.21 123.89 3.67 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 124.926 1.391 . . . . 0.0 112.251 -176.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -121.93 -174.93 2.99 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 113.318 -1.764 . . . . 0.0 108.933 -175.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 962' ' ' ALA . . . . . 0.525 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -71.8 147.88 46.8 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 3.7 m -75.29 158.72 83.5 Favored Pre-proline 0 C--N 1.313 -1.018 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.6 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 29.2 Cg_exo -54.75 -21.49 25.66 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.916 2.411 . . . . 0.0 114.428 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 5.7 p -74.27 -49.44 23.15 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.78 0.8 . . . . 0.0 109.31 175.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 966' ' ' GLU . . . . . 0.525 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 32.6 mt-10 -65.36 -30.01 70.79 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.295 -1.32 . . . . 0.0 110.666 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' A' ' 964' ' ' PRO . 71.4 mt -67.49 111.74 4.29 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.284 0.634 . . . . 0.0 109.557 176.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.2 p -116.55 168.51 10.11 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -171.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.538 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 5.8 p -96.86 121.9 58.17 Favored Pre-proline 0 N--CA 1.44 -0.973 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.369 175.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.658 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 28.9 Cg_endo -82.8 175.56 8.56 Favored 'Trans proline' 0 C--O 1.242 0.686 0 C-N-CA 123.92 3.08 . . . . 0.0 111.198 178.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.86 111.05 0.85 Allowed 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 122.15 1.9 . . . . 0.0 111.645 176.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.544 ' O ' ' HA ' ' A' 1029 ' ' LYS . . . 108.69 -3.54 32.32 Favored Glycine 0 N--CA 1.431 -1.653 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.852 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.658 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 97.3 m95 -120.4 122.62 41.15 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 122.405 1.098 . . . . 0.0 112.688 -178.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.566 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 7.5 tp10 -108.18 123.18 48.34 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 126.953 2.101 . . . . 0.0 111.599 -172.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 24.0 m95 -78.95 105.84 10.55 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.699 172.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 976' ' ' GLU . . . . . 0.46 ' CD ' ' HE3' ' A' 1028 ' ' LYS . 38.9 mt-10 -73.4 -43.94 59.46 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 121.581 0.705 . . . . 0.0 109.663 175.083 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.02 146.18 54.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.466 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -76.62 -32.11 57.84 Favored 'General case' 0 C--N 1.318 -0.785 0 O-C-N 123.462 0.476 . . . . 0.0 110.84 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -163.43 157.23 19.62 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.655 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 27.1 m95 -72.93 113.22 9.72 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 177.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 18.8 m -120.45 150.36 40.93 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 -172.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 982' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' A' 1022 ' ' ARG . 0.3 OUTLIER -74.2 126.57 30.9 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.688 0.756 . . . . 0.0 110.727 -175.675 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -83.03 143.19 30.78 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-N 113.516 -1.675 . . . . 0.0 111.041 -167.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 15.6 pt -133.66 23.45 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.942 0.877 . . . . 0.0 109.38 176.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 985' ' ' ASN . . . . . 0.417 ' O ' ' HD3' ' A' ' 986' ' ' ARG . 63.9 t30 -96.12 13.94 25.55 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 178.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.417 ' HD3' ' O ' ' A' ' 985' ' ' ASN . 1.0 OUTLIER -134.02 177.46 7.72 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 114.243 -1.344 . . . . 0.0 107.414 -175.071 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -88.27 82.17 7.14 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.926 0.869 . . . . 0.0 109.471 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.504 HG12 ' HG2' ' A' ' 994' ' ' GLU . 15.4 m -138.49 164.64 26.29 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 114.147 -1.388 . . . . 0.0 109.373 -177.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -55.44 169.98 0.26 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.923 0.489 . . . . 0.0 110.494 171.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -58.61 -30.92 67.6 Favored 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 121.911 -0.493 . . . . 0.0 111.664 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 991' ' ' LYS . . . . . 0.507 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 48.1 mttm -98.67 9.86 42.37 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 119.414 -0.915 . . . . 0.0 110.868 178.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.69 -13.98 65.28 Favored Glycine 0 C--O 1.226 -0.357 0 CA-C-N 116.724 -0.217 . . . . 0.0 112.646 174.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.507 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 85.1 m95 -51.54 130.97 29.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.844 0.83 . . . . 0.0 112.718 178.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.504 ' HG2' HG12 ' A' ' 988' ' ' VAL . 29.5 mt-10 -107.96 155.79 19.93 Favored 'General case' 0 C--O 1.251 1.148 0 C-N-CA 124.042 0.937 . . . . 0.0 109.413 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.66 ' HB3' ' H ' ' A' 1009 ' ' VAL . 26.2 t80 -81.08 96.72 7.25 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 112.456 -2.156 . . . . 0.0 110.216 -177.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 996' ' ' GLY . . . . . 0.402 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -121.86 106.06 1.05 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 118.863 -1.637 . . . . 0.0 111.86 174.218 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.517 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -111.0 151.1 13.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 O-C-N 120.931 -1.335 . . . . 0.0 108.484 178.539 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 5.2 m -127.69 103.3 7.23 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 176.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 62.9 mt -80.64 123.42 82.61 Favored Pre-proline 0 C--N 1.318 -0.803 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.43 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 25.1 Cg_endo -61.84 142.16 92.52 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.462 2.108 . . . . 0.0 112.938 -178.174 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1001 ' ' PRO . . . . . 0.43 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 11.1 Cg_endo -96.87 145.96 6.24 Favored 'Cis proline' 0 N--CA 1.452 -0.938 0 C-N-CA 123.366 -1.514 . . . . 0.0 113.636 -2.226 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 6.6 t70 168.28 -179.54 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 104.435 -2.431 . . . . 0.0 104.435 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 6.2 p80 -132.37 -33.86 1.25 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 118.861 0.755 . . . . 0.0 112.074 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 79.3 mttt -112.8 132.51 22.25 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -177.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.42 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 52.1 Cg_exo -59.61 134.31 57.04 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 123.179 2.586 . . . . 0.0 109.99 168.14 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1006 ' ' LYS . . . . . 0.402 ' HE2' ' HB3' ' A' 1006 ' ' LYS . 12.6 ptpt -116.94 15.86 15.16 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 122.434 1.112 . . . . 0.0 109.196 -177.124 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 41.9 t -148.01 137.81 22.51 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 113.948 -1.478 . . . . 0.0 108.235 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.617 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 56.5 m95 -136.17 137.34 40.82 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.66 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 47.0 t -143.21 178.65 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 N-CA-C 104.183 -2.525 . . . . 0.0 104.183 -173.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1010 ' ' ALA . . . . . 0.51 ' H ' HG12 ' A' 1009 ' ' VAL . . . -99.83 4.34 45.16 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 120.072 1.305 . . . . 0.0 112.657 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -86.59 -168.29 2.18 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 121.736 -0.602 . . . . 0.0 112.294 -178.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.542 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.4 OUTLIER -159.39 106.8 1.75 Allowed 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.735 0.778 . . . . 0.0 108.954 -174.739 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.44 ' H ' ' CE1' ' A' 1016 ' ' HIS . 98.2 mttt -113.55 148.32 36.34 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.761 -178.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 51.7 ttp -47.67 -39.14 16.49 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 124.146 0.904 . . . . 0.0 112.158 176.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -61.37 -0.35 0.37 Allowed 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.542 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 2.9 m80 -61.83 118.95 7.86 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 178.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1017 ' ' THR . . . . . 0.536 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 25.4 p -104.79 -18.45 14.25 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.736 174.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 5.1 m80 -140.93 151.18 44.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.9 -177.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -156.94 151.88 26.0 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 170.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.453 ' HB3' ' OD1' ' A' ' 937' ' ' ASN . 6.1 ptp180 -151.26 163.84 37.96 Favored 'General case' 0 C--O 1.187 -2.199 0 C-N-CA 118.886 -1.126 . . . . 0.0 109.567 175.532 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.566 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 25.6 ptt180 -141.75 148.62 39.29 Favored 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.919 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.519 ' O ' ' HA ' ' A' ' 982' ' ' TYR . 41.3 ttm180 -90.42 122.11 32.99 Favored 'General case' 0 N--CA 1.44 -0.933 0 O-C-N 123.525 0.515 . . . . 0.0 111.684 -178.141 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.655 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 83.6 mt -91.58 129.59 37.53 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 106.009 -1.849 . . . . 0.0 106.009 166.159 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1024 ' ' VAL . . . . . . . . . . . . . 8.0 m -112.16 137.45 44.86 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 CA-C-O 122.219 1.009 . . . . 0.0 111.518 -177.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.464 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 6.3 tpt180 -137.06 101.32 4.52 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 113.1 -1.863 . . . . 0.0 108.278 171.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.493 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -82.1 148.9 28.3 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.632 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 11.5 ptm180 -144.07 179.24 7.33 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 104.915 -2.254 . . . . 0.0 104.915 -171.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.861 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 15.8 ptpt -162.17 160.71 27.45 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 175.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.544 ' HA ' ' O ' ' A' ' 972' ' ' GLY . 35.6 ttmt -87.81 -16.47 34.01 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-O 123.027 1.394 . . . . 0.0 107.758 -177.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 22.7 t70 55.46 16.56 1.85 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 112.019 -2.355 . . . . 0.0 110.661 -172.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 37.8 tp 62.51 -56.62 0.14 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.583 1.553 . . . . 0.0 112.26 -172.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 11.6 p -87.1 0.61 54.99 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 -172.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.566 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 47.6 mt-30 . . . . . 0 CA--C 1.519 -0.24 0 C-N-CA 118.16 -1.416 . . . . 0.0 110.302 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 927' ' ' HIS . . . . . 0.482 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 42.2 m-70 . . . . . 0 N--CA 1.445 -0.696 0 N-CA-C 106.155 -1.795 . . . . 0.0 106.155 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -168.58 116.98 0.7 Allowed 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 169.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -137.58 129.77 29.21 Favored 'General case' 0 C--N 1.288 -2.07 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 174.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -121.55 138.12 54.44 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.59 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 31.3 m -77.84 122.34 25.32 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 175.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -96.56 175.02 6.55 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.68 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.6 pt-20 -168.83 143.72 3.24 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.497 0.665 . . . . 0.0 110.958 -171.149 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.595 HG22 ' H ' ' A' ' 935' ' ' TYR . 13.0 p -135.47 -177.61 2.08 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 173.243 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.595 ' H ' HG22 ' A' ' 934' ' ' VAL . 87.3 m-85 -137.27 146.18 44.42 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 118.862 0.755 . . . . 0.0 109.09 -178.445 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' A' 1020 ' ' ARG . 30.9 tt0 -116.81 118.05 31.42 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 -179.632 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 -109.18 142.33 40.13 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-O 122.141 0.972 . . . . 0.0 111.536 -175.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.561 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 62.0 mt-10 -128.95 162.57 27.26 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 170.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 38.1 m -146.89 152.75 39.2 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.978 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.444 ' O ' ' HA ' ' A' 1017 ' ' THR . 25.9 ptt180 -149.45 159.84 43.95 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 114.947 -1.024 . . . . 0.0 108.876 177.296 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -75.82 161.71 74.82 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 170.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 942' ' ' PRO . . . . . 0.404 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 23.0 Cg_exo -66.42 92.91 0.29 Allowed 'Trans proline' 0 N--CA 1.458 -0.586 0 N-CA-C 109.169 -1.127 . . . . 0.0 109.169 171.359 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 119.68 11.03 7.38 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -172.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 944' ' ' GLY . . . . . 0.408 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -109.45 -174.07 21.01 Favored Glycine 0 CA--C 1.498 -0.988 0 N-CA-C 108.203 -1.959 . . . . 0.0 108.203 176.078 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -120.97 159.26 25.97 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 105.561 -2.014 . . . . 0.0 105.561 170.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.561 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 43.0 m95 -71.07 125.96 28.29 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-O 121.428 0.633 . . . . 0.0 111.374 -172.16 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -114.9 172.54 3.53 Favored Pre-proline 0 C--N 1.299 -1.607 0 N-CA-C 102.634 -3.099 . . . . 0.0 102.634 170.049 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -54.73 147.66 49.01 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 CA-C-N 121.649 1.624 . . . . 0.0 111.848 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -69.35 -170.06 0.25 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.777 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.47 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.0 OUTLIER -98.21 -29.01 13.45 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 -179.221 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -120.53 88.15 2.88 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 103.765 -2.68 . . . . 0.0 103.765 173.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 20.5 m -62.03 -51.97 65.87 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.004 -172.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 953' ' ' TYR . . . . . 0.47 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 79.8 m-85 -103.31 133.9 47.61 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 119.551 -0.86 . . . . 0.0 111.097 177.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 72.7 p -142.91 174.77 10.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.48 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -109.81 -173.48 2.27 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.84 -36.19 36.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 114.044 1.128 . . . . 0.0 114.044 -174.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -101.34 11.13 39.79 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 92.78 0.18 69.31 Favored Glycine 0 CA--C 1.497 -1.042 0 C-N-CA 119.53 -1.319 . . . . 0.0 111.578 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -56.82 104.11 0.14 Allowed 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 174.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 960' ' ' LYS . . . . . 0.473 ' HD3' ' C ' ' A' ' 960' ' ' LYS . 7.8 tmtm? -49.52 118.5 2.8 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 124.158 0.911 . . . . 0.0 108.887 176.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -121.71 176.0 5.95 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.13 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -66.32 149.9 49.68 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 123.638 0.586 . . . . 0.0 110.661 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 15.6 m -85.38 156.73 59.44 Favored Pre-proline 0 N--CA 1.437 -1.119 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.511 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.3 Cg_exo -48.16 -32.81 19.85 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.397 3.398 . . . . 0.0 116.636 -173.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.6 p -75.81 -45.33 36.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.461 1.124 . . . . 0.0 109.437 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -65.2 -27.26 68.56 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.037 -1.892 . . . . 0.0 110.585 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.476 HD13 ' CH2' ' A' ' 980' ' ' TRP . 33.1 mt -71.49 120.6 17.31 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.061 0.944 . . . . 0.0 110.371 175.323 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 26.1 p -125.07 170.94 10.68 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.979 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 6.6 p -82.87 148.53 57.52 Favored Pre-proline 0 C--N 1.315 -0.925 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.998 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.581 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 20.0 Cg_endo -91.6 165.75 3.42 Favored 'Trans proline' 0 C--O 1.239 0.568 0 C-N-CA 123.004 2.469 . . . . 0.0 111.267 174.082 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.11 108.33 1.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 121.709 1.606 . . . . 0.0 110.579 174.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.616 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 118.93 1.71 14.45 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 120.908 -0.663 . . . . 0.0 111.859 -177.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.581 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 90.1 m95 -137.43 137.54 38.87 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 122.2 1.0 . . . . 0.0 111.161 177.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.594 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 9.4 tp10 -118.23 143.23 46.71 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.155 -1.839 . . . . 0.0 106.115 -174.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.523 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 98.7 m95 -83.53 153.77 24.2 Favored 'General case' 0 C--N 1.296 -1.736 0 O-C-N 120.693 -1.255 . . . . 0.0 110.418 171.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -121.55 -42.2 2.45 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 977' ' ' ASP . . . . . 0.756 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 1.6 m-20 -77.05 155.83 32.22 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.432 178.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -75.81 -56.72 4.41 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -171.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -156.54 147.88 22.37 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -175.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.511 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 17.6 m95 -61.39 120.43 10.45 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 124.167 0.917 . . . . 0.0 109.295 -172.135 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 981' ' ' SER . . . . . 0.648 ' O ' ' HA ' ' A' 1023 ' ' LEU . 42.4 m -111.63 -166.69 1.1 Allowed 'General case' 0 C--O 1.201 -1.45 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 17.6 p90 -109.82 154.34 23.13 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 119.825 1.193 . . . . 0.0 112.208 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' 1022 ' ' ARG . 9.0 t70 -99.89 131.57 45.78 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.672 -171.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 30.8 pt -119.87 28.32 3.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 122.209 1.004 . . . . 0.0 109.011 173.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -106.4 24.35 12.69 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 123.012 1.387 . . . . 0.0 108.963 -175.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.401 HH21 ' CD ' ' A' ' 994' ' ' GLU . 38.5 mtp85 -139.5 -177.61 5.02 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -83.93 80.76 9.05 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 172.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.904 HG12 ' HG2' ' A' ' 994' ' ' GLU . 29.2 m -135.97 156.14 36.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.352 -170.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.37 170.14 0.16 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.956 170.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -52.62 -34.18 49.93 Favored 'General case' 0 CA--C 1.498 -1.02 0 C-N-CA 123.479 0.711 . . . . 0.0 111.239 176.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 991' ' ' LYS . . . . . 0.445 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 84.5 mttt -98.35 2.97 48.54 Favored 'General case' 0 N--CA 1.422 -1.842 0 CA-C-N 114.924 -1.035 . . . . 0.0 111.947 -176.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 100.67 -16.08 57.94 Favored Glycine 0 C--O 1.223 -0.576 0 C-N-CA 121.27 -0.49 . . . . 0.0 111.888 178.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.738 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 71.3 m95 -55.8 116.61 3.04 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.904 ' HG2' HG12 ' A' ' 988' ' ' VAL . 5.0 mt-10 -99.76 155.44 17.64 Favored 'General case' 0 C--O 1.257 1.451 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.432 176.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.521 ' HD2' ' HB3' ' A' 1011 ' ' ALA . 21.9 t80 -69.47 102.67 1.85 Allowed 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 129.015 2.926 . . . . 0.0 110.829 -178.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -124.13 122.41 4.8 Favored Glycine 0 CA--C 1.503 -0.659 0 C-N-CA 119.33 -1.414 . . . . 0.0 111.876 172.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.973 ' HB ' ' HD2' ' A' 1016 ' ' HIS . 1.3 tt -133.24 139.57 48.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 O-C-N 121.663 -0.904 . . . . 0.0 109.291 -179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 35.0 m -132.61 116.81 17.13 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.405 ' HA ' ' HD2' ' A' 1000 ' ' PRO . 12.2 pt -114.18 97.38 45.39 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-O 121.188 0.518 . . . . 0.0 111.891 -175.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 999' ' ' ILE . 18.7 Cg_endo -58.88 132.98 50.77 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.632 2.888 . . . . 0.0 114.415 -175.11 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -79.59 146.02 75.26 Favored 'Cis proline' 0 N--CA 1.454 -0.835 0 C-N-CA 122.743 -1.774 . . . . 0.0 112.015 -0.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 6.2 t70 -153.53 -159.91 1.05 Allowed 'General case' 0 C--N 1.293 -1.878 0 CA-C-N 113.873 -1.512 . . . . 0.0 107.91 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 14.8 p80 -138.0 -57.67 0.66 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.248 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 63.0 mttp -165.26 155.69 12.09 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 102.837 -3.023 . . . . 0.0 102.837 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -60.53 122.0 10.61 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 CA-C-N 121.758 1.664 . . . . 0.0 109.244 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 46.7 pttt -83.78 -7.51 59.45 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.566 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 9.6 t -144.01 135.22 25.62 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -174.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.597 ' HE3' ' HB2' ' A' ' 994' ' ' GLU . 42.6 m95 -134.24 135.39 42.91 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 125.436 1.71 . . . . 0.0 106.405 175.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.51 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 2.6 m -162.9 -174.01 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 -174.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -97.4 104.74 16.78 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1011 ' ' ALA . . . . . 0.521 ' HB3' ' HD2' ' A' ' 995' ' ' TYR . . . -178.25 -176.96 0.55 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -175.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.517 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.2 OUTLIER -174.63 118.03 0.2 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.805 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 46.9 mttp -132.37 153.4 50.81 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.421 -172.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 23.0 ttt -53.03 -44.03 67.03 Favored 'General case' 0 C--N 1.315 -0.918 0 O-C-N 124.607 1.192 . . . . 0.0 113.38 -177.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1015 ' ' TYR . . . . . 0.404 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 54.0 m-85 -68.47 9.63 0.33 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.973 ' HD2' ' HB ' ' A' ' 997' ' ' ILE . 22.0 m170 -69.72 175.65 4.1 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.908 0.861 . . . . 0.0 112.233 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1017 ' ' THR . . . . . 0.444 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 1.1 m -155.75 -42.0 0.08 Allowed 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 -169.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -132.02 144.31 50.68 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.49 -174.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1019 ' ' ARG . . . . . 0.738 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 42.7 ttp180 -151.92 146.09 25.36 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 5.5 ptp180 -156.15 165.48 36.28 Favored 'General case' 0 C--O 1.198 -1.627 0 C-N-CA 117.575 -1.65 . . . . 0.0 110.824 178.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.582 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 29.4 ptt180 -144.38 151.36 39.17 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.792 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.68 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 36.2 ttm180 -83.7 129.76 34.95 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.648 ' HA ' ' O ' ' A' ' 981' ' ' SER . 72.9 mt -98.95 128.22 45.05 Favored 'General case' 0 N--CA 1.414 -2.275 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 167.034 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.522 HG13 ' HB2' ' A' ' 983' ' ' ASP . 1.4 m -104.76 145.1 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.828 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.503 -171.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.756 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -156.22 114.08 3.29 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 124.999 1.437 . . . . 0.0 111.299 168.001 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.8 tmmm? -82.09 144.83 30.52 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 -176.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.523 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 6.3 ptm180 -135.79 137.89 42.04 Favored 'General case' 0 C--O 1.209 -1.036 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 -172.209 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.562 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 30.2 ttmt -123.08 137.85 54.82 Favored 'General case' 0 C--N 1.284 -2.258 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.012 -171.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.639 ' C ' ' H ' ' A' 1031 ' ' LEU . 36.8 ttmt -89.1 -21.14 23.53 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-O 123.228 1.49 . . . . 0.0 108.26 -177.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 21.5 t70 66.67 -22.91 0.1 Allowed 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 111.927 -2.397 . . . . 0.0 112.28 -169.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1031 ' ' LEU . . . . . 0.639 ' H ' ' C ' ' A' 1029 ' ' LYS . 27.6 tp 88.46 -25.34 0.08 Allowed 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 129.029 2.932 . . . . 0.0 110.899 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 34.4 p -74.77 -16.35 60.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.307 0.575 . . . . 0.0 111.363 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.594 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 98.0 mt-30 . . . . . 0 C--O 1.233 0.203 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.459 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 56.9 m-70 . . . . . 0 CA--C 1.502 -0.889 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.6 m -161.2 124.43 3.25 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 102.804 -3.035 . . . . 0.0 102.804 168.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.473 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.4 OUTLIER -153.25 145.96 24.29 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 178.639 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -141.14 143.7 34.42 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.637 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 25.7 m -74.15 125.71 28.97 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 177.471 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -101.36 156.78 17.25 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 105.085 -2.191 . . . . 0.0 105.085 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.475 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.0 pt-20 -147.77 152.48 37.79 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.448 -174.165 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.499 HG11 ' HG3' ' A' ' 964' ' ' PRO . 12.2 p -141.95 174.76 5.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.291 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.503 ' HA ' ' O ' ' A' 1021 ' ' ARG . 68.6 m-85 -135.61 150.39 49.65 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.524 ' O ' ' HA ' ' A' 1020 ' ' ARG . 36.8 tt0 -126.18 127.53 45.85 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -178.314 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 937' ' ' ASN . . . . . 0.96 ' HB3' ' HG2' ' A' 1020 ' ' ARG . 20.5 p-10 -137.92 152.23 48.78 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.642 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 46.3 mt-10 -135.22 161.05 36.48 Favored 'General case' 0 C--O 1.245 0.834 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 178.065 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 939' ' ' SER . . . . . 0.495 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 17.9 p -133.36 147.92 51.83 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.143 0.497 . . . . 0.0 111.336 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.474 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 21.6 ptt180 -149.02 161.44 41.91 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.81 158.38 69.69 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 171.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 942' ' ' PRO . . . . . 0.456 ' HG3' HG22 ' A' 1017 ' ' THR . 24.5 Cg_exo -62.78 92.32 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 121.345 1.363 . . . . 0.0 110.259 174.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 97.0 70.58 1.03 Allowed Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 108.974 -1.65 . . . . 0.0 108.974 -176.058 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -160.5 -131.24 1.2 Allowed Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.102 -175.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -137.42 131.07 31.45 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.547 -0.827 . . . . 0.0 111.047 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.642 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 36.1 m95 -78.92 149.98 32.22 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-O 121.512 0.672 . . . . 0.0 110.485 -177.062 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -137.84 166.06 29.07 Favored Pre-proline 0 C--N 1.305 -1.352 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 171.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -49.31 127.95 19.04 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 CA-C-N 121.262 1.486 . . . . 0.0 110.285 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 949' ' ' ALA . . . . . 0.495 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -47.78 -51.7 21.46 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 124.725 1.266 . . . . 0.0 111.613 -174.61 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 163.33 -35.37 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 178.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 951' ' ' ASP . . . . . 0.433 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 15.6 m-20 -132.13 102.27 5.73 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 174.329 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 952' ' ' THR . . . . . 0.437 ' O ' ' HA ' ' A' ' 936' ' ' GLN . 24.1 m -68.96 -46.2 68.76 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -172.324 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 953' ' ' TYR . . . . . 0.419 ' CE1' ' HB2' ' A' ' 936' ' ' GLN . 59.7 m-85 -104.79 130.57 52.87 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.874 0.845 . . . . 0.0 110.591 175.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 5.0 p -145.02 173.09 12.19 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.264 -1.334 . . . . 0.0 111.017 -166.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 955' ' ' ASP . . . . . 0.509 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 11.3 t70 -97.72 170.74 8.79 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 175.494 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.49 -27.95 7.52 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 119.548 1.067 . . . . 0.0 113.67 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -95.39 2.19 54.5 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 98.07 -3.87 60.5 Favored Glycine 0 CA--C 1.497 -1.049 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.845 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 959' ' ' ASP . . . . . 0.509 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 38.6 t70 -51.74 108.41 0.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 O-C-N 124.388 0.699 . . . . 0.0 110.308 176.369 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 960' ' ' LYS . . . . . 0.433 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 51.8 tptt -47.14 111.1 0.36 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.537 1.148 . . . . 0.0 109.076 172.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -120.96 -179.91 4.17 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.604 -174.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -74.75 146.63 42.01 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 13.6 m -76.16 156.82 83.73 Favored Pre-proline 0 C--N 1.313 -1.011 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.567 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 53.1 Cg_exo -50.91 -25.13 15.14 Favored 'Trans proline' 0 N--CA 1.487 1.101 0 C-N-CA 123.537 2.825 . . . . 0.0 115.407 -177.292 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 9.3 p -71.3 -49.47 42.46 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.861 0.839 . . . . 0.0 108.993 176.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -66.2 -28.15 68.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.699 175.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.479 HD12 ' HA ' ' A' ' 964' ' ' PRO . 67.7 mt -66.46 110.72 3.24 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.614 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 10.6 p -126.27 -179.95 4.98 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.891 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.678 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 24.0 p -94.65 124.92 53.44 Favored Pre-proline 0 C--N 1.308 -1.239 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.689 178.508 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.626 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 80.3 Cg_endo -78.53 162.84 27.38 Favored 'Trans proline' 0 C--N 1.336 -0.118 0 C-N-CA 123.197 2.598 . . . . 0.0 110.461 178.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -59.45 100.91 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 121.66 1.574 . . . . 0.0 110.942 174.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.654 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 127.34 -3.57 7.2 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -176.129 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.678 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 94.7 m95 -141.21 145.98 36.33 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 122.68 0.392 . . . . 0.0 110.307 177.044 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.57 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 5.5 tp10 -131.69 157.57 43.41 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 126.004 1.722 . . . . 0.0 106.41 -175.248 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.644 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 98.4 m95 -90.34 148.05 23.09 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 120.468 -1.395 . . . . 0.0 112.691 170.564 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -113.2 -43.82 3.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 178.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 977' ' ' ASP . . . . . 0.474 ' HB3' ' NE ' ' A' 1025 ' ' ARG . 69.4 m-20 -78.22 161.19 27.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.788 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -84.18 -57.48 3.16 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 115.186 1.551 . . . . 0.0 115.186 -176.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -155.77 142.69 18.99 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 121.408 -0.808 . . . . 0.0 110.404 -170.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.567 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 15.4 m95 -66.84 130.49 43.33 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.118 0.485 . . . . 0.0 109.97 -173.417 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 981' ' ' SER . . . . . 0.443 ' O ' ' HA ' ' A' 1023 ' ' LEU . 62.3 m -128.67 166.39 19.01 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 -179.084 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 20.4 p90 -74.41 142.55 44.98 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -178.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.526 ' HB2' HG13 ' A' 1024 ' ' VAL . 31.9 t0 -97.96 122.03 40.6 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.024 -177.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.2 pp -114.46 22.66 5.65 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.385 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -97.98 27.44 4.52 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.526 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 50.6 mtp180 -141.78 -177.16 5.06 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 -173.336 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.31 84.89 6.97 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 16.8 m -141.1 157.21 22.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.477 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -53.06 169.45 0.1 Allowed 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.773 172.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -55.33 -34.17 63.98 Favored 'General case' 0 CA--C 1.507 -0.675 0 C-N-CA 123.061 0.544 . . . . 0.0 112.439 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -98.68 11.85 37.26 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.418 0.628 . . . . 0.0 110.008 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 69.85 81.27 0.24 Allowed Glycine 0 N--CA 1.431 -1.654 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.243 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.509 ' CE3' ' HD2' ' A' 1019 ' ' ARG . 99.5 m95 -148.13 131.53 16.63 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.687 ' HG2' ' O ' ' A' 1020 ' ' ARG . 6.4 pt-20 -108.02 150.88 26.58 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-O 121.611 0.719 . . . . 0.0 112.493 -177.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.693 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -74.67 94.63 2.72 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 112.556 -2.111 . . . . 0.0 111.329 -173.339 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -110.88 101.37 1.34 Allowed Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 120.33 -0.938 . . . . 0.0 111.272 177.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.492 HD12 ' HB3' ' A' 1015 ' ' TYR . 0.7 OUTLIER -110.19 133.19 56.34 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.055 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.792 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 8.7 m -118.61 97.05 5.54 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 120.608 0.242 . . . . 0.0 110.357 -177.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.444 ' O ' HD12 ' A' ' 999' ' ' ILE . 2.4 pp -81.41 133.59 53.01 Favored Pre-proline 0 C--N 1.319 -0.724 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.764 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 51.5 Cg_endo -70.55 143.36 46.8 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.825 2.35 . . . . 0.0 113.736 -175.229 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1001 ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 9.3 Cg_endo -93.7 143.86 9.01 Favored 'Cis proline' 0 N--CA 1.451 -1.009 0 C-N-CA 123.057 -1.643 . . . . 0.0 112.198 -3.01 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 2.7 t70 170.0 167.28 0.06 Allowed 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 113.342 -1.754 . . . . 0.0 107.718 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 13.9 p-80 -142.24 33.49 1.51 Allowed 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.845 0.355 . . . . 0.0 110.148 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -163.5 124.74 1.5 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.426 -175.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.562 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 51.5 Cg_exo -63.79 126.29 17.13 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 121.525 1.484 . . . . 0.0 109.445 166.525 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 55.2 pttt -107.21 7.71 29.58 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.949 0.88 . . . . 0.0 109.188 -178.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.0 t -144.28 138.03 27.65 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.421 -1.263 . . . . 0.0 108.651 -177.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.593 ' CE3' ' HG3' ' A' ' 994' ' ' GLU . 66.9 m95 -133.72 140.24 46.88 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 98.4 t -139.34 152.86 23.65 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -78.86 100.32 7.13 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 175.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1011 ' ' ALA . . . . . 0.563 ' HB3' ' HD2' ' A' ' 995' ' ' TYR . . . 177.19 -174.2 0.12 Allowed 'General case' 0 C--O 1.235 0.293 0 O-C-N 123.876 0.735 . . . . 0.0 110.588 -171.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.696 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.3 OUTLIER -172.34 104.52 0.17 Allowed 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 106.491 -1.67 . . . . 0.0 106.491 177.61 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.479 ' H ' ' CE1' ' A' 1016 ' ' HIS . 21.9 mttp -141.66 166.93 23.39 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 112.852 -1.976 . . . . 0.0 110.283 -170.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 55.6 ttp -49.95 -47.34 52.62 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -173.257 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1015 ' ' TYR . . . . . 0.492 ' HB3' HD12 ' A' ' 997' ' ' ILE . 33.2 m-85 -62.25 -0.89 0.61 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.696 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 15.3 m80 -59.28 111.05 1.22 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 118.55 0.613 . . . . 0.0 112.229 175.388 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1017 ' ' THR . . . . . 0.456 HG22 ' HG3' ' A' ' 942' ' ' PRO . 42.1 p -96.32 -28.63 14.4 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 123.478 1.609 . . . . 0.0 107.525 174.215 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 7.2 m170 -139.3 156.26 47.16 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 112.658 -2.064 . . . . 0.0 109.348 -178.661 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1019 ' ' ARG . . . . . 0.509 ' HD2' ' CE3' ' A' ' 993' ' ' TRP . 38.0 ptt180 -149.93 145.76 26.67 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 171.016 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.96 ' HG2' ' HB3' ' A' ' 937' ' ' ASN . 53.9 mtp180 -144.09 167.4 22.46 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.503 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.3 ptt180 -157.38 154.48 28.96 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.611 174.564 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.526 ' NH1' ' HD2' ' A' ' 986' ' ' ARG . 35.8 ttm180 -90.31 133.27 35.07 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 123.604 0.565 . . . . 0.0 109.775 178.743 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.531 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 71.9 mt -102.12 130.76 48.81 Favored 'General case' 0 N--CA 1.421 -1.909 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 165.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.526 HG13 ' HB2' ' A' ' 983' ' ' ASP . 1.8 m -106.35 145.09 14.56 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.354 -174.607 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.748 ' NE ' ' HA ' ' A' 1025 ' ' ARG . 0.6 OUTLIER -158.99 115.99 2.73 Favored 'General case' 0 C--N 1.31 -1.146 0 O-C-N 125.218 1.574 . . . . 0.0 113.017 168.233 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.8 tmmm? -76.29 142.38 41.34 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.204 0.526 . . . . 0.0 109.765 -177.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.644 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 11.2 ptm180 -130.69 144.52 51.49 Favored 'General case' 0 CA--C 1.497 -1.076 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -173.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 58.5 tttt -134.02 135.3 43.29 Favored 'General case' 0 C--N 1.286 -2.157 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.191 -167.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.654 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 34.6 ttmt -84.58 -20.26 31.77 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 123.473 1.606 . . . . 0.0 107.362 179.214 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1030 ' ' ASP . . . . . 0.453 ' H ' ' HG2' ' A' 1028 ' ' LYS . 24.6 t70 61.95 -17.71 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 111.246 -2.706 . . . . 0.0 113.555 -171.133 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1031 ' ' LEU . . . . . 0.611 ' H ' ' C ' ' A' 1029 ' ' LYS . 18.5 tp 81.25 -10.54 1.19 Allowed 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 128.43 2.692 . . . . 0.0 110.621 -178.089 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 17.6 p -87.69 -3.5 58.96 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.384 0.612 . . . . 0.0 111.394 -177.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.57 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 80.3 mt-30 . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.691 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 927' ' ' HIS . . . . . 0.518 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 6.1 m-70 . . . . . 0 CA--C 1.493 -1.215 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.87 127.26 48.77 Favored 'General case' 0 N--CA 1.42 -1.971 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 162.343 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.56 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 0.0 OUTLIER -138.48 149.66 45.64 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 104.853 -2.277 . . . . 0.0 104.853 171.715 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.414 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.1 t80 -154.48 138.65 16.53 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 -174.351 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 45.4 m -79.77 132.82 36.25 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -110.04 156.88 19.94 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.449 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.0 pt-20 -154.21 159.48 41.37 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 121.282 0.563 . . . . 0.0 111.118 -173.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.641 ' O ' ' HA ' ' A' 1022 ' ' ARG . 8.8 p -147.96 179.6 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 176.022 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.568 ' H ' HG22 ' A' ' 934' ' ' VAL . 77.9 m-85 -139.97 118.51 12.25 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 118.468 0.576 . . . . 0.0 110.418 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.473 ' O ' ' HA ' ' A' 1020 ' ' ARG . 47.3 mt-30 -78.46 122.47 25.87 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 170.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 937' ' ' ASN . . . . . 0.506 ' HB3' ' HB3' ' A' ' 949' ' ' ALA . 24.5 m-80 -117.5 143.24 46.26 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 123.338 0.655 . . . . 0.0 112.049 -176.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.67 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 52.4 mt-10 -136.18 150.76 49.16 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 174.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 939' ' ' SER . . . . . 0.482 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 31.8 p -134.85 146.63 49.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 117.895 0.316 . . . . 0.0 111.72 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.536 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 25.0 ptt180 -153.3 161.33 42.48 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 124.156 0.982 . . . . 0.0 108.685 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -68.71 153.21 96.16 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 172.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 942' ' ' PRO . . . . . 0.485 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 70.2 Cg_exo -55.49 97.97 0.06 OUTLIER 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 121.893 1.729 . . . . 0.0 111.219 174.069 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 93.88 66.99 1.05 Allowed Glycine 0 N--CA 1.435 -1.374 0 N-CA-C 107.849 -2.101 . . . . 0.0 107.849 -175.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -159.01 -155.68 7.73 Favored Glycine 0 N--CA 1.434 -1.485 0 C-N-CA 120.138 -1.03 . . . . 0.0 113.145 -176.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -116.47 131.23 57.0 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 113.541 -1.329 . . . . 0.0 110.032 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.67 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 48.1 m95 -79.9 154.21 28.49 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.407 0.622 . . . . 0.0 110.609 -175.534 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -136.53 173.96 5.0 Favored Pre-proline 0 C--N 1.306 -1.284 0 N-CA-C 103.806 -2.665 . . . . 0.0 103.806 173.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.63 128.9 32.3 Favored 'Trans proline' 0 C--N 1.346 0.436 0 CA-C-N 121.522 1.579 . . . . 0.0 109.47 173.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 949' ' ' ALA . . . . . 0.506 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . . . -71.51 37.58 0.06 Allowed 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.849 1.426 . . . . 0.0 114.849 -175.111 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 85.18 -57.45 0.09 Allowed 'General case' 0 CA--C 1.474 -1.948 0 C-N-CA 125.274 1.43 . . . . 0.0 107.981 174.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -119.04 101.56 8.11 Favored 'General case' 0 N--CA 1.401 -2.903 0 N-CA-C 104.393 -2.447 . . . . 0.0 104.393 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.2 m -64.05 -57.76 8.7 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.085 0.241 . . . . 0.0 111.545 -172.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -98.35 126.3 43.82 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 37.5 p -149.66 -178.23 6.33 Favored 'General case' 0 C--O 1.246 0.896 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -172.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -105.33 -177.15 3.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 175.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.16 -31.63 32.29 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.27 -41.46 20.15 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 129.5 -2.07 6.09 Favored Glycine 0 CA--C 1.498 -0.974 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.887 177.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.43 104.36 0.62 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 114.626 -0.787 . . . . 0.0 109.181 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 960' ' ' LYS . . . . . 0.414 ' HD3' ' N ' ' A' ' 961' ' ' ALA . 9.3 tmtt? -48.87 120.14 3.66 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.414 ' N ' ' HD3' ' A' ' 960' ' ' LYS . . . -125.39 -172.45 2.59 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.653 -175.256 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 962' ' ' ALA . . . . . 0.458 ' CB ' ' HG ' ' A' ' 967' ' ' LEU . . . -62.16 140.89 58.41 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 121.902 0.858 . . . . 0.0 111.35 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 963' ' ' SER . . . . . 0.491 ' O ' ' HB2' ' A' ' 967' ' ' LEU . 15.0 m -102.47 162.64 19.61 Favored Pre-proline 0 N--CA 1.43 -1.466 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -176.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.606 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.2 Cg_endo -51.23 -37.95 60.35 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.733 2.289 . . . . 0.0 114.249 -177.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 25.5 p -79.91 -47.46 15.02 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 121.906 -0.496 . . . . 0.0 111.03 175.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 966' ' ' GLU . . . . . 0.483 ' HB2' ' H ' ' A' ' 963' ' ' SER . 45.2 mt-10 -65.65 -8.23 19.39 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.491 ' HB2' ' O ' ' A' ' 963' ' ' SER . 1.0 OUTLIER -102.02 112.49 25.15 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 -175.322 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.91 155.5 18.88 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.089 -176.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 16.0 p -76.85 126.95 85.07 Favored Pre-proline 0 C--N 1.313 -1.005 0 C-N-CA 120.169 -0.613 . . . . 0.0 109.49 174.481 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.637 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 52.6 Cg_endo -80.27 166.14 20.64 Favored 'Trans proline' 0 C--O 1.238 0.479 0 C-N-CA 122.886 2.39 . . . . 0.0 111.363 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.82 102.8 0.21 Allowed 'Trans proline' 0 C--O 1.24 0.585 0 C-N-CA 121.84 1.694 . . . . 0.0 110.266 173.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.661 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 121.63 3.47 10.18 Favored Glycine 0 N--CA 1.429 -1.8 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.383 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.637 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 93.5 m95 -138.57 137.62 37.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.96 0.886 . . . . 0.0 112.177 177.094 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.632 ' HB3' ' O ' ' A' 1028 ' ' LYS . 3.5 tp10 -122.0 137.2 54.89 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.163 -1.38 . . . . 0.0 108.262 -175.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.618 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 80.9 m95 -81.07 100.41 9.0 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 120.996 -1.065 . . . . 0.0 110.48 175.342 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 976' ' ' GLU . . . . . 0.462 ' HB3' ' HB3' ' A' 1028 ' ' LYS . 8.4 pt-20 -75.9 -31.54 59.24 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 177.219 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -78.07 146.43 35.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.387 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.59 -46.38 66.45 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -166.75 156.41 11.22 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.437 0.637 . . . . 0.0 111.596 -173.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.71 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 37.7 m95 -70.75 119.63 15.18 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.422 -0.808 . . . . 0.0 108.822 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 19.6 m -125.35 148.51 48.72 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -175.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 982' ' ' TYR . . . . . 0.53 ' HA ' ' O ' ' A' 1022 ' ' ARG . 7.2 p90 -73.68 135.85 43.75 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 119.251 0.932 . . . . 0.0 110.284 -175.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.588 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 12.5 t70 -88.21 126.34 35.1 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 114.423 -1.262 . . . . 0.0 111.048 -172.611 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.467 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.3 pp -121.01 16.19 6.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.471 -179.092 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 985' ' ' ASN . . . . . 0.514 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 16.7 t-20 -90.36 16.89 7.94 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.848 -177.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.588 ' HD3' ' OD2' ' A' ' 983' ' ' ASP . 5.0 mpt_? -141.47 -175.86 4.52 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -175.193 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -73.85 84.21 1.68 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.286 0.565 . . . . 0.0 110.812 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.528 HG12 ' HG2' ' A' ' 994' ' ' GLU . 17.9 m -141.13 -171.89 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -104.0 -172.7 2.15 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -58.36 -35.44 71.95 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.734 0.778 . . . . 0.0 111.829 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 991' ' ' LYS . . . . . 0.413 ' HA ' ' CE2' ' A' ' 982' ' ' TYR . 80.4 mttt -106.75 9.1 31.19 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.363 -176.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.72 -121.55 7.2 Favored Glycine 0 C--O 1.205 -1.701 0 N-CA-C 105.691 -2.964 . . . . 0.0 105.691 -174.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.601 ' H ' ' HB3' ' A' 1021 ' ' ARG . 42.9 m95 52.72 99.4 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 173.075 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.528 ' HG2' HG12 ' A' ' 988' ' ' VAL . 26.2 mt-10 -98.6 148.95 23.28 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.69 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.747 ' HD2' ' HE2' ' A' 1016 ' ' HIS . 19.9 t80 -65.79 96.65 0.3 Allowed 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 127.059 2.144 . . . . 0.0 111.098 177.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -118.93 102.89 0.96 Allowed Glycine 0 N--CA 1.444 -0.825 0 C-N-CA 119.255 -1.45 . . . . 0.0 111.975 174.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.443 HG22 ' HD2' ' A' 1016 ' ' HIS . 0.1 OUTLIER -108.71 143.24 19.37 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 O-C-N 119.951 -1.911 . . . . 0.0 107.563 178.447 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 998' ' ' THR . . . . . 0.493 ' OG1' ' HG3' ' A' 1005 ' ' PRO . 7.9 m -138.92 127.97 23.84 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.7 mp -100.37 97.95 7.17 Favored Pre-proline 0 C--N 1.313 -0.99 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.26 140.85 38.02 Favored 'Trans proline' 0 C--O 1.238 0.478 0 C-N-CA 122.607 2.204 . . . . 0.0 114.071 -173.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -80.89 155.98 84.18 Favored 'Cis proline' 0 CA--C 1.512 -0.575 0 C-N-CA 123.177 -1.593 . . . . 0.0 110.857 -2.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1002 ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' 1003 ' ' HIS . 21.1 t70 -159.18 -133.84 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.336 -174.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1003 ' ' HIS . . . . . 0.424 ' H ' ' CG ' ' A' 1002 ' ' ASP . 5.8 p-80 -158.37 -45.09 0.06 Allowed 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 122.999 0.52 . . . . 0.0 111.25 -174.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 61.1 tttt -167.26 145.67 4.18 Favored Pre-proline 0 N--CA 1.448 -0.543 0 C-N-CA 119.651 -0.819 . . . . 0.0 108.793 -173.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.493 ' HG3' ' OG1' ' A' ' 998' ' ' THR . 52.1 Cg_exo -64.55 124.61 13.53 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 121.058 1.172 . . . . 0.0 109.724 167.139 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 57.8 pttt -70.64 -59.42 2.84 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 34.3 t -97.38 150.59 20.83 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 120.594 0.235 . . . . 0.0 111.179 -177.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.518 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 53.0 m95 -137.37 145.55 43.43 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 125.113 1.508 . . . . 0.0 107.454 175.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.62 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 10.8 m -161.92 -155.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 -177.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -103.14 -36.34 8.16 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 119.553 1.07 . . . . 0.0 113.104 -174.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -61.22 108.88 0.98 Allowed 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -168.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.444 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 4.9 tp10 -66.58 118.04 9.61 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 172.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.447 ' HD3' ' CZ ' ' A' 1015 ' ' TYR . 83.1 mttt -122.18 155.92 34.8 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.747 -174.26 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 23.7 ttt -55.88 -47.66 76.97 Favored 'General case' 0 CA--C 1.503 -0.864 0 O-C-N 123.951 0.782 . . . . 0.0 111.593 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1015 ' ' TYR . . . . . 0.485 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 31.6 p90 -75.09 28.07 0.09 Allowed 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.083 -0.647 . . . . 0.0 112.66 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.747 ' HE2' ' HD2' ' A' ' 995' ' ' TYR . 9.0 m170 -82.54 116.81 22.13 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 121.731 -0.606 . . . . 0.0 110.61 173.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 4.4 m -93.2 -28.99 15.94 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 123.088 1.423 . . . . 0.0 107.561 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1018 ' ' HIS . . . . . 0.415 ' CD2' ' HB3' ' A' ' 939' ' ' SER . 31.2 m80 -139.19 156.83 46.83 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 113.383 -1.735 . . . . 0.0 110.68 -176.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -156.37 150.74 25.53 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 105.75 -1.945 . . . . 0.0 105.75 169.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.473 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.9 ptp180 -149.99 163.65 37.56 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 118.267 -1.373 . . . . 0.0 110.86 176.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.601 ' HB3' ' H ' ' A' ' 993' ' ' TRP . 21.9 ptt180 -143.36 142.3 31.23 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.911 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.641 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 33.0 ttm180 -82.3 129.19 34.8 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.112 -178.582 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.71 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 97.0 mt -102.16 133.65 46.68 Favored 'General case' 0 N--CA 1.427 -1.609 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 166.62 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.536 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 13.8 m -111.11 138.99 37.09 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.009 -176.31 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.49 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 13.8 tpt180 -138.56 110.28 7.12 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.543 170.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.56 ' HE2' ' HG2' ' A' ' 929' ' ' GLU . 2.2 tmtp? -69.63 147.02 51.21 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.618 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 9.8 ptm180 -140.71 129.49 23.04 Favored 'General case' 0 C--O 1.201 -1.496 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -177.524 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.632 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 36.0 ttmt -121.55 135.5 55.01 Favored 'General case' 0 C--N 1.275 -2.661 0 CA-C-N 115.373 -0.831 . . . . 0.0 108.849 -174.599 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 35.5 ttmt -84.59 -23.54 29.57 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 123.709 1.719 . . . . 0.0 107.058 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1030 ' ' ASP . . . . . 0.518 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 16.7 t70 61.77 -5.24 0.15 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 110.811 -2.904 . . . . 0.0 111.62 -169.217 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1031 ' ' LEU . . . . . 0.563 ' H ' ' C ' ' A' 1029 ' ' LYS . 36.7 tp 74.56 -34.33 0.27 Allowed 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 127.67 2.388 . . . . 0.0 111.892 -177.312 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 8.1 t -68.27 -15.46 63.58 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -175.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.483 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 93.4 mt-30 . . . . . 0 C--N 1.333 -0.148 0 C-N-CA 120.429 -0.509 . . . . 0.0 110.764 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 927' ' ' HIS . . . . . 0.456 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 46.1 m-70 . . . . . 0 N--CA 1.421 -1.913 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.09 115.73 0.97 Allowed 'General case' 0 N--CA 1.413 -2.314 0 N-CA-C 101.495 -3.52 . . . . 0.0 101.495 172.082 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -142.22 132.08 24.32 Favored 'General case' 0 C--N 1.274 -2.686 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 177.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -128.69 140.43 51.75 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -177.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.64 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 38.7 m -70.64 126.72 30.4 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.141 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -96.35 166.36 11.75 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -161.07 149.31 15.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-O 121.204 0.526 . . . . 0.0 110.719 -172.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.571 ' O ' ' HA ' ' A' 1022 ' ' ARG . 14.8 p -145.33 175.07 2.69 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 176.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.606 ' CD2' ' HD3' ' A' 1020 ' ' ARG . 75.8 m-85 -135.62 151.47 50.28 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.495 ' O ' ' HA ' ' A' 1020 ' ' ARG . 13.0 tt0 -123.2 118.09 26.84 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 178.475 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -106.82 141.11 38.58 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.831 0.824 . . . . 0.0 111.121 -174.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 67.5 mt-10 -136.65 157.66 46.25 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 175.319 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 40.7 t -144.69 141.63 29.45 Favored 'General case' 0 N--CA 1.426 -1.632 0 CA-C-O 121.073 0.463 . . . . 0.0 109.997 -178.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.612 HH21 ' HB2' ' A' 1016 ' ' HIS . 21.6 ptt180 -139.03 159.61 41.73 Favored 'General case' 0 N--CA 1.435 -1.203 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 177.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -71.89 161.42 78.84 Favored Pre-proline 0 C--N 1.303 -1.452 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 170.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 942' ' ' PRO . . . . . 0.554 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 31.4 Cg_exo -61.84 86.16 0.1 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 121.374 1.383 . . . . 0.0 111.031 175.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 103.15 70.18 0.83 Allowed Glycine 0 N--CA 1.434 -1.484 0 N-CA-C 107.716 -2.154 . . . . 0.0 107.716 -173.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.62 -140.57 2.9 Favored Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 120.35 -0.929 . . . . 0.0 113.647 -175.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -127.97 122.62 32.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.702 -0.749 . . . . 0.0 111.532 -173.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.613 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 74.6 m95 -70.47 135.59 48.77 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.283 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -142.88 178.78 1.36 Allowed Pre-proline 0 C--N 1.302 -1.482 0 N-CA-C 103.073 -2.936 . . . . 0.0 103.073 -179.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.05 124.29 15.91 Favored 'Trans proline' 0 C--O 1.238 0.501 0 CA-C-N 122.735 2.012 . . . . 0.0 111.423 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -49.23 -49.99 40.52 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.626 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 173.88 -38.7 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 951' ' ' ASP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 960' ' ' LYS . 46.1 m-20 -122.5 116.07 23.3 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 174.035 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 6.6 m -63.64 -59.51 4.51 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -174.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 953' ' ' TYR . . . . . 0.472 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 91.7 m-85 -110.03 135.3 51.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.788 0.328 . . . . 0.0 110.425 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 954' ' ' THR . . . . . 0.434 ' HA ' ' HA ' ' A' ' 960' ' ' LYS . 58.5 p -142.74 179.91 6.72 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.55 0.691 . . . . 0.0 110.183 -171.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -98.21 174.36 6.55 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 104.911 -2.255 . . . . 0.0 104.911 172.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.54 -34.96 52.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 118.587 0.631 . . . . 0.0 110.952 174.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -86.36 -0.54 56.13 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 96.6 -10.12 66.69 Favored Glycine 0 CA--C 1.501 -0.782 0 C-N-CA 119.739 -1.219 . . . . 0.0 113.308 177.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -51.64 99.2 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 960' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 954' ' ' THR . 0.2 OUTLIER -60.36 137.9 58.06 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -177.895 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -134.24 -178.98 5.29 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.397 -175.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 962' ' ' ALA . . . . . 0.537 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -70.72 153.06 43.15 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 172.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 3.7 m -76.32 158.51 81.53 Favored Pre-proline 0 C--N 1.313 -1.017 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -178.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.596 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 53.9 Cg_exo -44.94 -31.73 5.68 Favored 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 124.263 3.308 . . . . 0.0 116.317 -178.465 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.8 t -71.61 -45.54 61.83 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 966' ' ' GLU . . . . . 0.537 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 35.2 mt-10 -65.19 -25.88 67.9 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.373 175.055 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.522 HD12 ' HA ' ' A' ' 964' ' ' PRO . 57.4 mt -71.43 112.05 7.24 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.702 0.763 . . . . 0.0 110.208 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 20.6 p -118.77 169.99 9.38 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.881 -172.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 20.3 p -83.91 129.21 59.9 Favored Pre-proline 0 N--CA 1.443 -0.781 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.646 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.614 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 53.5 Cg_endo -82.59 163.28 16.64 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.931 2.421 . . . . 0.0 110.642 177.437 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -59.61 104.82 0.23 Allowed 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.02 1.813 . . . . 0.0 110.657 174.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.511 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 121.19 -1.67 11.57 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.066 -177.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.614 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.4 m95 -136.81 141.57 42.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 117.256 0.528 . . . . 0.0 111.167 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.539 ' HB3' ' OE1' ' A' 1033 ' ' GLN . 2.9 pt-20 -117.94 148.37 42.25 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -177.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.54 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 85.5 m95 -84.64 98.36 10.15 Favored 'General case' 0 C--N 1.296 -1.732 0 C-N-CA 119.169 -1.013 . . . . 0.0 110.327 167.033 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 976' ' ' GLU . . . . . 0.428 ' HG2' ' HE3' ' A' 1026 ' ' LYS . 8.9 tp10 -67.83 -41.19 83.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.06 -1.427 . . . . 0.0 108.21 176.53 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 977' ' ' ASP . . . . . 0.554 ' HB3' ' NE ' ' A' 1025 ' ' ARG . 64.9 m-20 -84.1 158.68 21.32 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.842 -177.635 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -75.53 -63.79 1.21 Allowed 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 -175.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -154.21 144.38 22.02 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -171.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.596 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 6.8 m95 -68.4 130.06 41.76 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -173.482 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 981' ' ' SER . . . . . 0.532 ' O ' ' HA ' ' A' 1023 ' ' LEU . 22.9 t -136.18 -175.12 3.88 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 982' ' ' TYR . . . . . 0.58 ' CD2' ' HA ' ' A' ' 991' ' ' LYS . 0.1 OUTLIER -77.05 151.82 35.35 Favored 'General case' 0 C--N 1.295 -1.791 0 CA-C-N 118.986 0.812 . . . . 0.0 112.179 -175.394 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.554 ' HB2' HG13 ' A' 1024 ' ' VAL . 54.0 t0 -91.0 125.5 35.82 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 172.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.3 pp -119.06 6.76 6.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 985' ' ' ASN . . . . . 0.548 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 67.1 t30 -93.63 18.36 10.21 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.801 0.81 . . . . 0.0 110.767 -172.066 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.548 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 5.7 mpt_? -139.86 -176.35 4.55 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -177.25 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -75.29 75.55 2.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.991 0.9 . . . . 0.0 110.302 176.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.601 HG12 ' HG2' ' A' ' 994' ' ' GLU . 9.7 m -143.92 152.81 15.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.169 -1.378 . . . . 0.0 108.531 -177.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -55.8 170.52 0.28 Allowed 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 123.64 0.776 . . . . 0.0 111.966 177.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -57.5 -33.39 67.98 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 121.374 0.607 . . . . 0.0 111.074 174.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 991' ' ' LYS . . . . . 0.58 ' HA ' ' CD2' ' A' ' 982' ' ' TYR . 81.6 mttt -96.38 6.79 48.02 Favored 'General case' 0 N--CA 1.428 -1.546 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.931 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 93.62 -14.2 65.83 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.058 175.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.571 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 74.2 m95 -50.84 135.34 24.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.199 1.0 . . . . 0.0 113.262 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.601 ' HG2' HG12 ' A' ' 988' ' ' VAL . 41.7 mt-10 -114.61 148.75 37.64 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.407 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.768 ' O ' ' HA ' ' A' 1008 ' ' TRP . 3.9 t80 -81.37 100.9 9.49 Favored 'General case' 0 C--O 1.199 -1.561 0 CA-C-N 112.985 -1.916 . . . . 0.0 108.966 -177.495 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -123.29 101.64 0.71 Allowed Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 119.125 -1.512 . . . . 0.0 111.895 173.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.563 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.7 OUTLIER -102.57 151.04 6.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 O-C-N 120.864 -1.374 . . . . 0.0 107.741 179.65 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 15.8 m -127.91 102.77 6.91 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 15.8 pt -86.89 112.5 47.67 Favored Pre-proline 0 C--N 1.319 -0.721 0 C-N-CA 120.08 -0.648 . . . . 0.0 110.935 174.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -70.55 147.04 56.89 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.72 2.28 . . . . 0.0 112.975 -176.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -83.6 136.04 26.13 Favored 'Cis proline' 0 N--CA 1.451 -0.999 0 C-N-CA 122.931 -1.695 . . . . 0.0 112.993 -0.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 39.3 t0 167.23 154.98 0.03 OUTLIER 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 111.524 -2.58 . . . . 0.0 105.359 -176.215 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -119.11 -40.9 2.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 118.704 -1.199 . . . . 0.0 112.346 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 70.2 mttt -104.29 132.15 21.24 Favored Pre-proline 0 C--N 1.31 -1.143 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -176.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.443 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 74.5 Cg_exo -56.05 125.32 18.71 Favored 'Trans proline' 0 CA--C 1.515 -0.427 0 C-N-CA 123.117 2.545 . . . . 0.0 111.019 170.504 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -94.43 -48.07 6.29 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 35.4 t -85.15 134.72 34.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.44 -1.255 . . . . 0.0 111.093 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.768 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 54.4 m95 -131.54 136.41 47.83 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 124.457 1.098 . . . . 0.0 108.48 176.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.769 HG12 ' H ' ' A' 1010 ' ' ALA . 11.2 t -147.32 -164.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 103.664 -2.717 . . . . 0.0 103.664 -176.245 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1010 ' ' ALA . . . . . 0.769 ' H ' HG12 ' A' 1009 ' ' VAL . . . -114.98 12.16 16.69 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 120.381 1.446 . . . . 0.0 111.755 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -88.08 -166.36 1.57 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -177.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.44 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 8.5 tp10 -158.74 105.96 1.84 Allowed 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -175.327 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.545 ' O ' ' HB2' ' A' 1016 ' ' HIS . 56.5 mtpt -111.69 151.44 28.88 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 177.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1014 ' ' MET . . . . . 0.405 ' C ' ' H ' ' A' 1016 ' ' HIS . 50.8 ttp -53.24 -37.54 62.17 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 123.881 0.738 . . . . 0.0 111.013 175.186 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1015 ' ' TYR . . . . . 0.554 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 97.8 m-85 -69.2 16.08 0.06 Allowed 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 177.009 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.612 ' HB2' HH21 ' A' ' 940' ' ' ARG . 0.2 OUTLIER -79.54 115.91 19.44 Favored 'General case' 0 CA--C 1.499 -1.019 0 O-C-N 121.906 -0.496 . . . . 0.0 110.981 176.309 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 1017 ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 10.9 p -95.95 -27.03 15.35 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.701 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -139.15 153.82 48.0 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.693 -1.139 . . . . 0.0 111.648 -175.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -156.73 151.26 25.55 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 170.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.606 ' HD3' ' CD2' ' A' ' 935' ' ' TYR . 2.7 ptp180 -149.4 165.21 32.76 Favored 'General case' 0 C--O 1.193 -1.871 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 175.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.594 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.3 ptt180 -145.06 148.03 33.23 Favored 'General case' 0 C--N 1.285 -2.229 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.699 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.571 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 41.2 ttm180 -89.4 122.52 32.69 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.532 ' HA ' ' O ' ' A' ' 981' ' ' SER . 78.0 mt -98.27 125.68 43.46 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 103.706 -2.701 . . . . 0.0 103.706 168.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.554 HG13 ' HB2' ' A' ' 983' ' ' ASP . 2.5 m -106.5 151.16 8.57 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.069 -173.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.772 ' NE ' ' HA ' ' A' 1025 ' ' ARG . 0.5 OUTLIER -159.09 110.08 2.05 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 125.427 1.705 . . . . 0.0 112.614 169.421 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.64 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 3.2 tmmm? -78.21 146.86 34.72 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.398 0.618 . . . . 0.0 109.409 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.54 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 6.0 ptm180 -135.75 146.96 48.21 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 -171.555 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.456 ' O ' ' HG2' ' A' ' 974' ' ' GLU . 34.3 ttmt -129.94 136.27 49.28 Favored 'General case' 0 C--O 1.193 -1.873 0 O-C-N 123.429 0.456 . . . . 0.0 110.573 -172.319 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 38.7 ttmt -85.82 -22.3 27.69 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 123.466 1.603 . . . . 0.0 107.668 -176.475 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 9.3 t70 56.98 12.17 1.15 Allowed 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 111.431 -2.622 . . . . 0.0 110.044 -171.227 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1031 ' ' LEU . . . . . 0.456 ' HB2' ' HA ' ' A' ' 927' ' ' HIS . 22.6 tp 69.24 -52.1 0.6 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.635 1.974 . . . . 0.0 111.659 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 10.3 t -69.44 -10.08 56.43 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -173.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.539 ' OE1' ' HB3' ' A' ' 974' ' ' GLU . 23.5 mt-30 . . . . . 0 C--N 1.329 -0.317 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.255 177.284 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 . . . . . 0 CA--C 1.491 -1.322 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 928' ' ' THR . . . . . 0.483 ' HB ' ' HB3' ' A' 1029 ' ' LYS . 1.5 m 63.39 90.97 0.08 Allowed 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.799 -169.361 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -135.95 129.11 31.67 Favored 'General case' 0 N--CA 1.42 -1.94 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 173.158 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.452 ' O ' ' HG2' ' A' 1027 ' ' ARG . 70.8 t80 -122.62 139.86 53.46 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -178.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.564 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 9.0 m -76.01 121.14 22.31 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.445 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -99.54 157.38 16.49 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 -175.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.672 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 0.0 OUTLIER -159.06 156.29 28.97 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 119.433 1.015 . . . . 0.0 111.668 -175.489 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.476 HG11 HD11 ' A' ' 967' ' ' LEU . 20.3 m -145.99 142.71 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 174.581 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.486 ' CG ' ' HD3' ' A' 1020 ' ' ARG . 98.5 m-85 -101.15 113.67 26.92 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 120.861 -1.149 . . . . 0.0 111.516 178.353 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.561 ' HB3' ' CE2' ' A' ' 953' ' ' TYR . 3.8 pt20 -81.41 137.01 35.72 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 171.573 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 937' ' ' ASN . . . . . 0.884 ' HB3' ' HB3' ' A' 1020 ' ' ARG . 21.0 p-10 -140.56 163.23 33.41 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -175.2 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.657 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 43.2 mt-10 -136.67 161.35 36.17 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 113.334 -1.757 . . . . 0.0 107.422 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 19.6 m -138.46 147.61 43.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 120.7 0.286 . . . . 0.0 111.143 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.594 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 16.2 ptt180 -156.07 162.47 40.28 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 123.59 0.756 . . . . 0.0 109.756 -173.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -60.33 162.43 10.86 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 171.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -67.96 78.37 0.57 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.071 1.848 . . . . 0.0 112.32 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 105.28 74.31 0.94 Allowed Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 108.533 -1.827 . . . . 0.0 108.533 -175.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -165.41 -150.1 6.11 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.236 -176.109 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -101.28 130.02 47.35 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.991 -0.604 . . . . 0.0 110.07 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.657 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 45.6 m95 -82.79 139.67 33.42 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 177.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -117.52 163.79 22.28 Favored Pre-proline 0 C--N 1.292 -1.932 0 N-CA-C 101.279 -3.6 . . . . 0.0 101.279 171.275 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.22 149.02 47.07 Favored 'Trans proline' 0 C--O 1.238 0.49 0 CA-C-N 121.456 1.556 . . . . 0.0 110.353 175.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.14 -171.07 0.1 Allowed 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.161 0.505 . . . . 0.0 110.787 177.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.26 -38.61 30.58 Favored 'General case' 0 CA--C 1.476 -1.885 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -117.94 99.01 6.63 Favored 'General case' 0 N--CA 1.397 -3.085 0 N-CA-C 103.804 -2.665 . . . . 0.0 103.804 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 27.3 m -61.5 -50.35 73.09 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 123.342 0.401 . . . . 0.0 111.365 -172.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 953' ' ' TYR . . . . . 0.561 ' CE2' ' HB3' ' A' ' 936' ' ' GLN . 81.4 m-85 -101.83 132.44 47.59 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.167 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 18.4 p -142.73 177.22 8.47 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 123.393 0.677 . . . . 0.0 110.835 -171.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -104.97 171.17 7.46 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 171.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.88 -37.44 52.25 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 118.971 0.805 . . . . 0.0 110.159 174.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -73.23 -10.19 59.51 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 95.07 -7.79 69.78 Favored Glycine 0 CA--C 1.5 -0.872 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.15 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -58.7 105.76 0.34 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -47.01 124.0 5.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.54 178.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -115.76 168.54 9.95 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.903 -176.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -71.6 157.0 38.75 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.882 177.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.1 m -89.08 149.9 44.1 Favored Pre-proline 0 N--CA 1.435 -1.192 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.566 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 2.8 Cg_exo -43.57 -38.51 9.0 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 125.001 3.801 . . . . 0.0 116.925 -176.352 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 28.4 m -74.3 -41.8 60.59 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 122.143 0.973 . . . . 0.0 109.391 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -64.57 -28.77 69.86 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.041 -1.436 . . . . 0.0 110.565 173.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.482 HD13 ' CH2' ' A' ' 980' ' ' TRP . 39.6 mt -74.08 120.17 19.29 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 121.776 0.798 . . . . 0.0 110.616 178.22 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 22.0 p -124.38 169.09 12.17 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.042 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 16.9 p -90.44 138.96 26.66 Favored Pre-proline 0 C--N 1.312 -1.054 0 C-N-CA 120.459 -0.496 . . . . 0.0 109.906 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.616 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 92.8 Cg_endo -79.2 172.38 14.81 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.912 2.408 . . . . 0.0 111.066 173.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_exo -45.88 -43.52 19.45 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 123.211 2.607 . . . . 0.0 114.329 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.965 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . -102.76 22.79 35.95 Favored Glycine 0 N--CA 1.434 -1.438 0 C-N-CA 121.478 -0.391 . . . . 0.0 113.614 -175.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.616 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 78.1 m95 -135.42 138.11 42.93 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 117.946 0.873 . . . . 0.0 110.743 172.561 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.602 ' HB3' ' O ' ' A' 1028 ' ' LYS . 7.3 tp10 -118.85 131.02 56.06 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 125.671 1.588 . . . . 0.0 108.315 -175.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.443 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 82.5 m95 -77.07 98.75 5.11 Favored 'General case' 0 C--N 1.306 -1.288 0 O-C-N 120.92 -1.113 . . . . 0.0 110.129 173.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -69.72 -35.15 74.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 177.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 977' ' ' ASP . . . . . 0.768 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 1.5 m-20 -87.22 151.43 23.17 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.383 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.65 -65.08 0.75 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -170.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -153.81 146.39 24.13 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -171.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.589 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 19.7 m95 -60.62 125.64 24.47 Favored 'General case' 0 CA--C 1.502 -0.903 0 O-C-N 124.325 1.016 . . . . 0.0 109.834 -169.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 981' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' 1023 ' ' LEU . 18.0 m -111.95 -171.74 1.9 Allowed 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 -175.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -107.26 149.36 27.85 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 119.804 1.184 . . . . 0.0 109.224 175.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.532 ' O ' HG21 ' A' ' 988' ' ' VAL . 52.4 t0 -86.59 119.72 27.13 Favored 'General case' 0 C--N 1.317 -0.815 0 O-C-N 123.206 0.316 . . . . 0.0 110.216 -175.245 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 24.2 pt -120.11 13.33 6.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 122.227 1.013 . . . . 0.0 108.97 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.59 18.86 6.87 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.845 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -137.22 -176.24 4.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.401 -178.385 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.83 81.17 8.66 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 172.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.532 HG21 ' O ' ' A' ' 983' ' ' ASP . 16.5 m -134.66 162.67 38.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 114.429 -1.259 . . . . 0.0 109.555 -176.153 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -54.7 170.27 0.17 Allowed 'General case' 0 C--O 1.239 0.551 0 O-C-N 123.976 0.798 . . . . 0.0 110.026 170.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -53.04 -34.51 56.77 Favored 'General case' 0 CA--C 1.5 -0.973 0 CA-C-O 121.993 0.902 . . . . 0.0 110.538 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 991' ' ' LYS . . . . . 0.469 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 26.3 mttp -103.63 11.83 35.61 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.401 -1.272 . . . . 0.0 111.607 -174.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 90.73 -13.87 64.59 Favored Glycine 0 C--N 1.331 0.285 0 CA-C-N 116.739 -0.21 . . . . 0.0 113.483 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.634 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 97.7 m95 -51.9 146.78 7.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.566 0.698 . . . . 0.0 112.47 176.151 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -135.68 150.46 49.59 Favored 'General case' 0 C--O 1.252 1.198 0 CA-C-O 122.24 1.019 . . . . 0.0 112.216 -177.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.841 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 50.5 t80 -80.87 93.2 6.23 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 111.792 -2.458 . . . . 0.0 112.208 -172.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 996' ' ' GLY . . . . . 0.612 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -118.31 93.72 0.58 Allowed Glycine 0 CA--C 1.49 -1.478 0 C-N-CA 119.44 -1.362 . . . . 0.0 111.243 177.346 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.571 HG22 ' HA ' ' A' 1016 ' ' HIS . 12.0 pt -103.83 148.59 8.51 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.883 0 C-N-CA 118.204 -1.399 . . . . 0.0 108.556 -178.399 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 11.6 t -138.72 132.21 30.4 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.355 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.3 mp -114.45 114.47 45.12 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.03 136.34 64.74 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 123.068 2.512 . . . . 0.0 113.113 -178.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -85.23 138.42 25.69 Favored 'Cis proline' 0 N--CA 1.449 -1.11 0 C-N-CA 122.774 -1.761 . . . . 0.0 113.898 1.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 7.9 t0 162.02 126.52 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 111.271 -2.695 . . . . 0.0 104.624 -179.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -85.19 -43.04 14.16 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.739 -168.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 84.7 mttt -127.14 141.34 40.42 Favored Pre-proline 0 C--N 1.309 -1.157 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.347 -174.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -50.26 127.88 21.24 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.617 2.211 . . . . 0.0 110.614 169.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 21.2 pttm -110.62 15.52 21.98 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.012 -0.995 . . . . 0.0 108.484 -177.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 42.6 t -146.95 137.13 23.46 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.448 -175.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.673 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 59.7 m95 -137.62 135.89 36.99 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 125.367 1.667 . . . . 0.0 107.085 175.595 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.415 ' HB ' ' HB3' ' A' ' 995' ' ' TYR . 96.5 t -144.95 165.74 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 -171.574 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -82.99 -2.16 54.47 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -175.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -112.23 122.09 46.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 119.018 0.826 . . . . 0.0 112.538 -174.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.435 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 52.0 tp10 -72.13 120.58 17.93 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 174.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.538 ' H ' ' CE1' ' A' 1016 ' ' HIS . 94.5 mttt -124.66 155.79 38.6 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.004 -178.45 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 52.3 ttp -53.12 -40.08 63.92 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 123.863 0.727 . . . . 0.0 112.554 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -52.49 -7.98 0.08 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.568 1.321 . . . . 0.0 114.568 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.841 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 13.5 m80 -57.85 154.8 11.46 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 122.53 1.157 . . . . 0.0 112.993 179.115 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -161.55 -33.41 0.05 OUTLIER 'General case' 0 C--N 1.294 -1.827 0 CA-C-N 111.295 -2.684 . . . . 0.0 106.599 -167.799 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 14.2 m80 -135.21 141.49 45.83 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.697 -1.592 . . . . 0.0 108.601 174.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1019 ' ' ARG . . . . . 0.634 ' HG2' ' CE3' ' A' ' 993' ' ' TRP . 43.3 ttt180 -152.47 142.49 22.22 Favored 'General case' 0 CA--C 1.483 -1.598 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.884 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . 2.5 ptp180 -150.57 167.89 25.89 Favored 'General case' 0 C--N 1.294 -1.822 0 O-C-N 124.074 0.859 . . . . 0.0 109.626 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.552 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 26.5 ptt180 -148.62 151.47 35.05 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.663 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.672 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 32.5 ttm180 -90.21 129.45 36.47 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.261 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' A' ' 981' ' ' SER . 84.8 mt -94.46 125.87 39.38 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 167.491 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.517 HG13 ' HB2' ' A' ' 983' ' ' ASP . 2.5 m -105.46 136.62 38.76 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.803 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.366 -174.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.768 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -144.24 109.75 5.2 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 124.641 1.213 . . . . 0.0 111.726 168.639 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.668 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -78.73 141.98 37.43 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -178.703 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.509 ' N ' ' HD2' ' A' 1026 ' ' LYS . 12.1 ptm180 -135.78 143.19 45.1 Favored 'General case' 0 C--O 1.201 -1.452 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -171.483 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.602 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.7 ttmt -125.9 138.53 53.79 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 123.606 0.566 . . . . 0.0 109.65 -175.261 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.666 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.7 ttmt -89.33 -22.3 22.7 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 123.285 1.517 . . . . 0.0 108.124 -178.132 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 21.6 t70 55.45 21.08 4.06 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 111.098 -2.774 . . . . 0.0 109.331 -169.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 42.8 tp 57.53 -41.54 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.849 2.059 . . . . 0.0 115.227 -174.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 9.4 t -69.15 -23.6 63.98 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 122.953 0.501 . . . . 0.0 112.32 -170.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.965 ' HB3' ' HA2' ' A' ' 972' ' ' GLY . 3.8 mt-30 . . . . . 0 C--N 1.322 -0.596 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -175.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 31.0 m-70 . . . . . 0 CA--C 1.493 -1.249 0 N-CA-C 105.37 -2.085 . . . . 0.0 105.37 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 928' ' ' THR . . . . . 0.661 ' HB ' ' HB2' ' A' 1029 ' ' LYS . 1.0 OUTLIER -143.72 120.01 10.89 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 102.132 -3.285 . . . . 0.0 102.132 168.442 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.521 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.0 OUTLIER -142.16 168.36 19.92 Favored 'General case' 0 C--N 1.272 -2.783 0 C-N-CA 118.865 -1.134 . . . . 0.0 110.797 -178.375 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.642 ' O ' ' HG2' ' A' 1027 ' ' ARG . 54.7 t80 -157.19 124.7 5.31 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.638 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 17.8 m -75.42 126.85 31.84 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 118.897 0.771 . . . . 0.0 109.617 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -104.72 159.18 15.99 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 -177.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.491 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -153.42 145.01 23.31 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -174.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.469 HG22 ' H ' ' A' ' 935' ' ' TYR . 12.0 p -139.5 172.89 12.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 105.365 -2.087 . . . . 0.0 105.365 178.106 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.582 ' HA ' ' O ' ' A' 1021 ' ' ARG . 54.8 m-85 -132.52 138.88 47.67 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 118.7 0.682 . . . . 0.0 110.248 -174.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.616 ' O ' ' HA ' ' A' 1020 ' ' ARG . 24.3 tt0 -113.77 126.21 54.97 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -176.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 937' ' ' ASN . . . . . 0.498 ' HA ' ' O ' ' A' 1019 ' ' ARG . 19.3 p-10 -124.25 141.31 52.17 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 122.127 0.965 . . . . 0.0 113.432 178.419 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 35.8 mt-10 -115.31 158.5 22.3 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 104.972 -2.232 . . . . 0.0 104.972 171.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 36.8 m -139.62 152.58 46.9 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 119.007 0.821 . . . . 0.0 109.846 -172.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.682 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 24.6 ptt180 -156.99 160.95 39.53 Favored 'General case' 0 N--CA 1.44 -0.953 0 O-C-N 124.548 1.155 . . . . 0.0 109.499 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -78.55 161.26 70.29 Favored Pre-proline 0 C--N 1.312 -1.038 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 170.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -63.36 87.09 0.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 121.374 1.383 . . . . 0.0 111.273 172.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.22 1.93 5.17 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -176.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 944' ' ' GLY . . . . . 0.611 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -100.21 -178.68 30.19 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 109.88 -1.288 . . . . 0.0 109.88 177.064 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -108.38 163.1 13.5 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 171.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.682 ' CZ3' ' HG2' ' A' ' 940' ' ' ARG . 53.5 m95 -83.87 137.61 33.59 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 117.901 0.318 . . . . 0.0 110.756 -173.032 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -129.78 139.1 34.66 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 170.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.498 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 6.8 Cg_endo -50.28 123.4 11.05 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.691 2.261 . . . . 0.0 112.777 -176.151 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -52.04 151.2 3.83 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -57.3 -45.97 83.64 Favored 'General case' 0 CA--C 1.484 -1.561 0 CA-C-N 114.799 -1.091 . . . . 0.0 108.453 172.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 951' ' ' ASP . . . . . 0.45 ' HB3' ' HG2' ' A' ' 960' ' ' LYS . 52.8 m-20 -96.4 77.12 2.97 Favored 'General case' 0 N--CA 1.414 -2.267 0 N-CA-C 105.113 -2.18 . . . . 0.0 105.113 175.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 3.9 m -63.77 -41.73 97.91 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.439 -168.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 953' ' ' TYR . . . . . 0.436 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 66.9 m-85 -108.74 137.73 46.21 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 122.02 0.914 . . . . 0.0 112.18 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 4.6 p -144.87 174.47 10.97 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 125.485 1.514 . . . . 0.0 108.257 -170.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -106.07 178.69 4.49 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 173.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.47 -28.35 13.02 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -93.62 -13.16 27.96 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.934 -0.479 . . . . 0.0 111.455 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 107.33 -2.95 34.82 Favored Glycine 0 CA--C 1.491 -1.461 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.099 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -58.07 107.33 0.46 Allowed 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 960' ' ' LYS . . . . . 0.45 ' HG2' ' HB3' ' A' ' 951' ' ' ASP . 1.1 tmtp? -47.03 119.64 2.66 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 124.556 1.16 . . . . 0.0 110.169 178.565 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.45 179.59 4.07 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.047 -0.978 . . . . 0.0 110.306 -175.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 962' ' ' ALA . . . . . 0.47 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -78.4 156.37 29.5 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.813 178.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 13.0 p -76.21 161.23 75.87 Favored Pre-proline 0 N--CA 1.437 -1.096 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 178.067 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 964' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -61.12 -18.28 57.17 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 122.716 2.278 . . . . 0.0 112.454 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 4.2 m -74.27 -48.83 26.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 174.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 966' ' ' GLU . . . . . 0.47 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 42.4 mt-10 -65.26 -37.31 86.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.499 -1.228 . . . . 0.0 112.389 177.461 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.47 111.0 2.14 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.236 0.541 . . . . 0.0 110.396 -177.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 73.0 p -107.24 165.36 11.43 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.863 -176.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.605 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 9.1 p -97.81 128.6 33.57 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.705 172.347 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.62 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 61.3 Cg_endo -71.11 169.0 21.66 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.488 2.125 . . . . 0.0 110.34 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -46.91 -34.78 16.96 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.125 2.55 . . . . 0.0 114.685 -178.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.544 ' O ' ' HG2' ' A' 1029 ' ' LYS . . . -101.43 8.42 56.85 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 119.943 -1.122 . . . . 0.0 112.995 -177.188 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.62 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 76.1 m95 -124.2 133.47 53.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.829 0.823 . . . . 0.0 110.451 179.128 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.546 ' HB3' ' O ' ' A' 1028 ' ' LYS . 5.5 tp10 -126.01 119.45 27.71 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 126.563 1.945 . . . . 0.0 109.569 -173.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.67 ' CE3' ' HG2' ' A' 1025 ' ' ARG . 90.2 m95 -70.35 104.56 2.73 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 121.416 -0.802 . . . . 0.0 111.716 -178.033 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -70.49 -38.55 74.37 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.563 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 977' ' ' ASP . . . . . 0.545 ' HB2' ' HG3' ' A' 1025 ' ' ARG . 83.5 m-20 -78.46 152.67 31.98 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.269 0.557 . . . . 0.0 111.811 -176.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -88.69 107.57 19.01 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 174.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . 57.13 173.04 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 123.37 1.557 . . . . 0.0 114.405 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.459 ' HA ' ' O ' ' A' 1024 ' ' VAL . 24.5 m95 -91.2 124.09 35.15 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 112.851 -1.977 . . . . 0.0 108.08 177.495 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 15.1 m -124.31 155.62 38.37 Favored 'General case' 0 C--O 1.206 -1.211 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -175.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 982' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' 1022 ' ' ARG . 11.0 p90 -74.46 144.68 44.1 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 119.044 0.838 . . . . 0.0 111.206 -174.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.466 ' HB3' ' HD2' ' A' 1022 ' ' ARG . 18.0 t70 -102.67 126.16 49.66 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.633 -174.271 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.0 pp -114.86 26.5 3.69 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.111 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -109.25 27.27 9.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 123.489 1.614 . . . . 0.0 107.31 -178.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.607 ' HG2' ' H ' ' A' ' 987' ' ' ALA . 11.3 ttt180 -141.24 -178.58 5.66 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 -178.394 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.607 ' H ' ' HG2' ' A' ' 986' ' ' ARG . . . -89.0 82.0 6.75 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 119.451 1.023 . . . . 0.0 109.732 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 983' ' ' ASP . 28.3 m -128.41 -172.15 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 114.337 -1.301 . . . . 0.0 109.289 -178.346 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -92.9 -178.8 4.93 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 177.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -57.07 -33.45 67.27 Favored 'General case' 0 CA--C 1.494 -1.181 0 C-N-CA 123.987 0.915 . . . . 0.0 111.721 179.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -108.25 17.41 22.25 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.222 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 86.13 -23.06 10.08 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.12 -0.945 . . . . 0.0 113.588 177.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.879 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 79.0 m95 -56.25 111.68 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.695 0.759 . . . . 0.0 112.5 -177.704 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.707 ' HG3' ' CE3' ' A' 1008 ' ' TRP . 7.4 pt-20 -98.62 157.25 16.37 Favored 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 124.244 1.018 . . . . 0.0 109.944 -178.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.514 ' HB3' ' H ' ' A' 1009 ' ' VAL . 59.3 t80 -64.99 99.08 0.32 Allowed 'General case' 0 C--O 1.211 -0.953 0 CA-C-N 111.803 -2.453 . . . . 0.0 113.002 -174.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -120.9 114.93 2.75 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 119.462 -1.351 . . . . 0.0 112.573 172.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.413 ' HA ' ' H ' ' A' 1017 ' ' THR . 1.6 pt -118.57 151.84 20.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 106.131 -1.803 . . . . 0.0 106.131 174.645 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 76.7 m -133.37 97.32 3.93 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-O 122.168 0.985 . . . . 0.0 110.589 174.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.401 ' HA ' ' HD3' ' A' 1000 ' ' PRO . 77.0 mt -97.42 115.52 65.75 Favored Pre-proline 0 C--N 1.317 -0.845 0 CA-C-N 114.014 -1.448 . . . . 0.0 109.184 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 999' ' ' ILE . 27.0 Cg_exo -60.57 141.87 96.43 Favored 'Trans proline' 0 C--O 1.241 0.649 0 C-N-CA 122.82 2.347 . . . . 0.0 112.864 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1001 ' ' PRO . . . . . 0.442 ' O ' ' HB2' ' A' 1002 ' ' ASP . 9.7 Cg_endo -90.41 141.13 13.37 Favored 'Cis proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.862 -1.724 . . . . 0.0 114.365 0.12 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1002 ' ' ASP . . . . . 0.442 ' HB2' ' O ' ' A' 1001 ' ' PRO . 7.8 t0 160.17 166.59 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 111.867 -2.424 . . . . 0.0 106.521 176.614 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -117.04 -33.63 4.66 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 174.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 33.8 mttm -105.88 134.12 19.88 Favored Pre-proline 0 N--CA 1.429 -1.507 0 CA-C-N 114.806 -1.088 . . . . 0.0 113.463 -171.125 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.572 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 31.7 Cg_exo -66.26 126.28 15.43 Favored 'Trans proline' 0 C--N 1.329 -0.463 0 C-N-CA 122.775 2.317 . . . . 0.0 109.782 167.345 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -84.03 -57.39 3.21 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 122.217 1.008 . . . . 0.0 109.409 -177.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 3.7 m -87.5 136.01 33.11 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 112.742 -2.026 . . . . 0.0 111.608 -173.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.707 ' CE3' ' HG3' ' A' ' 994' ' ' GLU . 60.4 m95 -134.65 137.2 43.42 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.514 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 11.0 m -163.11 -173.31 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -175.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -97.3 97.6 9.28 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 175.283 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -165.27 167.37 18.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.426 -176.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.59 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.9 tp10 -148.2 101.24 3.25 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-O 122.066 0.936 . . . . 0.0 109.553 178.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 90.4 mttt -118.0 135.92 53.85 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 113.662 -1.608 . . . . 0.0 107.363 174.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 56.8 ttp -44.87 -22.77 0.1 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -177.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -68.01 -9.03 42.5 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 178.023 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.59 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 2.5 m80 -50.49 107.7 0.18 Allowed 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 123.754 0.821 . . . . 0.0 112.419 176.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1017 ' ' THR . . . . . 0.413 ' H ' ' HA ' ' A' ' 997' ' ' ILE . 2.6 m -103.21 -21.38 13.87 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.78 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 1.2 m80 -145.54 123.3 11.9 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.576 -172.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1019 ' ' ARG . . . . . 0.879 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 17.8 mmt180 -100.36 136.36 40.37 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 170.147 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.616 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 41.8 ttm180 -140.25 161.97 36.39 Favored 'General case' 0 C--O 1.197 -1.674 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 178.102 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.582 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.6 ptt180 -159.28 159.21 33.8 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 118.068 0.395 . . . . 0.0 110.257 174.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.491 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.5 ttm180 -90.6 120.99 32.13 Favored 'General case' 0 N--CA 1.424 -1.771 0 O-C-N 123.842 0.714 . . . . 0.0 109.934 177.134 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.405 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 65.7 mt -102.66 126.89 49.92 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 104.648 -2.352 . . . . 0.0 104.648 167.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 6.9 m -110.29 151.54 12.48 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.895 0 CA-C-O 122.032 0.92 . . . . 0.0 111.667 -175.426 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.67 ' HG2' ' CE3' ' A' ' 975' ' ' TRP . 0.6 OUTLIER -149.53 111.49 4.6 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 113.054 -1.884 . . . . 0.0 108.997 169.017 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.5 tmmm? -70.86 138.05 49.9 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.654 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 14.1 ptm180 -122.02 150.95 41.37 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 104.092 -2.559 . . . . 0.0 104.092 -173.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.546 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 71.3 tttt -144.8 132.07 20.63 Favored 'General case' 0 C--N 1.283 -2.31 0 O-C-N 123.265 0.353 . . . . 0.0 110.399 -167.758 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.661 ' HB2' ' HB ' ' A' ' 928' ' ' THR . 24.3 mtpp -88.58 -24.42 22.87 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 123.685 1.707 . . . . 0.0 108.049 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1030 ' ' ASP . . . . . 0.482 ' HB3' HG22 ' A' 1032 ' ' THR . 29.8 t0 50.21 10.25 0.05 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 110.895 -2.866 . . . . 0.0 112.742 -168.326 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1031 ' ' LEU . . . . . 0.411 ' H ' ' C ' ' A' 1029 ' ' LYS . 20.8 tp 60.15 13.68 4.01 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.053 1.741 . . . . 0.0 111.625 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1032 ' ' THR . . . . . 0.482 HG22 ' HB3' ' A' 1030 ' ' ASP . 13.5 t -125.55 7.07 7.59 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -174.43 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.508 ' OE1' ' HB2' ' A' ' 974' ' ' GLU . 6.0 tt0 . . . . . 0 C--N 1.315 -0.921 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.914 -177.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 65.2 m-70 . . . . . 0 CA--C 1.499 -1.008 0 CA-C-O 119.311 -0.376 . . . . 0.0 111.735 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 2.9 m 60.84 85.38 0.11 Allowed 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.962 0.887 . . . . 0.0 108.784 -167.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.906 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.6 OUTLIER -104.76 165.92 10.74 Favored 'General case' 0 C--N 1.282 -2.33 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 178.225 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.574 ' O ' ' HG2' ' A' 1027 ' ' ARG . 79.2 t80 -148.45 123.56 10.13 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 -178.098 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 21.1 m -75.97 114.76 14.96 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 173.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -93.66 163.37 13.57 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.562 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 11.9 pt-20 -162.01 145.98 12.32 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 118.64 0.655 . . . . 0.0 110.368 -171.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 5.8 p -155.43 128.31 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.537 0.684 . . . . 0.0 111.381 172.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.653 ' HA ' ' O ' ' A' 1021 ' ' ARG . 70.1 m-85 -90.32 113.38 25.23 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.518 ' O ' ' HA ' ' A' 1020 ' ' ARG . 16.3 tt0 -79.52 128.62 33.59 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.792 171.257 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 937' ' ' ASN . . . . . 0.454 HD22 ' N ' ' A' ' 937' ' ' ASN . 0.5 OUTLIER -117.89 146.58 43.82 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 123.501 0.72 . . . . 0.0 109.907 -177.987 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.61 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 38.4 mt-10 -129.07 172.11 11.72 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 171.01 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 27.1 t -152.08 136.76 17.0 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 118.529 0.604 . . . . 0.0 110.622 -175.175 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.701 HH21 ' HB2' ' A' 1016 ' ' HIS . 22.4 ptt180 -136.85 159.63 41.3 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 176.413 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -81.21 166.92 35.56 Favored Pre-proline 0 C--N 1.308 -1.227 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 171.159 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 942' ' ' PRO . . . . . 0.453 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 15.6 Cg_exo -69.66 86.69 0.56 Allowed 'Trans proline' 0 N--CA 1.452 -0.948 0 N-CA-C 108.988 -1.197 . . . . 0.0 108.988 170.519 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.13 8.18 3.41 Favored Glycine 0 N--CA 1.436 -1.352 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 -173.218 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 944' ' ' GLY . . . . . 0.515 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -117.89 -179.26 17.32 Favored Glycine 0 CA--C 1.503 -0.713 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -112.02 158.28 19.74 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 119.822 1.811 . . . . 0.0 107.012 172.589 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.61 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 28.9 m95 -67.35 138.69 56.96 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-O 121.392 0.615 . . . . 0.0 110.798 -174.645 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -129.12 179.31 1.33 Allowed Pre-proline 0 C--N 1.302 -1.498 0 N-CA-C 101.412 -3.551 . . . . 0.0 101.412 174.236 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.9 144.48 99.57 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 CA-C-N 123.243 2.194 . . . . 0.0 111.406 177.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.94 -170.09 0.1 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.481 0.658 . . . . 0.0 110.818 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.518 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.0 OUTLIER -90.62 -35.74 14.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 -177.935 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -123.28 100.15 6.7 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 104.556 -2.387 . . . . 0.0 104.556 168.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 27.6 m -69.13 -59.45 3.02 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -173.081 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -96.0 128.25 42.73 Favored 'General case' 0 C--N 1.313 -0.99 0 O-C-N 121.277 -0.889 . . . . 0.0 109.719 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 18.1 p -148.89 -178.05 6.14 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.705 0.764 . . . . 0.0 111.352 -168.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -108.3 168.49 9.27 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 104.314 -2.476 . . . . 0.0 104.314 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.38 -30.88 31.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 119.153 0.888 . . . . 0.0 111.114 174.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -78.54 -8.34 58.47 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 95.07 -4.75 68.02 Favored Glycine 0 CA--C 1.501 -0.799 0 C-N-CA 120.263 -0.97 . . . . 0.0 112.224 178.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -62.08 102.25 0.27 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 960' ' ' LYS . . . . . 0.412 ' HD3' ' C ' ' A' ' 960' ' ' LYS . 12.5 tmtt? -50.68 122.78 7.74 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.571 1.17 . . . . 0.0 109.438 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.24 -173.2 2.41 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.317 -178.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 962' ' ' ALA . . . . . 0.619 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -78.9 152.94 30.89 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 177.493 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.3 m -79.05 157.7 75.68 Favored Pre-proline 0 C--N 1.315 -0.892 0 N-CA-C 107.435 -1.321 . . . . 0.0 107.435 178.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.582 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 7.5 Cg_exo -49.18 -24.89 8.66 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.586 2.857 . . . . 0.0 115.653 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.8 t -80.24 -43.34 21.58 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 177.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 966' ' ' GLU . . . . . 0.619 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 46.2 mm-40 -64.87 -32.2 73.79 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.768 175.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.484 HD13 ' CH2' ' A' ' 980' ' ' TRP . 83.6 mt -68.59 118.55 11.76 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 175.871 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 10.0 p -126.14 -175.39 3.35 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.126 -171.167 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.663 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 25.9 p -109.99 124.94 32.2 Favored Pre-proline 0 N--CA 1.435 -1.189 0 O-C-N 121.905 -0.497 . . . . 0.0 110.457 177.344 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.662 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 98.1 Cg_endo -77.04 173.24 14.77 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 122.908 2.405 . . . . 0.0 110.713 174.034 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -41.93 -48.64 6.02 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 124.271 3.314 . . . . 0.0 115.451 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.462 ' O ' ' HA ' ' A' 1029 ' ' LYS . . . -101.38 14.01 58.21 Favored Glycine 0 N--CA 1.439 -1.102 0 C-N-CA 120.141 -1.028 . . . . 0.0 113.584 -175.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.663 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 88.5 m95 -119.95 121.4 38.91 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 118.437 1.118 . . . . 0.0 111.71 179.342 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.464 ' HB2' ' OE1' ' A' 1033 ' ' GLN . 7.5 tp10 -110.08 127.69 55.01 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 126.602 1.961 . . . . 0.0 109.585 -172.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -70.77 106.89 3.73 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.722 0.772 . . . . 0.0 112.393 174.19 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 976' ' ' GLU . . . . . 0.449 ' H ' ' HA ' ' A' 1027 ' ' ARG . 5.5 tp10 -72.15 -47.11 53.41 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 172.535 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 977' ' ' ASP . . . . . 0.785 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 3.6 m-20 -87.41 160.6 18.26 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.704 -1.135 . . . . 0.0 112.229 -178.551 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -91.13 -53.32 4.41 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -168.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -148.32 132.67 17.53 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -173.191 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.582 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 17.1 m95 -61.11 123.1 16.69 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 123.989 0.805 . . . . 0.0 109.806 -172.548 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 49.8 p -122.8 156.02 35.38 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -177.029 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 982' ' ' TYR . . . . . 0.485 ' HB3' ' HD2' ' A' 1021 ' ' ARG . 0.0 OUTLIER -72.47 140.84 48.49 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.334 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.53 ' HB2' HG13 ' A' 1024 ' ' VAL . 52.6 t0 -91.16 130.5 37.04 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.832 -1.077 . . . . 0.0 111.117 -171.056 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.1 pp -115.59 14.25 7.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.501 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 985' ' ' ASN . . . . . 0.593 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 3.5 t-20 -97.37 16.45 20.07 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.009 0.909 . . . . 0.0 109.146 -176.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.593 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 7.6 mpt_? -139.87 179.75 6.42 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -175.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.85 86.2 3.43 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.691 0.758 . . . . 0.0 110.768 179.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 18.2 m -125.73 -179.23 2.37 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 114.933 -1.03 . . . . 0.0 109.39 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -73.67 177.82 5.17 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -64.82 -28.14 69.36 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 118.725 0.693 . . . . 0.0 111.768 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 57.3 mttt -85.87 -57.42 3.05 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 141.08 71.79 0.03 OUTLIER Glycine 0 CA--C 1.498 -1.013 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.667 177.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -145.6 140.79 27.63 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -99.93 160.08 14.59 Favored 'General case' 0 C--O 1.252 1.235 0 CA-C-N 118.944 0.793 . . . . 0.0 109.996 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.729 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 21.6 t80 -83.65 99.36 10.16 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 127.412 2.285 . . . . 0.0 109.547 -176.078 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 996' ' ' GLY . . . . . 0.521 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -120.97 120.95 4.65 Favored Glycine 0 N--CA 1.433 -1.505 0 C-N-CA 119.005 -1.569 . . . . 0.0 110.741 175.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.566 HG22 ' HA ' ' A' 1016 ' ' HIS . 13.8 pt -127.47 143.17 41.52 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 C-N-CA 118.579 -1.248 . . . . 0.0 109.148 177.019 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.7 t -146.1 155.63 42.89 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 20.5 pt -116.6 107.91 45.92 Favored Pre-proline 0 C--N 1.315 -0.927 0 C-N-CA 119.931 -0.708 . . . . 0.0 110.865 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -69.13 136.6 35.11 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.497 2.131 . . . . 0.0 112.556 -178.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -87.15 150.35 38.57 Favored 'Cis proline' 0 N--CA 1.45 -1.035 0 C-N-CA 122.938 -1.692 . . . . 0.0 112.816 -1.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 25.0 t70 -165.0 -86.68 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 113.336 -1.756 . . . . 0.0 107.707 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -178.5 -81.14 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 63.3 mttm -144.19 160.42 49.06 Favored Pre-proline 0 C--N 1.317 -0.811 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.614 ' HG2' ' HB2' ' A' 1018 ' ' HIS . 36.1 Cg_exo -58.5 144.34 97.04 Favored 'Trans proline' 0 C--O 1.241 0.675 0 C-N-CA 122.433 2.089 . . . . 0.0 110.882 169.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 39.8 mmtt -98.85 -48.18 5.01 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 -177.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 3.4 m -89.06 139.14 30.76 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 111.724 -2.489 . . . . 0.0 111.406 -173.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.636 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 61.8 m95 -135.11 132.64 38.34 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 175.633 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 37.1 t -142.11 170.04 12.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 -169.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -90.53 97.99 11.51 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 119.619 1.099 . . . . 0.0 108.274 172.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1011 ' ' ALA . . . . . 0.416 ' HB3' ' CD2' ' A' ' 995' ' ' TYR . . . -177.08 177.26 1.28 Allowed 'General case' 0 C--O 1.238 0.492 0 C-N-CA 122.81 0.444 . . . . 0.0 109.862 -176.41 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1012 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -169.48 110.62 0.46 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.505 ' H ' ' CD2' ' A' 1016 ' ' HIS . 76.3 mttt -122.34 150.81 41.87 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.384 -1.28 . . . . 0.0 108.756 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 24.2 ttt -53.43 -36.26 61.35 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1015 ' ' TYR . . . . . 0.453 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 59.7 m-85 -72.85 14.21 0.3 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.03 0.532 . . . . 0.0 111.62 -179.244 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 995' ' ' TYR . 0.2 OUTLIER -63.45 176.38 0.84 Allowed 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 121.863 0.84 . . . . 0.0 110.12 171.032 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 1017 ' ' THR . . . . . 0.644 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.7 OUTLIER -163.41 -31.04 0.04 OUTLIER 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.006 -1.452 . . . . 0.0 108.793 -168.236 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 1018 ' ' HIS . . . . . 0.614 ' HB2' ' HG2' ' A' 1005 ' ' PRO . 59.7 m80 -145.56 155.87 43.33 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.416 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -154.66 152.52 30.06 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 105.863 -1.903 . . . . 0.0 105.863 176.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.518 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 3.8 ptp180 -151.65 165.58 33.9 Favored 'General case' 0 C--O 1.195 -1.805 0 C-N-CA 118.418 -1.313 . . . . 0.0 109.837 178.188 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.653 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.3 ptt180 -149.17 145.71 27.3 Favored 'General case' 0 C--N 1.289 -2.05 0 C-N-CA 119.471 -0.891 . . . . 0.0 109.64 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.562 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.7 ttm180 -85.91 114.99 23.26 Favored 'General case' 0 N--CA 1.424 -1.749 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.509 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 65.6 mt -84.67 123.31 30.22 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 103.603 -2.74 . . . . 0.0 103.603 167.284 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.53 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.3 m -102.3 149.41 6.89 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.92 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -176.129 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.785 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -152.34 110.0 3.62 Favored 'General case' 0 C--N 1.289 -2.048 0 O-C-N 125.138 1.524 . . . . 0.0 111.542 166.558 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.437 ' HD2' ' N ' ' A' 1027 ' ' ARG . 2.7 tmmm? -84.35 146.42 27.71 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -176.432 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 12.2 ptm180 -142.98 179.9 6.76 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 104.643 -2.355 . . . . 0.0 104.643 -170.531 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.906 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 14.1 ptpt -162.56 155.58 19.83 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 118.648 0.658 . . . . 0.0 109.767 178.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 972' ' ' GLY . 33.1 ttmt -91.24 -12.56 34.86 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.166 0.984 . . . . 0.0 109.953 -172.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 33.9 t70 60.03 19.44 8.58 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.208 -1.815 . . . . 0.0 108.734 -175.065 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 37.3 tp 62.33 -29.46 0.08 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.865 2.066 . . . . 0.0 115.196 -179.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 13.4 t -136.41 19.87 3.14 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 119.508 1.049 . . . . 0.0 110.106 -169.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.464 ' OE1' ' HB2' ' A' ' 974' ' ' GLU . 18.5 tt0 . . . . . 0 C--N 1.323 -0.58 0 CA-C-O 121.559 0.695 . . . . 0.0 110.561 -179.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.487 -1.478 0 CA-C-O 121.309 0.576 . . . . 0.0 110.483 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 928' ' ' THR . . . . . 0.452 ' OG1' ' HB3' ' A' 1029 ' ' LYS . 0.5 OUTLIER -91.34 113.29 25.52 Favored 'General case' 0 N--CA 1.415 -2.213 0 N-CA-C 104.809 -2.293 . . . . 0.0 104.809 160.555 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.644 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.4 OUTLIER -129.28 129.62 45.14 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 176.866 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -121.64 135.14 54.99 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -179.184 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 26.0 m -71.16 123.06 21.3 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 177.279 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -98.54 156.53 16.74 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 104.651 -2.351 . . . . 0.0 104.651 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.799 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.1 pt-20 -154.93 159.21 40.26 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 118.209 0.459 . . . . 0.0 110.672 -170.708 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.443 HG12 ' CZ3' ' A' ' 980' ' ' TRP . 7.7 p -158.77 131.37 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 170.455 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.456 ' HA ' ' O ' ' A' 1021 ' ' ARG . 37.7 m-85 -82.3 150.19 27.38 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 122.284 1.04 . . . . 0.0 111.063 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.504 ' O ' ' HA ' ' A' 1020 ' ' ARG . 23.8 tt0 -126.12 125.42 42.49 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 -179.352 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 937' ' ' ASN . . . . . 0.984 ' HB3' ' HG2' ' A' 1020 ' ' ARG . 13.6 p-10 -124.1 145.68 49.11 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.787 0.804 . . . . 0.0 111.398 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.594 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 18.8 mt-10 -139.13 153.3 47.96 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 -178.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 15.2 m -136.37 149.55 48.39 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 121.168 0.509 . . . . 0.0 111.544 -172.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.591 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 20.2 ptt180 -146.62 161.34 40.74 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 114.14 -1.391 . . . . 0.0 108.343 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -66.89 158.76 79.33 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 170.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 942' ' ' PRO . . . . . 0.58 ' HG3' HG23 ' A' 1017 ' ' THR . 36.9 Cg_exo -61.13 85.85 0.09 OUTLIER 'Trans proline' 0 C--O 1.237 0.458 0 CA-C-N 120.687 1.281 . . . . 0.0 110.39 172.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 110.03 73.52 0.75 Allowed Glycine 0 N--CA 1.434 -1.457 0 N-CA-C 106.74 -2.544 . . . . 0.0 106.74 -173.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -166.34 -144.89 4.25 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 119.721 -1.228 . . . . 0.0 113.65 -172.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -128.91 123.6 33.02 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.417 -0.892 . . . . 0.0 110.639 -172.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.594 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 64.3 m95 -73.84 136.44 43.48 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 -178.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -142.34 163.16 41.12 Favored Pre-proline 0 C--N 1.295 -1.763 0 N-CA-C 102.791 -3.04 . . . . 0.0 102.791 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -49.2 137.06 30.52 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.851 1.7 . . . . 0.0 113.575 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.38 -172.7 0.08 Allowed 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.349 175.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.54 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.1 OUTLIER -84.36 -35.91 22.86 Favored 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 -178.452 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 951' ' ' ASP . . . . . 0.503 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 53.4 m-20 -123.03 97.45 5.44 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 170.382 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 25.7 m -61.16 -49.67 76.3 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -170.606 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -102.73 126.17 49.74 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.026 0.917 . . . . 0.0 111.783 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 10.6 p -135.16 165.59 25.05 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.702 -174.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 955' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 24.6 t70 -91.19 170.05 10.33 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 172.516 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.93 -29.88 22.05 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.101 0.864 . . . . 0.0 112.635 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -96.02 13.05 28.33 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 70.67 49.39 30.32 Favored Glycine 0 CA--C 1.484 -1.898 0 C-N-CA 121.061 -0.59 . . . . 0.0 111.711 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 959' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 16.8 t70 -107.73 109.43 21.02 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 103.617 -2.734 . . . . 0.0 103.617 177.296 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 960' ' ' LYS . . . . . 0.503 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 20.9 tptm -45.16 113.54 0.59 Allowed 'General case' 0 C--N 1.312 -1.027 0 O-C-N 124.6 1.188 . . . . 0.0 111.276 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.11 176.02 5.41 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.002 -176.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 962' ' ' ALA . . . . . 0.512 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -80.5 159.88 25.41 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.2 m -86.87 159.02 52.67 Favored Pre-proline 0 N--CA 1.433 -1.304 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.624 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 15.4 Cg_exo -46.57 -26.77 4.58 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 124.225 3.283 . . . . 0.0 115.608 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.9 t -71.93 -49.22 39.46 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 966' ' ' GLU . . . . . 0.512 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 1.5 mp0 -64.56 -33.15 75.25 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.15 0.5 . . . . 0.0 110.181 176.02 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.448 ' HB2' ' HA ' ' A' ' 964' ' ' PRO . 73.5 mt -64.89 110.96 2.61 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.978 0.894 . . . . 0.0 109.591 178.482 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.09 179.21 5.88 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.141 -173.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.508 ' HB3' ' NE1' ' A' ' 975' ' ' TRP . 25.0 p -94.74 136.87 22.65 Favored Pre-proline 0 C--N 1.321 -0.632 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.974 -176.276 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.601 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 44.7 Cg_endo -84.78 167.66 11.24 Favored 'Trans proline' 0 C--O 1.241 0.641 0 C-N-CA 122.977 2.452 . . . . 0.0 110.731 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -67.01 103.96 0.79 Allowed 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 121.607 1.538 . . . . 0.0 110.289 175.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.514 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 124.59 -2.23 8.74 Favored Glycine 0 N--CA 1.438 -1.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.92 -177.14 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.601 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 94.5 m95 -133.98 130.75 38.08 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 122.035 0.921 . . . . 0.0 111.255 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 974' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -117.24 131.41 56.85 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 126.586 1.954 . . . . 0.0 109.602 -170.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.581 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 91.9 m95 -83.95 156.74 22.18 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.571 177.337 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -140.11 -36.36 0.49 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.183 -178.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -68.15 146.52 53.35 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.507 178.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.55 -43.63 80.22 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -177.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.73 168.51 12.43 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -176.043 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.624 ' CD1' ' HB3' ' A' ' 964' ' ' PRO . 45.2 m95 -70.07 118.37 12.81 Favored 'General case' 0 C--N 1.309 -1.159 0 O-C-N 124.435 1.085 . . . . 0.0 108.446 -179.349 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 981' ' ' SER . . . . . 0.687 ' O ' ' HA ' ' A' 1023 ' ' LEU . 21.0 m -110.3 -161.0 0.73 Allowed 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 104.853 -2.277 . . . . 0.0 104.853 -173.607 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 982' ' ' TYR . . . . . 0.416 ' HB2' ' HA3' ' A' ' 992' ' ' GLY . 15.4 p90 -119.75 153.06 36.24 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 121.669 2.031 . . . . 0.0 109.697 177.089 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.523 ' HB2' ' HD2' ' A' 1022 ' ' ARG . 20.8 t70 -83.28 114.95 21.75 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.719 0.771 . . . . 0.0 111.063 -173.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.436 ' HA ' HG21 ' A' ' 988' ' ' VAL . 23.4 pt -107.1 -157.89 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.649 176.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 10.1 t30 49.79 44.01 24.85 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.923 1.344 . . . . 0.0 108.589 -172.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.45 ' HD3' ' CG1' ' A' ' 988' ' ' VAL . 52.4 ttt85 -153.43 -179.71 8.01 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 -172.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.409 ' H ' ' HG2' ' A' ' 986' ' ' ARG . . . -87.95 69.82 9.42 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.832 -1.174 . . . . 0.0 107.832 176.497 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.45 ' CG1' ' HD3' ' A' ' 986' ' ' ARG . 24.1 m -122.79 150.66 26.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.67 -1.15 . . . . 0.0 113.154 -173.573 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 989' ' ' ASP . . . . . 0.453 ' HB3' ' HB2' ' A' ' 993' ' ' TRP . 23.8 t70 -55.25 171.68 0.16 Allowed 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 113.271 -1.786 . . . . 0.0 110.751 168.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.53 -34.01 47.89 Favored 'General case' 0 CA--C 1.499 -0.991 0 C-N-CA 123.669 0.788 . . . . 0.0 111.304 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 991' ' ' LYS . . . . . 0.543 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 71.3 mmtt -106.46 16.92 24.07 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.347 -174.748 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 992' ' ' GLY . . . . . 0.416 ' HA3' ' HB2' ' A' ' 982' ' ' TYR . . . 93.69 -11.1 71.79 Favored Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.586 173.296 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.623 ' CG ' ' HD3' ' A' 1019 ' ' ARG . 97.1 m95 -59.93 153.31 21.45 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.384 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -137.49 152.38 49.47 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-N 115.238 -0.892 . . . . 0.0 112.252 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.693 ' HD2' ' HB ' ' A' 1009 ' ' VAL . 0.3 OUTLIER -62.32 99.85 0.15 Allowed 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 113.429 -1.714 . . . . 0.0 111.853 -178.267 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 996' ' ' GLY . . . . . 0.509 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -117.91 84.36 0.37 Allowed Glycine 0 CA--C 1.49 -1.497 0 C-N-CA 118.964 -1.589 . . . . 0.0 111.829 172.67 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.772 ' O ' ' HA ' ' A' 1005 ' ' PRO . 2.3 tt -92.4 131.79 38.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 O-C-N 121.581 -0.953 . . . . 0.0 109.806 -176.093 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 29.4 m -131.23 110.93 11.48 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 61.0 mt -117.81 119.46 33.87 Favored Pre-proline 0 C--N 1.314 -0.975 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.489 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 44.9 Cg_exo -58.53 144.62 96.88 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 122.816 2.344 . . . . 0.0 112.145 177.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1001 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 12.2 Cg_endo -90.86 127.22 6.48 Favored 'Cis proline' 0 N--CA 1.445 -1.341 0 C-N-CA 123.279 -1.55 . . . . 0.0 112.805 -1.017 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 49.3 t0 156.8 141.7 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 110.878 -2.874 . . . . 0.0 105.84 -176.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.0 p80 -125.43 41.95 3.4 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 122.997 1.38 . . . . 0.0 108.7 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 59.1 mttp -138.5 139.42 24.7 Favored Pre-proline 0 N--CA 1.434 -1.257 0 CA-C-N 112.915 -1.948 . . . . 0.0 107.441 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.772 ' HA ' ' O ' ' A' ' 997' ' ' ILE . 81.5 Cg_exo -57.23 170.38 1.66 Allowed 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.234 1.956 . . . . 0.0 113.081 167.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -110.16 -46.33 3.46 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.85 -173.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 13.4 t -160.81 147.23 15.09 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -174.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1008 ' ' TRP . . . . . . . . . . . . . 42.8 m95 -112.83 124.33 52.36 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.693 ' HB ' ' HD2' ' A' ' 995' ' ' TYR . 46.3 t -143.88 161.62 15.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 -169.074 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -93.34 -1.2 56.21 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.835 0.35 . . . . 0.0 111.483 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1011 ' ' ALA . . . . . 0.515 ' H ' HG12 ' A' 1009 ' ' VAL . . . -101.08 116.5 32.99 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.158 0.504 . . . . 0.0 111.045 -175.322 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.41 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 42.9 tp10 -71.36 114.99 10.0 Favored 'General case' 0 N--CA 1.439 -1.025 0 CA-C-O 122.226 1.012 . . . . 0.0 111.033 177.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.484 ' H ' ' CE1' ' A' 1016 ' ' HIS . 66.4 mttm -120.59 147.92 44.57 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 113.985 -1.461 . . . . 0.0 108.51 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 54.8 ttp -51.13 -37.43 46.08 Favored 'General case' 0 C--N 1.307 -1.28 0 O-C-N 124.091 0.869 . . . . 0.0 112.799 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -55.11 -12.14 0.84 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.665 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 26.5 m80 -58.19 109.76 0.82 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.071 0.463 . . . . 0.0 111.833 175.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1017 ' ' THR . . . . . 0.58 HG23 ' HG3' ' A' ' 942' ' ' PRO . 0.0 OUTLIER -97.63 -31.34 12.34 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 123.268 1.508 . . . . 0.0 109.319 175.62 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 1018 ' ' HIS . . . . . 0.509 ' HB2' ' O ' ' A' ' 996' ' ' GLY . 30.4 m170 -136.41 155.93 49.33 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 113.774 -1.557 . . . . 0.0 108.162 -176.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1019 ' ' ARG . . . . . 0.623 ' HD3' ' CG ' ' A' ' 993' ' ' TRP . 11.3 ttm180 -153.08 139.37 18.47 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 177.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.984 ' HG2' ' HB3' ' A' ' 937' ' ' ASN . 95.9 mtt180 -134.05 166.02 23.7 Favored 'General case' 0 CA--C 1.481 -1.69 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -177.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.602 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 24.5 ptt180 -155.74 153.47 29.94 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 124.23 0.956 . . . . 0.0 108.616 168.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.799 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 34.4 ttm180 -86.52 120.75 28.18 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 176.142 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.687 ' HA ' ' O ' ' A' ' 981' ' ' SER . 77.6 mt -86.71 129.45 34.87 Favored 'General case' 0 N--CA 1.423 -1.791 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 169.095 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.456 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 14.1 m -108.3 135.26 47.61 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 CA-C-O 121.419 0.628 . . . . 0.0 112.397 -172.307 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.464 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.3 tpt180 -142.98 97.63 3.13 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 170.45 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.565 ' HD3' ' HB2' ' A' ' 929' ' ' GLU . 0.0 OUTLIER -74.65 152.79 39.15 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 -179.607 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.581 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 8.1 ptm180 -142.18 166.58 24.31 Favored 'General case' 0 CA--C 1.496 -1.098 0 N-CA-C 106.255 -1.757 . . . . 0.0 106.255 -171.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.644 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 13.6 ptpt -155.19 152.74 29.74 Favored 'General case' 0 C--O 1.196 -1.727 0 CA-C-O 121.042 0.449 . . . . 0.0 110.842 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.514 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 36.9 ttmt -91.39 -21.28 21.07 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 -178.089 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 14.3 t70 46.97 27.53 0.74 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 111.175 -2.738 . . . . 0.0 110.411 -169.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 34.8 tp 70.82 -47.52 0.65 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.332 1.853 . . . . 0.0 114.005 177.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 11.3 t -90.55 14.82 12.13 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -170.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 . . . . . 0 C--O 1.216 -0.692 0 O-C-N 121.237 -0.914 . . . . 0.0 110.833 175.467 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . 0.259 0.6 OUTLIER . . . . . 0 CA--C 1.492 -1.277 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.66 122.91 35.55 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 163.032 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.438 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.1 OUTLIER -139.19 137.86 36.4 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 170.758 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.419 ' O ' ' HG2' ' A' 1027 ' ' ARG . 91.8 t80 -136.19 140.62 43.71 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.689 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 28.0 m -72.2 129.65 38.95 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 118.673 0.67 . . . . 0.0 112.108 178.257 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -100.19 160.56 14.23 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 105.989 -1.856 . . . . 0.0 105.989 177.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -158.94 145.24 16.84 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.323 0.582 . . . . 0.0 110.961 -171.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.552 HG11 ' HG3' ' A' ' 964' ' ' PRO . 14.6 p -141.02 171.47 12.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 177.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.426 ' H ' HG22 ' A' ' 934' ' ' VAL . 83.5 m-85 -127.89 143.13 51.11 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -176.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.615 ' O ' ' HA ' ' A' 1020 ' ' ARG . 16.9 tt0 -117.65 118.21 31.49 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.397 179.265 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -95.89 126.17 40.96 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 124.365 1.041 . . . . 0.0 111.288 -178.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.527 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 47.8 mt-10 -121.27 154.38 36.42 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 169.079 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 33.8 m -144.84 158.19 43.89 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.566 -0.853 . . . . 0.0 110.727 -173.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.498 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 28.7 ptt180 -151.64 159.58 43.98 Favored 'General case' 0 N--CA 1.427 -1.598 0 O-C-N 124.57 1.169 . . . . 0.0 108.612 178.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -76.51 166.85 41.68 Favored Pre-proline 0 C--N 1.309 -1.185 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.73 74.36 1.28 Allowed 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 121.359 1.373 . . . . 0.0 111.212 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 139.86 8.14 0.94 Allowed Glycine 0 CA--C 1.528 0.86 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 -176.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 944' ' ' GLY . . . . . 0.493 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -101.43 -166.33 27.54 Favored Glycine 0 C--N 1.336 0.538 0 N-CA-C 111.071 -0.811 . . . . 0.0 111.071 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -125.61 159.9 31.0 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.588 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 45.5 m95 -73.53 129.76 38.65 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 122.127 0.965 . . . . 0.0 110.304 -175.509 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 947' ' ' LYS . . . . . 0.409 ' HA ' ' HD3' ' A' ' 948' ' ' PRO . 17.8 pttp -146.39 138.45 13.55 Favored Pre-proline 0 C--N 1.287 -2.15 0 N-CA-C 103.627 -2.731 . . . . 0.0 103.627 172.339 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' A' ' 938' ' ' GLU . 80.2 Cg_exo -49.87 124.6 12.78 Favored 'Trans proline' 0 C--O 1.239 0.548 0 C-N-CA 123.148 2.565 . . . . 0.0 114.733 -169.719 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -52.44 -177.49 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.231 169.604 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -102.61 -0.08 32.49 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 115.883 -2.327 . . . . 0.0 109.215 -163.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 951' ' ' ASP . . . . . 0.511 ' HB3' ' HG3' ' A' ' 960' ' ' LYS . 20.3 m-20 -132.63 82.92 2.03 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 103.018 -2.956 . . . . 0.0 103.018 169.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.0 m -69.31 -37.04 77.57 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.342 -167.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -109.12 131.01 55.48 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.531 0.681 . . . . 0.0 112.204 -176.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 42.5 p -145.54 178.81 7.85 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.842 -169.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -99.19 171.5 7.97 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 176.076 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.01 -31.88 31.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 118.335 0.516 . . . . 0.0 111.231 174.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -81.21 -15.23 56.28 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.065 0.46 . . . . 0.0 112.037 177.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 101.64 -4.32 53.76 Favored Glycine 0 CA--C 1.497 -1.064 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.458 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.87 102.5 0.08 Allowed 'General case' 0 CA--C 1.503 -0.829 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 960' ' ' LYS . . . . . 0.511 ' HG3' ' HB3' ' A' ' 951' ' ' ASP . 5.3 tmmm? -51.65 130.69 28.86 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 124.432 1.082 . . . . 0.0 109.571 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -130.54 175.73 8.75 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.014 -0.993 . . . . 0.0 109.484 -173.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 962' ' ' ALA . . . . . 0.425 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -64.18 144.44 57.12 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 176.005 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.0 m -68.91 159.42 82.72 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -178.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.584 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 51.8 Cg_exo -52.65 -21.66 15.21 Favored 'Trans proline' 0 N--CA 1.48 0.733 0 C-N-CA 123.865 3.043 . . . . 0.0 114.705 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 5.2 p -70.94 -53.45 14.93 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 966' ' ' GLU . . . . . 0.425 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 3.0 mp0 -68.84 -24.8 64.4 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.297 176.627 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.572 ' HB2' ' HA ' ' A' ' 964' ' ' PRO . 37.3 mt -63.56 111.37 2.33 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.206 1.003 . . . . 0.0 108.68 175.248 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 2.7 p -130.08 169.52 15.2 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.85 -171.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 15.8 p -87.15 143.07 34.17 Favored Pre-proline 0 C--N 1.313 -0.985 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.981 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.573 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 96.8 Cg_endo -75.09 175.61 11.01 Favored 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 122.703 2.269 . . . . 0.0 110.017 174.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.61 -45.4 41.31 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.928 1.752 . . . . 0.0 114.272 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 972' ' ' GLY . . . . . . . . . . . . . . . -76.56 -45.4 13.72 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.073 -1.06 . . . . 0.0 112.779 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.573 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 97.5 m95 -76.82 145.15 38.63 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 -179.356 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.521 ' HB3' ' O ' ' A' 1028 ' ' LYS . 4.6 tp10 -125.59 149.78 48.08 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 -179.009 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.603 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 94.6 m95 -86.07 156.33 20.45 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 120.495 -1.378 . . . . 0.0 111.594 172.249 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -120.42 -44.98 2.45 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 977' ' ' ASP . . . . . 0.572 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.0 OUTLIER -78.75 157.14 28.56 Favored 'General case' 0 CA--C 1.499 -1.018 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.914 -176.629 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -88.62 110.05 20.61 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.863 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 979' ' ' ALA . . . . . 0.519 ' C ' ' HD3' ' A' 1025 ' ' ARG . . . 57.51 176.77 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 O-C-N 125.223 1.577 . . . . 0.0 113.71 174.778 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.584 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 36.9 m95 -89.53 120.66 31.02 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 113.905 -1.498 . . . . 0.0 107.291 176.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 36.7 m -125.64 145.28 50.22 Favored 'General case' 0 C--N 1.295 -1.77 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 -176.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -73.21 135.03 44.52 Favored 'General case' 0 C--N 1.301 -1.536 0 CA-C-O 121.691 0.757 . . . . 0.0 110.044 -174.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -85.72 133.36 34.01 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 114.195 -1.366 . . . . 0.0 111.608 -170.159 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.574 ' HA ' HG21 ' A' ' 988' ' ' VAL . 1.8 pp -114.22 21.85 6.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.024 177.468 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -104.39 30.5 5.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.856 0.836 . . . . 0.0 108.798 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.563 ' HB2' HG13 ' A' ' 988' ' ' VAL . 78.1 mtp180 -136.84 -179.52 5.75 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 -178.282 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -81.34 84.17 6.71 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 171.166 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.574 HG21 ' HA ' ' A' ' 984' ' ' ILE . 11.9 m -115.5 -178.78 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 122.485 1.136 . . . . 0.0 113.928 -173.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 989' ' ' ASP . . . . . 0.574 ' HB3' ' H ' ' A' ' 993' ' ' TRP . 3.7 t70 -74.15 179.12 4.62 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 112.727 -2.033 . . . . 0.0 108.67 178.094 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.49 -31.56 69.47 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 118.768 0.713 . . . . 0.0 111.967 178.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -102.06 -44.65 5.4 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.169 -174.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 139.19 75.37 0.05 OUTLIER Glycine 0 CA--C 1.489 -1.534 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.899 176.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.619 ' HA ' ' HB3' ' A' 1021 ' ' ARG . 72.2 m95 -139.45 179.68 6.41 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.537 ' HG3' ' CE3' ' A' 1008 ' ' TRP . 6.9 pt-20 -143.15 153.54 42.97 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 122.285 1.04 . . . . 0.0 110.917 -177.308 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.763 ' O ' ' HA ' ' A' 1008 ' ' TRP . 9.6 t80 -81.99 104.44 12.35 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 112.777 -2.011 . . . . 0.0 112.272 -173.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 996' ' ' GLY . . . . . 0.457 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -128.78 116.8 2.32 Favored Glycine 0 C--O 1.216 -0.995 0 C-N-CA 118.478 -1.82 . . . . 0.0 112.667 172.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.808 HD12 ' HE1' ' A' 1015 ' ' TYR . 0.5 OUTLIER -109.18 149.61 12.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 O-C-N 120.349 -1.677 . . . . 0.0 109.461 -179.157 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 33.1 m -138.27 115.86 11.33 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 174.209 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 2.6 mp -100.42 108.13 51.44 Favored Pre-proline 0 C--N 1.305 -1.326 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 177.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -68.32 150.3 76.1 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.519 2.146 . . . . 0.0 113.057 -175.525 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -89.33 148.33 23.77 Favored 'Cis proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.474 -1.886 . . . . 0.0 112.474 -2.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 13.4 t70 -164.05 -89.16 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.419 -1.718 . . . . 0.0 109.032 177.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 159.32 -76.85 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.0 1.32 . . . . 0.0 109.925 -177.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 90.8 mttt -126.42 150.59 70.82 Favored Pre-proline 0 N--CA 1.447 -0.589 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.049 -172.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -63.85 147.07 92.33 Favored 'Trans proline' 0 C--O 1.239 0.571 0 C-N-CA 123.555 2.837 . . . . 0.0 110.425 170.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -93.89 -50.73 5.2 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 20.7 m -102.06 152.15 21.31 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 112.774 -2.012 . . . . 0.0 112.543 -172.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.763 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 67.3 m95 -135.22 137.09 42.28 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.214 -1.357 . . . . 0.0 107.929 -178.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.68 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 20.9 t -136.63 -109.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.864 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 -175.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -167.44 -31.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 118.65 0.659 . . . . 0.0 110.939 -171.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -72.16 -169.44 0.5 Allowed 'General case' 0 C--O 1.237 0.433 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.457 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.2 tp10 -150.0 105.95 3.45 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.528 -172.336 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 87.4 mttt -115.0 139.15 50.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.761 -1.108 . . . . 0.0 109.456 176.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1014 ' ' MET . . . . . 0.473 ' HA ' ' NH2' ' A' ' 940' ' ' ARG . 24.4 ttt -45.92 -32.56 2.76 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1015 ' ' TYR . . . . . 0.808 ' HE1' HD12 ' A' ' 997' ' ' ILE . 40.5 p90 -74.79 5.27 5.16 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 118.794 -1.162 . . . . 0.0 111.366 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.588 ' HB3' ' CH2' ' A' ' 946' ' ' TRP . 0.6 OUTLIER -60.02 118.35 6.18 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.535 171.282 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 21.1 p -110.5 -13.04 14.31 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.081 174.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 27.0 m80 -140.5 147.52 39.69 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 122.653 1.216 . . . . 0.0 113.265 -174.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -151.47 144.87 24.8 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 176.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.615 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 98.0 mtt180 -138.27 168.79 19.0 Favored 'General case' 0 CA--C 1.466 -2.252 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -179.137 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.619 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 30.3 ptt180 -154.16 153.64 32.15 Favored 'General case' 0 C--N 1.284 -2.281 0 O-C-N 124.677 1.235 . . . . 0.0 108.007 168.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.442 ' HG2' HG13 ' A' 1024 ' ' VAL . 41.8 ttm180 -91.51 115.65 28.22 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 123.558 0.536 . . . . 0.0 109.837 179.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.57 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 81.3 mt -90.12 125.19 35.35 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 169.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 17.6 m -112.83 153.45 14.42 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.866 0 CA-C-O 121.776 0.798 . . . . 0.0 111.33 -174.006 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.543 ' HG3' ' HB2' ' A' ' 977' ' ' ASP . 31.3 ttp180 -158.83 110.28 2.14 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-N 112.798 -2.001 . . . . 0.0 109.691 168.606 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.689 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.7 tmmm? -76.0 149.52 37.58 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -178.285 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.603 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 7.4 ptm180 -136.17 139.41 42.83 Favored 'General case' 0 C--O 1.204 -1.336 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -169.619 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 30.2 ttmt -125.74 135.83 52.5 Favored 'General case' 0 C--N 1.283 -2.283 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.078 -173.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.55 ' C ' ' H ' ' A' 1031 ' ' LEU . 35.3 ttmt -88.34 -21.02 24.59 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 123.571 1.653 . . . . 0.0 107.781 -177.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 3.2 t70 53.65 -2.92 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 111.135 -2.757 . . . . 0.0 114.127 -170.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1031 ' ' LEU . . . . . 0.55 ' H ' ' C ' ' A' 1029 ' ' LYS . 15.9 tp 61.68 16.31 7.66 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 125.905 1.682 . . . . 0.0 111.305 178.078 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 13.5 t -123.09 3.45 9.31 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -179.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 13.9 tt0 . . . . . 0 N--CA 1.438 -1.038 0 CA-C-N 113.852 -1.522 . . . . 0.0 107.141 -178.966 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 927' ' ' HIS . . . . . 0.441 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 20.1 m-70 . . . . . 0 CA--C 1.5 -0.975 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -161.92 116.79 1.94 Allowed 'General case' 0 N--CA 1.413 -2.312 0 N-CA-C 102.267 -3.234 . . . . 0.0 102.267 172.629 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -142.29 138.65 31.48 Favored 'General case' 0 C--N 1.282 -2.337 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 175.376 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 930' ' ' PHE . . . . . 0.433 ' O ' ' HG2' ' A' 1027 ' ' ARG . 84.4 t80 -131.13 139.55 49.83 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.557 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 33.3 m -78.75 123.0 26.73 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -99.79 159.72 14.85 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 -173.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -154.51 156.25 36.33 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 119.589 -0.845 . . . . 0.0 111.492 -171.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 934' ' ' VAL . . . . . 0.527 HG22 ' H ' ' A' ' 935' ' ' TYR . 14.2 p -150.37 177.4 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 N-CA-C 106.768 -1.568 . . . . 0.0 106.768 175.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.565 ' HA ' ' O ' ' A' 1021 ' ' ARG . 78.7 m-85 -138.28 151.22 47.4 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.4 ' O ' ' HA ' ' A' 1020 ' ' ARG . 28.0 tt0 -120.34 124.83 46.51 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 -177.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -117.79 149.71 40.34 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.528 0.68 . . . . 0.0 111.849 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.598 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 38.9 mt-10 -144.0 159.33 42.78 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 125.306 1.442 . . . . 0.0 107.44 175.486 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 46.1 m -142.3 142.63 32.56 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.452 0.644 . . . . 0.0 111.777 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.503 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 17.8 ptt180 -141.78 161.07 38.86 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -176.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -67.68 152.67 96.09 Favored Pre-proline 0 C--N 1.311 -1.103 0 N-CA-C 105.291 -2.114 . . . . 0.0 105.291 170.447 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 942' ' ' PRO . . . . . 0.551 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 40.8 Cg_exo -60.59 90.37 0.09 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.636 1.558 . . . . 0.0 112.131 176.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 101.44 68.58 0.83 Allowed Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -157.98 -123.15 0.72 Allowed Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.176 -1.012 . . . . 0.0 111.106 -175.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -145.98 131.03 18.28 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.77 -0.715 . . . . 0.0 109.928 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.598 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 51.2 m95 -72.35 141.3 48.79 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.942 0.877 . . . . 0.0 109.448 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -125.02 149.66 64.07 Favored Pre-proline 0 C--N 1.289 -2.032 0 N-CA-C 101.955 -3.35 . . . . 0.0 101.955 175.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.549 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 31.8 Cg_exo -56.39 152.01 41.85 Favored 'Trans proline' 0 C--N 1.323 -0.787 0 C-N-CA 121.394 1.396 . . . . 0.0 111.697 -177.501 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -70.07 -171.55 0.45 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.121 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -105.98 -18.92 13.89 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -119.18 85.82 2.44 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 103.635 -2.728 . . . . 0.0 103.635 169.62 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 9.6 m -56.62 -54.0 51.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.032 -173.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 953' ' ' TYR . . . . . 0.505 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 70.5 m-85 -105.73 134.22 49.2 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-O 121.666 0.746 . . . . 0.0 111.106 177.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 15.5 p -143.9 171.63 13.97 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.628 -171.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 955' ' ' ASP . . . . . 0.702 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 20.7 t0 -107.64 -176.23 3.01 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 106.187 -1.783 . . . . 0.0 106.187 178.068 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.05 -35.56 25.53 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -175.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -105.9 10.42 32.44 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 100.14 -1.9 56.41 Favored Glycine 0 CA--C 1.497 -1.091 0 C-N-CA 119.36 -1.4 . . . . 0.0 112.457 177.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 959' ' ' ASP . . . . . 0.702 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 23.9 t70 -51.48 101.95 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 O-C-N 124.791 0.936 . . . . 0.0 109.165 173.751 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -56.53 123.64 15.48 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.559 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -120.95 -179.88 4.16 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.817 -175.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -75.98 154.87 35.52 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 175.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 6.1 m -83.29 150.42 60.63 Favored Pre-proline 0 N--CA 1.431 -1.389 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.711 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 50.7 Cg_exo -42.71 -33.75 3.12 Favored 'Trans proline' 0 N--CA 1.48 0.686 0 C-N-CA 124.841 3.694 . . . . 0.0 117.324 -174.019 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 15.5 t -79.05 -43.62 23.85 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -66.8 -25.72 66.59 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.0 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.505 HD13 ' CH2' ' A' ' 980' ' ' TRP . 7.0 mt -66.3 110.43 3.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.398 0.618 . . . . 0.0 110.904 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.3 p -105.5 154.01 20.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.251 0.548 . . . . 0.0 112.211 -176.241 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.4 ' HB3' ' CE2' ' A' ' 975' ' ' TRP . 8.1 p -90.43 153.71 46.24 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.143 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.581 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 89.7 Cg_endo -77.58 168.89 21.89 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.05 1.833 . . . . 0.0 110.118 173.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -65.03 -9.75 22.84 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.111 1.874 . . . . 0.0 113.74 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.616 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -115.05 17.45 17.24 Favored Glycine 0 C--O 1.221 -0.665 0 C-N-CA 121.331 -0.462 . . . . 0.0 112.6 178.124 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.581 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 75.6 m95 -137.31 134.9 36.59 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-O 122.066 0.936 . . . . 0.0 110.133 175.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.658 ' HB3' ' O ' ' A' 1028 ' ' LYS . 8.7 tp10 -116.92 133.49 55.95 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-N 113.609 -1.632 . . . . 0.0 109.573 -169.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.665 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 65.9 m95 -82.39 100.26 9.9 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.422 -0.911 . . . . 0.0 109.911 174.68 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -74.44 -40.14 62.14 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.61 138.3 58.46 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 114.057 -1.428 . . . . 0.0 112.081 -177.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -52.39 -60.3 3.39 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 124.115 0.884 . . . . 0.0 111.953 176.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.5 154.72 8.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.99 -171.06 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.711 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 28.3 m95 -65.33 117.22 7.55 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -178.119 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 19.8 m -120.98 151.75 39.36 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 -173.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -73.52 133.17 43.54 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 119.055 0.843 . . . . 0.0 110.434 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.462 ' HB2' HG13 ' A' 1024 ' ' VAL . 45.0 t0 -82.35 122.45 28.0 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.123 -172.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 31.2 pt -114.03 8.36 7.77 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.314 -177.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -93.38 33.27 1.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.809 0.814 . . . . 0.0 109.064 -175.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 986' ' ' ARG . . . . . 0.631 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 53.6 mtp180 -143.58 -176.25 4.89 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -176.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -84.79 78.65 9.84 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 172.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.425 HG21 ' O ' ' A' ' 983' ' ' ASP . 17.3 m -138.71 161.42 30.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.624 -175.154 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 989' ' ' ASP . . . . . 0.401 ' HB3' ' HB2' ' A' ' 993' ' ' TRP . 11.7 t70 -55.58 169.34 0.32 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.293 1.037 . . . . 0.0 110.914 172.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -54.76 -33.6 61.49 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.479 0.657 . . . . 0.0 110.176 178.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 991' ' ' LYS . . . . . 0.514 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 86.4 mttt -98.38 9.07 43.94 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 115.092 -0.958 . . . . 0.0 112.106 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.68 -11.81 71.11 Favored Glycine 0 C--O 1.227 -0.314 0 N-CA-C 111.674 -0.57 . . . . 0.0 111.674 175.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 993' ' ' TRP . . . . . 0.671 ' HB3' ' CD ' ' A' 1019 ' ' ARG . 59.6 m95 -54.16 138.97 36.92 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.536 -0.832 . . . . 0.0 112.91 178.099 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.42 ' HG2' HG12 ' A' ' 988' ' ' VAL . 31.2 mt-10 -113.48 155.56 25.12 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.437 0.637 . . . . 0.0 111.462 -177.131 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.709 ' HB3' ' H ' ' A' 1009 ' ' VAL . 15.1 t80 -77.46 100.53 6.05 Favored 'General case' 0 C--O 1.209 -1.074 0 C-N-CA 127.08 2.152 . . . . 0.0 111.329 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -126.59 97.84 0.5 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 119.056 -1.545 . . . . 0.0 113.218 173.104 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.598 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -97.75 146.7 7.41 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 O-C-N 120.628 -1.513 . . . . 0.0 107.179 178.869 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 25.0 m -115.12 79.03 1.22 Allowed 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.719 0.771 . . . . 0.0 109.418 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.505 ' HA ' ' HD3' ' A' 1000 ' ' PRO . 2.0 pp -72.98 125.46 91.07 Favored Pre-proline 0 N--CA 1.447 -0.586 0 CA-C-N 114.592 -1.186 . . . . 0.0 111.846 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.505 ' HD3' ' HA ' ' A' ' 999' ' ' ILE . 2.7 Cg_exo -71.31 143.34 43.3 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.401 2.067 . . . . 0.0 114.183 -177.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1001 ' ' PRO . . . . . 0.447 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.9 Cg_endo -97.27 137.31 3.94 Favored 'Cis proline' 0 N--CA 1.444 -1.384 0 C-N-CA 122.973 -1.678 . . . . 0.0 112.873 -3.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 3.9 t70 -177.18 177.92 1.17 Allowed 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 112.312 -2.222 . . . . 0.0 106.507 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 10.7 m170 -119.61 -43.51 2.58 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 82.1 mttt -125.15 150.6 67.42 Favored Pre-proline 0 C--N 1.307 -1.249 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.128 -174.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1005 ' ' PRO . . . . . 0.531 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 77.0 Cg_exo -57.7 124.6 16.42 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.335 2.023 . . . . 0.0 110.305 171.21 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1006 ' ' LYS . . . . . 0.407 ' H ' ' HG2' ' A' 1006 ' ' LYS . 41.5 pttt -112.14 11.18 20.32 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 121.918 0.866 . . . . 0.0 109.726 -177.166 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 46.8 t -148.85 140.98 23.94 Favored 'General case' 0 N--CA 1.431 -1.386 0 CA-C-N 114.611 -1.177 . . . . 0.0 107.933 -176.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.641 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 47.1 m95 -138.76 141.82 38.83 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.229 0.956 . . . . 0.0 108.836 -178.331 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.844 HG12 ' H ' ' A' 1010 ' ' ALA . 21.5 t -152.14 -165.08 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 102.933 -2.988 . . . . 0.0 102.933 -176.248 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1010 ' ' ALA . . . . . 0.844 ' H ' HG12 ' A' 1009 ' ' VAL . . . -101.67 -32.92 10.09 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 120.112 1.324 . . . . 0.0 112.554 -179.331 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -68.64 122.81 19.29 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -167.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.52 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 3.0 tp10 -70.98 117.91 13.08 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 171.127 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.454 ' HD3' ' HE2' ' A' ' 995' ' ' TYR . 56.5 mtpt -115.34 151.95 33.69 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 173.093 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 25.6 ttt -49.48 -44.6 46.04 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 124.442 1.089 . . . . 0.0 111.677 174.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1015 ' ' TYR . . . . . 0.551 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 88.4 m-85 -65.32 7.44 0.21 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.598 ' CD2' HG22 ' A' ' 997' ' ' ILE . 6.2 m170 -66.79 114.16 5.45 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 121.86 0.838 . . . . 0.0 112.366 176.656 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.31 -35.19 11.32 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-N 112.852 -1.976 . . . . 0.0 108.156 177.311 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -136.31 154.29 50.91 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.104 -174.694 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1019 ' ' ARG . . . . . 0.671 ' CD ' ' HB3' ' A' ' 993' ' ' TRP . 9.1 ttm180 -160.44 147.16 15.64 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.231 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 994' ' ' GLU . 2.2 ptm180 -151.06 154.73 37.56 Favored 'General case' 0 C--O 1.196 -1.743 0 C-N-CA 119.516 -0.874 . . . . 0.0 110.676 -177.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.565 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 23.2 ptt180 -135.25 149.29 49.82 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.563 -0.855 . . . . 0.0 111.428 -176.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.631 ' NH1' ' HD2' ' A' ' 986' ' ' ARG . 34.7 ttm180 -87.95 129.55 35.21 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 123.2 0.313 . . . . 0.0 110.512 178.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.509 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 61.6 mt -103.96 129.25 51.5 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 167.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.569 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 6.2 m -107.11 141.57 22.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.877 -174.694 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.549 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 9.9 tpt180 -137.46 106.11 5.87 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.164 170.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.0 tmmm? -72.5 135.85 45.77 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.665 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.2 ptm180 -131.56 134.43 46.07 Favored 'General case' 0 C--O 1.204 -1.333 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -172.323 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.658 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.1 ttmt -125.03 137.88 54.22 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 -173.058 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.616 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.9 ttmt -91.13 -17.74 25.65 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 124.053 1.882 . . . . 0.0 106.978 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1030 ' ' ASP . . . . . 0.417 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 15.6 t70 60.99 -0.41 0.32 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 111.347 -2.66 . . . . 0.0 111.624 -171.381 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1031 ' ' LEU . . . . . 0.516 ' H ' ' C ' ' A' 1029 ' ' LYS . 29.6 tp 72.58 -2.68 2.57 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 127.02 2.128 . . . . 0.0 112.56 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 10.3 t -119.62 -1.8 10.56 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -177.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.457 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 26.5 tt0 . . . . . 0 N--CA 1.431 -1.395 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.438 -178.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 927' ' ' HIS . . . . . 0.448 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 3.1 m-70 . . . . . 0 CA--C 1.482 -1.667 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.48 131.25 55.0 Favored 'General case' 0 N--CA 1.413 -2.291 0 N-CA-C 105.85 -1.908 . . . . 0.0 105.85 160.256 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 929' ' ' GLU . . . . . 0.563 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.9 OUTLIER -143.81 147.56 34.3 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.348 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -140.89 143.89 34.94 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 176.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 931' ' ' THR . . . . . 0.597 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 24.8 m -75.32 130.53 39.2 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 120.769 0.319 . . . . 0.0 111.068 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -106.08 158.08 17.07 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 933' ' ' GLU . . . . . 0.933 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 10.6 pt-20 -149.46 156.54 42.16 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 118.54 0.609 . . . . 0.0 110.385 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 7.2 p -153.2 130.4 2.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-O 121.255 0.55 . . . . 0.0 109.944 170.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 935' ' ' TYR . . . . . 0.633 ' HA ' ' O ' ' A' 1021 ' ' ARG . 62.0 m-85 -80.34 147.09 31.24 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -176.436 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 936' ' ' GLN . . . . . 0.655 ' O ' ' HA ' ' A' 1020 ' ' ARG . 32.9 tt0 -116.27 111.66 20.47 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -110.56 142.19 42.72 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.811 0.815 . . . . 0.0 112.328 -172.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 49.3 mt-10 -141.78 162.11 36.28 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 113.806 -1.543 . . . . 0.0 107.196 173.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 939' ' ' SER . . . . . 0.676 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 25.4 p -150.23 157.72 43.39 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 121.7 0.762 . . . . 0.0 111.995 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 940' ' ' ARG . . . . . 0.55 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 30.9 ptt180 -149.95 158.56 44.29 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 113.459 -1.7 . . . . 0.0 108.029 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -76.56 166.51 44.33 Favored Pre-proline 0 C--N 1.308 -1.212 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 168.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -65.75 90.74 0.24 Allowed 'Trans proline' 0 N--CA 1.449 -1.104 0 N-CA-C 108.576 -1.356 . . . . 0.0 108.576 168.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.39 -8.45 5.93 Favored Glycine 0 N--CA 1.435 -1.424 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -172.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 944' ' ' GLY . . . . . 0.55 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -103.44 -177.8 26.14 Favored Glycine 0 C--N 1.341 0.809 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 -178.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -118.89 163.21 17.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 120.795 2.297 . . . . 0.0 106.969 172.555 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 946' ' ' TRP . . . . . 0.602 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 42.3 m95 -64.45 135.65 56.29 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.955 0.883 . . . . 0.0 112.656 -172.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -138.84 171.82 7.56 Favored Pre-proline 0 C--N 1.309 -1.173 0 N-CA-C 103.394 -2.817 . . . . 0.0 103.394 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -52.21 124.07 14.06 Favored 'Trans proline' 0 C--O 1.234 0.322 0 CA-C-N 121.806 1.681 . . . . 0.0 110.76 176.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 949' ' ' ALA . . . . . 0.676 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -51.88 -68.43 0.17 Allowed 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -174.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.401 ' CG ' ' H ' ' A' ' 951' ' ' ASP . 7.2 pt-20 -168.18 -50.59 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 104.793 -2.299 . . . . 0.0 104.793 -172.405 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 951' ' ' ASP . . . . . 0.401 ' H ' ' CG ' ' A' ' 950' ' ' GLU . 23.2 m-20 -132.48 125.94 31.82 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 104.216 -2.513 . . . . 0.0 104.216 171.074 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 20.0 m -65.7 -58.64 5.23 Favored 'General case' 0 C--N 1.313 -1.002 0 O-C-N 123.329 0.393 . . . . 0.0 111.698 -174.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 953' ' ' TYR . . . . . 0.518 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 76.4 m-85 -102.25 132.21 48.33 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.381 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 954' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' ' 960' ' ' LYS . 69.9 p -142.23 177.78 8.01 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.817 0.817 . . . . 0.0 110.829 -172.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -100.68 171.47 7.68 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 105.291 -2.115 . . . . 0.0 105.291 174.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.12 -36.18 39.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.468 0.576 . . . . 0.0 111.5 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -75.81 -39.98 55.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.219 0.533 . . . . 0.0 110.66 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 133.51 -6.79 4.94 Favored Glycine 0 CA--C 1.493 -1.287 0 C-N-CA 120.499 -0.857 . . . . 0.0 112.053 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -58.37 105.28 0.27 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 176.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 960' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 953' ' ' TYR . 7.0 ttpm? -50.84 128.24 20.5 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.718 0.771 . . . . 0.0 111.525 176.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -115.39 -172.4 2.14 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.361 -1.29 . . . . 0.0 108.089 -177.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -82.0 159.05 23.61 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.62 152.24 72.35 Favored Pre-proline 0 N--CA 1.433 -1.286 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 177.262 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 964' ' ' PRO . . . . . 0.557 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 6.1 Cg_exo -45.5 -35.41 12.24 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 124.441 3.427 . . . . 0.0 114.917 -178.353 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 19.5 m -75.26 -46.87 30.9 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -69.0 -5.09 19.6 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.905 0.882 . . . . 0.0 112.414 174.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 967' ' ' LEU . . . . . 0.461 HD13 ' CH2' ' A' ' 980' ' ' TRP . 13.9 mt -90.85 114.7 27.18 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.947 0.403 . . . . 0.0 110.271 -178.259 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 34.5 p -117.26 172.95 6.96 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.21 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 969' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 6.2 p -95.6 141.43 23.18 Favored Pre-proline 0 C--N 1.319 -0.719 0 CA-C-O 120.938 0.399 . . . . 0.0 111.375 -178.38 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 970' ' ' PRO . . . . . 0.582 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 42.0 Cg_endo -84.55 170.34 10.4 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.368 2.712 . . . . 0.0 112.716 -178.543 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -64.36 102.7 0.4 Allowed 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 122.05 1.833 . . . . 0.0 110.415 174.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 972' ' ' GLY . . . . . 0.651 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 126.13 -7.12 7.67 Favored Glycine 0 N--CA 1.433 -1.507 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.038 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 973' ' ' TRP . . . . . 0.582 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.2 m95 -135.62 138.19 42.66 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 122.246 1.022 . . . . 0.0 111.395 -177.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 974' ' ' GLU . . . . . 0.515 ' HB2' HE21 ' A' 1033 ' ' GLN . 9.4 tp10 -129.53 145.6 51.44 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 126.55 1.94 . . . . 0.0 108.932 -171.16 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 975' ' ' TRP . . . . . 0.678 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 89.2 m95 -84.73 153.85 22.79 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.826 0.822 . . . . 0.0 112.03 174.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 976' ' ' GLU . . . . . 0.745 ' HB2' ' HD2' ' A' 1028 ' ' LYS . 40.3 tt0 -129.01 -37.27 1.71 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.215 177.379 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -74.54 151.99 39.4 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.022 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.24 -30.2 18.68 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -165.4 141.34 5.32 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.524 0.602 . . . . 0.0 111.749 -173.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 980' ' ' TRP . . . . . 0.6 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 36.2 m95 -63.21 123.88 19.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.055 -0.975 . . . . 0.0 108.537 -178.802 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 981' ' ' SER . . . . . 0.761 ' O ' ' HA ' ' A' 1023 ' ' LEU . 15.0 m -116.29 -165.51 1.06 Allowed 'General case' 0 C--O 1.203 -1.36 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 -175.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -119.69 148.22 43.65 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 120.604 1.547 . . . . 0.0 110.624 177.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 983' ' ' ASP . . . . . 0.401 ' CB ' ' HD2' ' A' 1022 ' ' ARG . 15.6 t0 -96.19 116.14 28.53 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.078 0.466 . . . . 0.0 109.83 -174.036 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.586 ' HA ' HG21 ' A' ' 988' ' ' VAL . 26.9 pt -106.26 15.83 6.98 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.452 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -96.7 38.41 1.22 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.259 1.028 . . . . 0.0 108.8 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 40.4 mtt180 -140.82 -176.74 4.78 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 -175.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.01 85.73 6.68 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 171.265 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 988' ' ' VAL . . . . . 0.586 HG21 ' HA ' ' A' ' 984' ' ' ILE . 23.0 m -135.83 150.79 28.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.967 -176.744 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 989' ' ' ASP . . . . . 0.449 ' HB2' ' HB3' ' A' 1011 ' ' ALA . 21.2 t70 -52.81 169.09 0.1 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.823 171.203 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -55.32 -34.08 63.89 Favored 'General case' 0 CA--C 1.507 -0.701 0 C-N-CA 123.369 0.668 . . . . 0.0 111.869 178.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -95.97 11.73 32.92 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.51 -177.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 992' ' ' GLY . . . . . 0.414 ' O ' ' HB3' ' A' 1021 ' ' ARG . . . 69.62 77.72 0.41 Allowed Glycine 0 N--CA 1.432 -1.581 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.687 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -147.0 129.11 15.58 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 994' ' ' GLU . . . . . 0.534 ' HB2' ' HB3' ' A' 1008 ' ' TRP . 3.7 pt-20 -103.24 154.02 19.78 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 177.666 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 995' ' ' TYR . . . . . 0.839 ' HB3' ' HA ' ' A' 1011 ' ' ALA . 0.5 OUTLIER -110.02 127.8 55.03 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.502 -172.47 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 996' ' ' GLY . . . . . 0.487 ' HA2' ' O ' ' A' 1007 ' ' SER . . . -127.29 141.21 12.45 Favored Glycine 0 N--CA 1.422 -2.297 0 CA-C-N 113.95 -1.477 . . . . 0.0 109.731 176.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 997' ' ' ILE . . . . . 0.716 HG22 ' HA ' ' A' 1016 ' ' HIS . 1.0 OUTLIER -121.41 138.7 50.91 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 C-N-CA 122.387 0.275 . . . . 0.0 110.507 -179.808 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.1 t -145.01 150.26 36.57 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.4 mp -108.11 100.64 37.66 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 176.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1000 ' ' PRO . . . . . 0.493 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 48.9 Cg_endo -70.5 134.27 26.05 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.343 2.028 . . . . 0.0 113.42 -175.05 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1001 ' ' PRO . . . . . 0.493 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.7 Cg_endo -94.81 150.04 10.41 Favored 'Cis proline' 0 N--CA 1.445 -1.339 0 C-N-CA 122.919 -1.701 . . . . 0.0 113.572 -1.431 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 27.9 t70 -149.43 -86.49 0.08 Allowed 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 112.964 -1.925 . . . . 0.0 107.164 176.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1003 ' ' HIS . . . . . 0.524 ' HB2' ' H ' ' A' 1004 ' ' LYS . 31.9 m-70 -158.87 -82.81 0.05 OUTLIER 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 170.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1004 ' ' LYS . . . . . 0.524 ' H ' ' HB2' ' A' 1003 ' ' HIS . 63.6 mttp -150.92 160.76 31.64 Favored Pre-proline 0 N--CA 1.439 -1.015 0 CA-C-N 113.937 -1.483 . . . . 0.0 109.073 177.426 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -56.28 143.61 85.02 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.801 2.334 . . . . 0.0 111.052 168.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -124.75 12.21 8.51 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 122.321 1.058 . . . . 0.0 108.174 -175.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1007 ' ' SER . . . . . 0.487 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 33.2 t -135.96 126.28 26.58 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 114.173 -1.376 . . . . 0.0 107.755 -173.629 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1008 ' ' TRP . . . . . 0.603 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 55.2 m95 -136.74 132.54 34.97 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 124.211 0.944 . . . . 0.0 108.489 -178.314 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.648 HG12 ' H ' ' A' 1010 ' ' ALA . 3.8 t -151.18 -178.08 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 -171.605 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1010 ' ' ALA . . . . . 0.648 ' H ' HG12 ' A' 1009 ' ' VAL . . . -65.53 109.71 2.45 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 119.016 0.825 . . . . 0.0 109.64 175.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1011 ' ' ALA . . . . . 0.839 ' HA ' ' HB3' ' A' ' 995' ' ' TYR . . . -52.73 108.53 0.32 Allowed 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 124.069 0.948 . . . . 0.0 112.234 -178.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1012 ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' 1013 ' ' LYS . 13.1 pt-20 -128.6 -48.29 1.27 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 178.597 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1013 ' ' LYS . . . . . 0.451 ' N ' ' HG3' ' A' 1012 ' ' GLU . 15.4 ptmt -78.06 147.56 34.68 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -168.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 24.7 ttt -62.49 -40.72 97.6 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 175.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -68.62 2.92 2.11 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -175.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1016 ' ' HIS . . . . . 0.716 ' HA ' HG22 ' A' ' 997' ' ' ILE 0.315 14.2 p-80 -82.84 128.13 34.12 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 116.0 -2.28 . . . . 0.0 111.202 174.986 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 73.7 p -101.42 -11.51 19.31 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.245 -166.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -139.95 143.69 36.68 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -176.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -142.5 152.58 42.82 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 175.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1020 ' ' ARG . . . . . 0.655 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 2.2 ptp180 -155.32 167.51 30.13 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 175.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1021 ' ' ARG . . . . . 0.633 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 27.7 ptt180 -150.15 153.56 36.55 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.061 175.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1022 ' ' ARG . . . . . 0.933 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 26.7 ttm180 -86.65 115.19 23.95 Favored 'General case' 0 N--CA 1.427 -1.596 0 O-C-N 123.864 0.727 . . . . 0.0 109.479 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1023 ' ' LEU . . . . . 0.761 ' HA ' ' O ' ' A' ' 981' ' ' SER . 76.1 mt -85.94 127.32 34.59 Favored 'General case' 0 N--CA 1.421 -1.88 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 169.394 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1024 ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 10.2 m -104.08 133.36 48.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.491 -173.056 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1025 ' ' ARG . . . . . 0.549 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.9 tpt180 -141.04 102.52 4.27 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.247 171.296 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1026 ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.5 OUTLIER -76.23 145.54 39.67 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 -179.043 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 1027 ' ' ARG . . . . . 0.678 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 5.9 ptm180 -136.39 157.84 45.85 Favored 'General case' 0 C--O 1.208 -1.092 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 -171.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1028 ' ' LYS . . . . . 0.745 ' HD2' ' HB2' ' A' ' 976' ' ' GLU . 21.2 ptmt -141.91 151.34 42.55 Favored 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -174.432 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1029 ' ' LYS . . . . . 0.651 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.6 ttmt -89.49 -20.33 23.98 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-O 123.304 1.526 . . . . 0.0 106.955 177.337 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1030 ' ' ASP . . . . . 0.448 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 33.9 t70 54.93 -0.49 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 111.402 -2.635 . . . . 0.0 113.101 -172.29 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1031 ' ' LEU . . . . . 0.543 ' H ' ' C ' ' A' 1029 ' ' LYS . 12.2 tp 66.35 6.11 4.11 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 126.489 1.916 . . . . 0.0 110.582 -178.621 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 18.1 p -105.83 -8.19 17.87 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-O 121.947 0.879 . . . . 0.0 109.42 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1033 ' ' GLN . . . . . 0.515 HE21 ' HB2' ' A' ' 974' ' ' GLU . 0.8 OUTLIER . . . . . 0 C--N 1.323 -0.573 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.265 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 49.2 mm . . . . . 0 C--O 1.236 0.347 0 CA-C-O 121.474 0.654 . . . . 0.0 109.794 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -139.47 154.2 71.36 Favored Pre-proline 0 C--N 1.32 -0.686 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 172.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -86.13 20.88 1.16 Allowed 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.227 1.951 . . . . 0.0 113.859 -177.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -107.73 -38.78 5.77 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.207 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 13.2 t -113.15 156.6 22.93 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 173.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -90.0 96.91 10.89 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 924' ' ' ASP . . . . . 0.406 ' HA ' ' HE2' ' A' ' 927' ' ' HIS . 49.4 m-20 -73.53 86.83 1.59 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -173.265 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -146.69 -60.62 0.3 Allowed 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.477 -1.238 . . . . 0.0 107.781 173.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -65.23 92.96 0.15 Allowed Glycine 0 CA--C 1.499 -0.949 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 924' ' ' ASP 0.263 95.6 m-70 -179.19 -46.13 0.01 OUTLIER 'General case' 0 CA--C 1.479 -1.755 0 N-CA-C 104.918 -2.253 . . . . 0.0 104.918 -170.527 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 928' ' ' THR . . . . . 0.526 HG22 ' HH2' ' A' ' 973' ' ' TRP . 1.5 m 62.76 89.41 0.09 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 125.301 1.625 . . . . 0.0 108.196 -171.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.564 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.5 OUTLIER -128.69 128.87 44.94 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 106.816 -1.549 . . . . 0.0 106.816 174.754 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.483 ' O ' ' HG2' ' A' 1027 ' ' ARG . 87.2 t80 -121.78 136.3 54.93 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 121.495 -0.753 . . . . 0.0 109.058 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.594 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 23.4 m -69.57 120.21 15.01 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 176.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -94.98 146.81 23.99 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.768 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.3 pt-20 -152.86 158.08 41.65 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 118.436 0.562 . . . . 0.0 111.229 -169.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 3.7 p -160.53 129.37 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.408 0.623 . . . . 0.0 111.137 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.639 ' HA ' ' O ' ' A' 1021 ' ' ARG . 50.5 m-85 -88.94 112.66 23.59 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.786 -176.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 936' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -85.81 142.8 28.67 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 937' ' ' ASN . . . . . 1.067 ' HB3' ' HB3' ' A' 1020 ' ' ARG . 0.0 OUTLIER -144.44 162.22 37.07 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -178.329 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.603 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 44.8 mt-10 -131.18 162.2 30.48 Favored 'General case' 0 C--O 1.246 0.91 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 16.6 t -135.16 146.25 48.57 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.203 176.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.59 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 18.1 ptt180 -152.58 162.42 41.25 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -176.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -67.49 152.58 96.08 Favored Pre-proline 0 C--N 1.31 -1.141 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 171.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -56.89 94.42 0.06 OUTLIER 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 122.1 1.866 . . . . 0.0 112.98 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 94.07 65.44 1.03 Allowed Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 108.071 -2.012 . . . . 0.0 108.071 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -159.33 -156.4 8.06 Favored Glycine 0 N--CA 1.435 -1.418 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.349 -173.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -105.27 125.17 50.69 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.321 -0.94 . . . . 0.0 110.04 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.603 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 56.5 m95 -80.14 147.89 31.18 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-O 121.619 0.724 . . . . 0.0 109.9 -177.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -128.66 171.33 8.81 Favored Pre-proline 0 C--N 1.298 -1.667 0 N-CA-C 103.475 -2.787 . . . . 0.0 103.475 174.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -59.17 135.97 69.56 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 CA-C-N 121.245 1.48 . . . . 0.0 109.801 175.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -58.9 174.06 0.38 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.976 0.893 . . . . 0.0 112.338 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -69.63 -38.47 77.2 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.189 -1.368 . . . . 0.0 107.494 -178.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -122.4 104.23 9.26 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 104.64 -2.356 . . . . 0.0 104.64 170.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 17.5 m -68.02 -52.84 30.9 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -172.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -97.58 125.2 42.17 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.175 173.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 13.0 p -140.9 173.28 11.64 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.681 -171.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -94.68 167.07 11.69 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 171.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.0 -28.84 18.4 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.765 0.711 . . . . 0.0 112.2 177.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -82.05 -39.76 23.01 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.22 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 139.86 -10.75 3.12 Favored Glycine 0 CA--C 1.498 -0.991 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.888 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -60.51 109.23 0.96 Allowed 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 121.193 0.52 . . . . 0.0 110.494 177.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 960' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' A' ' 961' ' ' ALA . 9.5 tmtt? -47.52 126.57 10.04 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.581 -1.645 . . . . 0.0 110.698 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.434 ' N ' ' HD3' ' A' ' 960' ' ' LYS . . . -122.74 173.57 7.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.731 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -69.08 160.87 30.21 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.874 0.369 . . . . 0.0 110.337 178.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.95 153.95 41.88 Favored Pre-proline 0 N--CA 1.435 -1.199 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -177.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.549 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.4 Cg_exo -47.18 -33.16 15.18 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 124.51 3.473 . . . . 0.0 115.866 -178.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.2 p -71.22 -45.0 64.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.879 0.847 . . . . 0.0 110.182 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -64.47 -27.43 68.98 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.42 -1.263 . . . . 0.0 110.285 175.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 81.2 mt -74.36 110.66 8.82 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 122.072 0.939 . . . . 0.0 110.11 176.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.3 p -129.01 165.11 21.79 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.99 -172.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 12.0 p -81.09 128.2 71.69 Favored Pre-proline 0 N--CA 1.441 -0.916 0 CA-C-O 121.239 0.542 . . . . 0.0 110.638 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.654 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 58.8 Cg_endo -82.27 165.73 16.57 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.562 2.174 . . . . 0.0 109.722 175.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -59.23 112.19 1.15 Allowed 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 121.551 1.501 . . . . 0.0 110.112 173.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.478 ' HA3' HG23 ' A' 1034 ' ' THR . . . 114.04 -4.18 23.97 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.83 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.654 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 92.9 m95 -126.18 132.9 51.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 122.225 1.012 . . . . 0.0 111.793 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.669 ' HB2' HE22 ' A' 1033 ' ' GLN . 8.1 tp10 -112.22 129.45 56.26 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 112.797 -2.001 . . . . 0.0 108.162 -175.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.52 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 94.1 m95 -70.85 138.81 50.58 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.644 -1.222 . . . . 0.0 111.129 172.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 976' ' ' GLU . . . . . 0.606 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 9.8 tp10 -100.88 -47.59 4.74 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.003 -0.999 . . . . 0.0 108.543 -177.233 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 977' ' ' ASP . . . . . 0.588 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.8 m-20 -85.88 161.09 19.23 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.155 -177.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -93.17 108.97 20.47 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.377 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 979' ' ' ALA . . . . . 0.509 ' C ' ' HD3' ' A' 1025 ' ' ARG . . . 55.49 178.05 0.03 OUTLIER 'General case' 0 C--O 1.234 0.254 0 CA-C-O 122.72 1.248 . . . . 0.0 113.491 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.626 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 51.9 m95 -88.09 118.45 27.67 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 113.606 -1.634 . . . . 0.0 108.066 177.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 981' ' ' SER . . . . . 0.687 ' O ' ' HA ' ' A' 1023 ' ' LEU . 34.7 m -110.2 -165.05 0.97 Allowed 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 -177.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -112.89 145.41 40.75 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 121.242 1.837 . . . . 0.0 109.432 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.481 ' HB2' HG13 ' A' 1024 ' ' VAL . 55.3 t0 -86.56 120.15 27.57 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -175.035 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.3 pp -116.24 15.45 7.72 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.349 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -99.12 30.04 3.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 123.036 1.398 . . . . 0.0 108.257 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.507 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 70.3 mtp85 -138.68 174.05 10.94 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.584 -177.088 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -80.74 79.62 7.35 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 171.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.619 HG12 ' HG2' ' A' ' 994' ' ' GLU . 25.7 m -135.84 161.09 38.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.97 -175.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.34 168.65 0.34 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.633 0.583 . . . . 0.0 110.553 171.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -54.73 -34.66 62.77 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-O 120.903 0.383 . . . . 0.0 111.314 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -101.03 7.36 43.47 Favored 'General case' 0 N--CA 1.427 -1.618 0 C-N-CA 119.004 -1.079 . . . . 0.0 111.469 -178.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 100.87 -20.8 46.36 Favored Glycine 0 C--O 1.224 -0.494 0 CA-C-N 116.122 -0.49 . . . . 0.0 113.803 173.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 83.1 m95 -54.19 121.7 8.72 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.619 ' HG2' HG12 ' A' ' 988' ' ' VAL . 22.6 mt-10 -99.37 153.63 18.83 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.039 177.193 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.733 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 27.6 t80 -79.01 94.27 5.26 Favored 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 126.783 2.033 . . . . 0.0 111.918 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -110.17 96.53 0.94 Allowed Glycine 0 N--CA 1.435 -1.423 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 177.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.591 HD12 ' HB3' ' A' 1015 ' ' TYR . 1.1 tt -98.42 130.1 47.73 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.194 0 O-C-N 122.139 -0.624 . . . . 0.0 110.197 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 7.1 m -108.12 85.45 2.12 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.989 -178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 16.2 pt -78.68 121.28 83.37 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.21 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 38.8 Cg_endo -69.94 135.67 30.62 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.05 1.833 . . . . 0.0 111.373 178.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1001 ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.0 Cg_endo -92.63 144.84 11.2 Favored 'Cis proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.23 -1.571 . . . . 0.0 114.331 -0.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 22.7 t0 163.33 155.64 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 112.176 -2.284 . . . . 0.0 105.994 177.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -99.55 -34.92 10.05 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.022 0.439 . . . . 0.0 110.339 -175.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1004 ' ' LYS . . . . . 0.548 ' H ' ' HD2' ' A' 1004 ' ' LYS . 0.0 OUTLIER -123.55 154.0 66.26 Favored Pre-proline 0 C--N 1.317 -0.829 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.172 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -58.49 127.75 25.83 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.25 2.634 . . . . 0.0 110.291 163.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 20.5 pttm -117.88 13.32 14.02 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.196 0.998 . . . . 0.0 109.608 178.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 29.9 t -143.54 136.1 27.24 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 113.908 -1.496 . . . . 0.0 107.766 -178.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.599 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 62.9 m95 -134.09 140.15 46.42 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 124.478 1.111 . . . . 0.0 108.966 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.522 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 92.8 t -140.51 157.77 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -177.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -83.03 8.76 11.88 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -121.23 134.78 55.2 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 121.278 -0.888 . . . . 0.0 111.603 -175.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.665 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.7 tp10 -69.56 105.1 2.54 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.526 ' H ' ' CE1' ' A' 1016 ' ' HIS . 95.0 mttt -109.26 147.15 33.08 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.743 -1.571 . . . . 0.0 108.47 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 26.5 ptt? -56.27 -36.09 68.19 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -178.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1015 ' ' TYR . . . . . 0.591 ' HB3' HD12 ' A' ' 997' ' ' ILE . 58.9 m-85 -60.93 -4.27 0.97 Allowed 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.733 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 2.6 m80 -54.67 108.03 0.35 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.63 -25.44 16.77 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 123.585 1.659 . . . . 0.0 106.912 173.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -141.71 150.73 42.22 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 111.865 -2.425 . . . . 0.0 109.466 -177.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1019 ' ' ARG . . . . . 0.515 ' HB3' ' CD2' ' A' 1016 ' ' HIS . 35.2 ptt180 -151.87 141.77 22.03 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 171.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1020 ' ' ARG . . . . . 1.067 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . 4.9 ptp180 -149.63 161.88 41.31 Favored 'General case' 0 CA--C 1.481 -1.687 0 C-N-CA 118.532 -1.267 . . . . 0.0 109.977 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.639 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.9 ptt180 -148.0 149.39 32.05 Favored 'General case' 0 C--N 1.298 -1.673 0 C-N-CA 119.431 -0.907 . . . . 0.0 110.969 -177.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.768 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 37.2 ttm180 -83.83 115.09 22.08 Favored 'General case' 0 N--CA 1.423 -1.806 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.455 -177.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.687 ' HA ' ' O ' ' A' ' 981' ' ' SER . 72.4 mt -80.44 129.66 34.66 Favored 'General case' 0 N--CA 1.425 -1.718 0 N-CA-C 105.179 -2.156 . . . . 0.0 105.179 166.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.481 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.6 m -111.83 133.63 56.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 CA-C-O 121.733 0.778 . . . . 0.0 112.721 -174.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.557 ' HG3' ' HB2' ' A' ' 977' ' ' ASP . 14.6 ttp180 -150.26 101.66 3.01 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 112.926 -1.943 . . . . 0.0 109.373 166.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.606 ' HE2' ' HG2' ' A' ' 976' ' ' GLU . 0.0 OUTLIER -79.43 154.21 29.11 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 -178.29 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.52 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 7.5 ptm180 -136.4 165.75 25.07 Favored 'General case' 0 CA--C 1.488 -1.432 0 N-CA-C 105.076 -2.194 . . . . 0.0 105.076 -170.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 30.4 ttmt -149.9 142.6 24.6 Favored 'General case' 0 C--N 1.281 -2.403 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 -172.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1029 ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -91.37 -13.2 32.89 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 123.568 1.651 . . . . 0.0 107.581 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1030 ' ' ASP . . . . . 0.401 ' H ' ' HG2' ' A' 1028 ' ' LYS . 25.0 t0 52.69 23.35 2.64 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 111.454 -2.612 . . . . 0.0 110.225 -173.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 25.4 tp 66.38 -47.32 0.43 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.224 2.21 . . . . 0.0 113.284 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 14.6 t -79.02 -21.7 46.56 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -171.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.669 HE22 ' HB2' ' A' ' 974' ' ' GLU . 43.2 mt-30 -64.3 -59.36 4.48 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -175.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1034 ' ' THR . . . . . 0.478 HG23 ' HA3' ' A' ' 972' ' ' GLY . 0.7 OUTLIER -110.19 80.53 1.32 Allowed 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.758 0.789 . . . . 0.0 110.281 169.395 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -104.59 -34.02 8.33 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.006 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 50.6 m -112.09 146.88 37.2 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.413 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 28.9 m -116.49 152.88 33.17 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.6 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 29.9 m -70.56 109.81 5.06 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -88.9 113.35 24.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.282 0.563 . . . . 0.0 111.116 -177.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 . . . . . 0 C--N 1.316 -0.859 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 177.656 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.531 0 CA-C-O 121.521 0.677 . . . . 0.0 109.825 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.42 139.41 89.39 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.833 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 920' ' ' PRO . . . . . 0.47 ' HB3' ' HB3' ' A' ' 923' ' ' ALA . 45.6 Cg_exo -40.73 102.74 0.04 OUTLIER 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 124.809 3.673 . . . . 0.0 112.846 178.234 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -49.06 -60.99 2.31 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 111.72 -2.491 . . . . 0.0 112.576 -174.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 15.4 t -112.34 -24.18 9.93 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.309 -177.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 923' ' ' ALA . . . . . 0.47 ' HB3' ' HB3' ' A' ' 920' ' ' PRO . . . -69.6 132.86 46.87 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 178.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -87.96 93.05 9.35 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -109.27 -75.66 0.63 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.076 0.465 . . . . 0.0 111.697 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -123.79 47.8 1.0 Allowed Glycine 0 CA--C 1.49 -1.529 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.543 ' HB2' ' OE1' ' A' ' 929' ' ' GLU . 79.7 m-70 -94.02 -28.99 15.45 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.116 -0.542 . . . . 0.0 110.254 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 928' ' ' THR . . . . . 0.471 ' HB ' ' HB3' ' A' 1029 ' ' LYS . 4.7 m 64.19 87.89 0.11 Allowed 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -167.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.709 ' HB3' ' HD3' ' A' 1028 ' ' LYS . 0.8 OUTLIER -121.67 168.02 12.26 Favored 'General case' 0 C--N 1.27 -2.863 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.544 ' O ' ' HG2' ' A' 1027 ' ' ARG . 81.6 t80 -149.51 124.74 10.14 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -176.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 931' ' ' THR . . . . . . . . . . . . . 70.0 m -78.52 113.83 16.9 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 174.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -92.47 163.3 13.89 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 105.715 -1.958 . . . . 0.0 105.715 -174.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.602 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -164.28 142.31 7.01 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 120.265 -0.574 . . . . 0.0 109.791 -172.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.427 HG11 HD11 ' A' ' 967' ' ' LEU . 34.1 m -143.29 126.5 13.31 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 175.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.609 ' HA ' ' O ' ' A' 1021 ' ' ARG . 29.9 m-85 -84.18 149.47 26.13 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.67 -0.644 . . . . 0.0 110.164 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.526 ' O ' ' HA ' ' A' 1020 ' ' ARG . 13.3 tt0 -119.91 121.22 38.55 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -109.28 146.34 34.45 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.15 0.976 . . . . 0.0 112.666 -174.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.557 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 39.6 mt-10 -138.34 160.56 39.18 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 112.909 -1.95 . . . . 0.0 106.54 170.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 15.4 m -145.39 151.48 38.33 Favored 'General case' 0 C--N 1.311 -1.065 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -176.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.598 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 26.9 ptt180 -146.13 160.7 41.57 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.298 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -75.62 163.55 66.52 Favored Pre-proline 0 C--N 1.315 -0.928 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 169.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -68.5 89.22 0.41 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 CA-C-N 120.357 1.163 . . . . 0.0 109.993 172.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 129.41 -1.05 6.04 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 110.262 -1.135 . . . . 0.0 110.262 -174.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 944' ' ' GLY . . . . . 0.598 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -100.99 -171.93 28.77 Favored Glycine 0 CA--C 1.502 -0.749 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 177.227 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -122.5 154.84 37.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 119.204 1.502 . . . . 0.0 107.094 172.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.571 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 24.8 m95 -61.72 135.73 57.72 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.709 0.766 . . . . 0.0 112.302 -173.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -135.56 167.27 23.11 Favored Pre-proline 0 C--N 1.307 -1.256 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -49.16 128.42 19.71 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.496 2.13 . . . . 0.0 112.931 -179.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -74.32 -162.31 0.15 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.543 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -89.7 -52.92 4.75 Favored 'General case' 0 CA--C 1.483 -1.603 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -109.17 92.06 3.9 Favored 'General case' 0 N--CA 1.411 -2.382 0 N-CA-C 104.983 -2.229 . . . . 0.0 104.983 -176.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 10.4 m -57.97 -58.06 10.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.672 -172.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 953' ' ' TYR . . . . . 0.487 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 89.1 m-85 -104.97 136.68 43.98 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.062 -0.655 . . . . 0.0 111.37 178.279 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 3.0 p -149.66 -178.08 6.24 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.039 0.936 . . . . 0.0 112.333 -168.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 955' ' ' ASP . . . . . 0.494 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 6.5 t70 -108.95 164.94 11.96 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 173.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -54.4 -29.16 48.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 119.379 0.99 . . . . 0.0 111.494 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -82.41 -8.37 59.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 177.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 100.61 -3.7 56.31 Favored Glycine 0 CA--C 1.501 -0.833 0 C-N-CA 119.918 -1.134 . . . . 0.0 112.133 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 959' ' ' ASP . . . . . 0.494 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 30.6 t70 -59.41 99.15 0.05 Allowed 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 175.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -52.56 129.69 29.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.226 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.11 171.34 8.17 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.666 -176.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -74.53 160.62 30.67 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.1 m -85.67 151.83 56.12 Favored Pre-proline 0 N--CA 1.423 -1.792 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.471 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 2.8 Cg_endo -47.52 -29.89 11.09 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 125.119 3.879 . . . . 0.0 117.729 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 51.1 m -88.23 -35.61 17.21 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 118.98 0.809 . . . . 0.0 109.55 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -65.4 -25.94 67.77 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.009 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.486 HD13 ' CH2' ' A' ' 980' ' ' TRP . 32.9 mt -74.75 122.4 23.22 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.685 0.794 . . . . 0.0 110.351 176.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 24.0 p -124.77 169.53 11.91 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.368 -174.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.569 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 25.6 p -92.7 133.74 28.85 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.26 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.608 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 93.6 Cg_endo -75.79 170.52 20.01 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.328 2.018 . . . . 0.0 110.835 176.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -56.67 -19.93 32.54 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.201 2.601 . . . . 0.0 115.227 -176.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.685 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . -116.07 14.98 16.19 Favored Glycine 0 N--CA 1.439 -1.103 0 C-N-CA 120.474 -0.869 . . . . 0.0 112.708 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.608 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 96.4 m95 -129.13 127.78 42.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 118.014 0.907 . . . . 0.0 110.793 178.471 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.455 ' HB2' HE21 ' A' 1033 ' ' GLN . 8.9 tp10 -106.4 118.18 35.97 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.616 2.366 . . . . 0.0 108.528 -173.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.648 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 42.8 m95 -69.55 105.12 2.55 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.107 -1.037 . . . . 0.0 111.135 176.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -71.15 -51.09 26.93 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 174.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -74.43 144.84 44.11 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.774 -172.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.63 -36.53 68.04 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -178.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -166.8 150.27 6.84 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.96 0.41 . . . . 0.0 110.806 -174.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.607 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 35.1 m95 -64.68 120.24 12.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 981' ' ' SER . . . . . 0.712 ' O ' ' HA ' ' A' 1023 ' ' LEU . 19.9 m -115.6 -172.28 2.12 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -174.128 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 982' ' ' TYR . . . . . 0.437 ' CD2' ' HA ' ' A' ' 991' ' ' LYS . 3.7 p90 -109.88 143.78 39.3 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 120.472 1.487 . . . . 0.0 109.695 -177.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.499 ' HB3' ' HD2' ' A' 1022 ' ' ARG . 17.2 t70 -106.16 131.54 53.29 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.365 -171.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.2 pp -109.33 29.63 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.631 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -106.4 30.51 5.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.952 1.358 . . . . 0.0 107.742 -174.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -138.95 -177.1 4.73 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -178.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -86.79 77.68 9.23 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 173.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.506 HG12 ' HB3' ' A' ' 994' ' ' GLU . 30.3 m -137.1 156.67 34.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.529 -172.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -55.02 165.94 0.59 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.792 -1.094 . . . . 0.0 110.995 170.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -52.88 -25.25 11.09 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 123.582 0.753 . . . . 0.0 112.871 176.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 991' ' ' LYS . . . . . 0.444 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 95.4 mttt -106.77 13.03 28.42 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.812 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.32 -13.23 66.97 Favored Glycine 0 C--O 1.224 -0.473 0 CA-C-N 115.967 -0.56 . . . . 0.0 113.383 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.477 ' HE3' ' HG2' ' A' 1019 ' ' ARG . 79.4 m95 -59.31 115.38 3.19 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.506 ' HB3' HG12 ' A' ' 988' ' ' VAL . 4.5 pt-20 -105.41 159.25 16.06 Favored 'General case' 0 C--O 1.257 1.451 0 CA-C-O 121.992 0.901 . . . . 0.0 112.543 176.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.788 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 57.1 t80 -83.08 103.0 12.18 Favored 'General case' 0 C--O 1.209 -1.068 0 C-N-CA 128.019 2.528 . . . . 0.0 113.714 -172.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -127.23 137.99 10.24 Favored Glycine 0 N--CA 1.439 -1.152 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 172.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.49 ' O ' ' HA ' ' A' 1005 ' ' PRO . 0.6 OUTLIER -133.44 149.65 31.41 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 177.13 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 28.8 m -127.82 103.77 7.46 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 121.203 0.525 . . . . 0.0 109.832 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 18.0 pt -95.51 114.18 63.37 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.37 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 33.0 Cg_endo -65.87 138.16 51.98 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 122.518 2.145 . . . . 0.0 112.931 -177.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1001 ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 6.6 Cg_endo -89.92 138.53 12.77 Favored 'Cis proline' 0 N--CA 1.45 -1.071 0 C-N-CA 123.143 -1.607 . . . . 0.0 113.883 -1.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 30.9 t0 165.16 151.19 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 111.604 -2.544 . . . . 0.0 104.664 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1003 ' ' HIS . . . . . 0.403 ' HB2' ' HD2' ' A' 1004 ' ' LYS . 3.5 m-70 -112.22 -35.91 5.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 120.631 1.559 . . . . 0.0 110.588 -175.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1004 ' ' LYS . . . . . 0.403 ' HD2' ' HB2' ' A' 1003 ' ' HIS . 2.0 mptp? -96.84 142.33 24.38 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-O 120.934 0.397 . . . . 0.0 111.772 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.49 ' HA ' ' O ' ' A' ' 997' ' ' ILE . 77.5 Cg_exo -62.66 123.21 11.94 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 N-CA-C 107.405 -1.806 . . . . 0.0 107.405 162.441 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 34.3 mttm -75.5 -12.61 60.27 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.199 0.523 . . . . 0.0 111.783 -175.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 39.3 t -150.07 151.74 33.69 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 -165.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.691 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 59.4 m95 -138.41 131.95 30.65 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 125.457 1.723 . . . . 0.0 107.254 174.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.407 HG12 ' N ' ' A' 1010 ' ' ALA . 21.3 t -150.18 170.56 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -171.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1010 ' ' ALA . . . . . 0.407 ' N ' HG12 ' A' 1009 ' ' VAL . . . -94.37 95.22 8.74 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 176.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -169.26 172.51 7.24 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.905 -175.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.644 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.2 OUTLIER -150.7 97.68 2.52 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 122.69 1.233 . . . . 0.0 109.238 176.973 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.586 ' HD3' ' CE1' ' A' ' 995' ' ' TYR . 57.7 mtpt -115.87 144.25 44.29 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 112.869 -1.969 . . . . 0.0 110.084 -176.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 55.5 ttp -46.27 -35.11 4.97 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 124.887 1.275 . . . . 0.0 113.875 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -62.34 -13.0 24.27 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.812 0.339 . . . . 0.0 111.178 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.788 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.4 OUTLIER -48.94 106.14 0.1 Allowed 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.0 177.253 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -18.57 13.91 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.15 175.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -139.73 147.17 40.5 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.169 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1019 ' ' ARG . . . . . 0.477 ' HG2' ' HE3' ' A' ' 993' ' ' TRP . 50.3 ttp180 -147.58 147.63 30.27 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.458 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.589 ' HG2' ' CZ3' ' A' 1008 ' ' TRP . 3.6 ptp180 -155.44 167.78 29.26 Favored 'General case' 0 C--O 1.201 -1.471 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.935 176.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.609 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 28.1 ptt180 -149.93 156.31 41.51 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 123.713 0.633 . . . . 0.0 109.753 177.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.602 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 34.5 ttm180 -88.69 128.25 35.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 117.794 0.27 . . . . 0.0 110.612 177.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.712 ' HA ' ' O ' ' A' ' 981' ' ' SER . 87.2 mt -101.67 128.28 48.04 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 106.924 -1.509 . . . . 0.0 106.924 168.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 4.5 m -107.44 139.1 30.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.14 0 CA-C-O 121.543 0.687 . . . . 0.0 111.93 -174.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.514 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.1 tpt180 -135.61 104.41 5.79 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.1 171.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.722 ' HE2' ' HE3' ' A' 1028 ' ' LYS . 0.9 OUTLIER -72.4 136.76 46.15 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.046 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.648 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.4 ptm180 -138.03 144.46 41.05 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -172.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.722 ' HE3' ' HE2' ' A' 1026 ' ' LYS . 30.4 mmtp -108.61 150.3 27.71 Favored 'General case' 0 CA--C 1.468 -2.2 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.822 -175.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 35.1 ttmt -99.26 -16.46 18.5 Favored 'General case' 0 C--N 1.275 -2.656 0 N-CA-C 103.996 -2.594 . . . . 0.0 103.996 161.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1030 ' ' ASP . . . . . 0.462 ' C ' ' H ' ' A' 1032 ' ' THR . 8.6 t70 49.27 16.1 0.14 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 111.217 -2.72 . . . . 0.0 111.376 -174.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 29.5 tp 55.74 -37.58 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 127.864 2.465 . . . . 0.0 113.247 -172.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1032 ' ' THR . . . . . 0.462 ' H ' ' C ' ' A' 1030 ' ' ASP . 9.0 t -74.79 -14.08 60.66 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.405 1.082 . . . . 0.0 112.878 -178.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.685 ' HB3' ' HA2' ' A' ' 972' ' ' GLY . 11.5 mm-40 -59.45 -43.7 93.1 Favored 'General case' 0 N--CA 1.483 1.179 0 CA-C-N 118.999 0.818 . . . . 0.0 109.908 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 30.7 p -84.69 106.0 15.9 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.013 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -137.34 100.01 4.13 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 18.9 m -72.1 102.15 2.94 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.149 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 49.5 m -72.09 160.84 31.79 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.228 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 9.2 t -146.04 140.03 26.51 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -117.3 -50.25 2.56 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.136 0.493 . . . . 0.0 110.108 -178.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 . . . . . 0 N--CA 1.438 -1.074 0 CA-C-O 118.534 -0.746 . . . . 0.0 109.157 -176.915 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 918' ' ' ILE . . . . . 0.446 HD12 ' N ' ' A' ' 919' ' ' ASP . 2.8 pp . . . . . 0 N--CA 1.477 0.908 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 919' ' ' ASP . . . . . 0.467 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 28.9 t70 -80.96 127.5 74.42 Favored Pre-proline 0 C--O 1.238 0.477 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 920' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 19.0 Cg_exo -65.05 169.85 11.35 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.88 2.387 . . . . 0.0 113.211 -173.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -108.79 -169.54 1.51 Allowed 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.789 -176.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 75.0 m -55.6 120.22 6.89 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.285 0.564 . . . . 0.0 111.84 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -119.67 166.63 12.94 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -102.94 135.3 44.87 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.42 -0.912 . . . . 0.0 112.729 -174.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -132.52 28.37 4.32 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 174.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 100.92 63.35 0.78 Allowed Glycine 0 N--CA 1.439 -1.166 0 CA-C-N 115.064 -0.971 . . . . 0.0 112.23 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -132.31 152.73 51.26 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 174.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.16 124.01 47.01 Favored 'General case' 0 N--CA 1.415 -2.223 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 163.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.485 ' HB2' ' HE3' ' A' 1026 ' ' LYS . 0.1 OUTLIER -141.67 133.0 26.56 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 171.194 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.425 ' O ' ' HG2' ' A' 1027 ' ' ARG . 73.2 t80 -128.36 135.65 49.85 Favored 'General case' 0 C--N 1.295 -1.771 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 -176.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.594 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 34.0 m -77.5 124.45 27.92 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -105.06 159.4 15.86 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 105.153 -2.166 . . . . 0.0 105.153 -173.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.781 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 11.9 pt-20 -151.1 152.55 33.55 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.105 -175.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.619 ' O ' ' HA ' ' A' 1022 ' ' ARG . 8.6 p -137.03 178.63 4.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 N-CA-C 106.438 -1.689 . . . . 0.0 106.438 176.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.54 ' HA ' ' O ' ' A' 1021 ' ' ARG . 49.8 m-85 -142.79 113.11 7.23 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 118.755 0.707 . . . . 0.0 110.761 -174.354 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.567 ' O ' ' HA ' ' A' 1020 ' ' ARG . 31.3 tt0 -79.3 127.42 32.04 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.944 0.778 . . . . 0.0 110.046 173.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 937' ' ' ASN . . . . . 0.451 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 33.5 m-80 -118.53 152.41 36.02 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.632 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 43.5 mt-10 -140.86 162.11 36.21 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 171.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 24.7 p -137.62 142.37 41.23 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.54 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 15.0 ptt180 -151.63 160.05 43.8 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 123.779 0.832 . . . . 0.0 108.92 -178.047 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -66.29 161.23 59.33 Favored Pre-proline 0 C--N 1.311 -1.087 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 171.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.64 97.76 0.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 121.554 1.503 . . . . 0.0 111.396 175.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 89.27 62.56 1.34 Allowed Glycine 0 N--CA 1.441 -0.983 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 -178.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -156.25 -159.65 9.54 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 121.096 -0.573 . . . . 0.0 111.929 -175.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -103.24 133.08 48.92 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 123.989 0.464 . . . . 0.0 110.263 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.632 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 42.2 m95 -80.78 147.41 30.5 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-O 121.3 0.571 . . . . 0.0 109.876 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -127.56 151.29 74.91 Favored Pre-proline 0 C--N 1.296 -1.758 0 N-CA-C 103.018 -2.956 . . . . 0.0 103.018 170.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -49.35 140.15 27.3 Favored 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 122.426 2.084 . . . . 0.0 111.66 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.64 -178.17 0.38 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.435 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -89.73 -40.11 12.72 Favored 'General case' 0 CA--C 1.473 -1.995 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -120.18 88.15 2.88 Favored 'General case' 0 N--CA 1.399 -3.023 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 31.8 m -64.64 -57.79 8.09 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.715 -1.13 . . . . 0.0 112.384 -170.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -92.77 129.27 38.74 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.725 0.774 . . . . 0.0 111.436 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 954' ' ' THR . . . . . 0.572 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 12.9 p -149.61 178.44 8.84 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.133 -169.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -99.27 172.99 7.0 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 105.567 -2.012 . . . . 0.0 105.567 173.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -53.07 -31.55 42.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.931 0.787 . . . . 0.0 111.437 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 957' ' ' ASN . . . . . 0.416 HD21 ' HB2' ' A' ' 959' ' ' ASP . 5.3 p30 -84.16 -7.78 59.27 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.588 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 958' ' ' GLY . . . . . 0.572 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 74.76 56.52 4.9 Favored Glycine 0 CA--C 1.49 -1.525 0 C-N-CA 120.194 -1.003 . . . . 0.0 111.27 -174.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 959' ' ' ASP . . . . . 0.416 ' HB2' HD21 ' A' ' 957' ' ' ASN . 11.3 t70 -105.17 109.66 21.73 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.499 -3.149 . . . . 0.0 102.499 174.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -46.58 115.95 1.18 Allowed 'General case' 0 C--N 1.319 -0.748 0 O-C-N 124.481 1.113 . . . . 0.0 111.164 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -122.42 -177.26 3.57 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.858 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 962' ' ' ALA . . . . . 0.617 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -80.52 161.62 24.74 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 176.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.0 m -80.69 159.94 68.01 Favored Pre-proline 0 C--N 1.314 -0.95 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.699 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 41.7 Cg_exo -46.38 -33.8 13.16 Favored 'Trans proline' 0 N--CA 1.478 0.56 0 C-N-CA 123.674 2.916 . . . . 0.0 115.047 -178.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 2.5 p -72.57 -47.51 47.49 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.507 0.67 . . . . 0.0 110.086 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 966' ' ' GLU . . . . . 0.617 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 40.0 mt-10 -64.84 -32.86 74.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.112 -1.403 . . . . 0.0 110.488 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.509 HD13 ' CH2' ' A' ' 980' ' ' TRP . 14.5 mt -60.9 110.41 1.33 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.923 0.868 . . . . 0.0 111.175 178.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 18.7 p -104.64 164.35 11.82 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.282 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 14.2 p -97.98 136.04 21.22 Favored Pre-proline 0 N--CA 1.442 -0.835 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.421 175.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.604 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 77.8 Cg_endo -71.76 175.57 9.44 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 123.683 2.922 . . . . 0.0 110.492 177.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.53 -46.59 30.76 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.643 2.228 . . . . 0.0 114.011 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.613 ' HA2' ' HB ' ' A' 1034 ' ' THR . . . -72.11 -51.96 12.58 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.732 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.604 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 96.6 m95 -72.01 144.31 48.86 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -177.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.533 ' HB3' ' O ' ' A' 1028 ' ' LYS . 2.6 tp10 -133.47 156.51 47.6 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 113.297 -1.774 . . . . 0.0 106.455 -177.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.493 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 82.6 m95 -89.56 152.11 21.59 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.616 -0.678 . . . . 0.0 110.703 172.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -131.1 -33.78 1.5 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.54 0.686 . . . . 0.0 109.396 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 977' ' ' ASP . . . . . 0.454 ' HB3' ' HD2' ' A' 1025 ' ' ARG . 8.2 t0 -71.44 151.49 43.95 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.83 -47.49 74.84 Favored 'General case' 0 C--N 1.318 -0.788 0 O-C-N 123.527 0.517 . . . . 0.0 111.253 -176.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -164.72 171.97 13.64 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -174.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.699 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 31.6 m95 -84.86 87.13 7.31 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.884 0.849 . . . . 0.0 109.14 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 3.2 m -93.45 145.43 24.5 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.715 -1.129 . . . . 0.0 108.575 -176.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 982' ' ' TYR . . . . . 0.463 ' HA ' ' O ' ' A' 1022 ' ' ARG . 3.5 p90 -73.39 136.03 44.31 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 121.919 0.866 . . . . 0.0 110.722 -176.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.577 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 4.4 t70 -82.92 141.02 32.49 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 113.668 -1.606 . . . . 0.0 111.746 -172.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.5 pp -132.29 5.63 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.442 176.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 985' ' ' ASN . . . . . 0.571 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 17.1 m120 -92.31 18.91 7.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.042 0.449 . . . . 0.0 111.845 -175.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.577 ' HD3' ' OD2' ' A' ' 983' ' ' ASP . 8.2 mpt_? -143.87 -178.27 5.84 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 106.344 -1.725 . . . . 0.0 106.344 -178.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.15 83.73 2.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 118.71 0.687 . . . . 0.0 112.008 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.411 HG12 ' HG2' ' A' ' 994' ' ' GLU . 15.8 m -143.65 157.63 16.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 C-N-CA 124.666 1.186 . . . . 0.0 107.966 178.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -55.22 173.01 0.11 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.599 0.36 . . . . 0.0 110.765 175.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.59 -31.4 72.61 Favored 'General case' 0 CA--C 1.492 -1.265 0 O-C-N 121.282 -0.886 . . . . 0.0 110.422 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 991' ' ' LYS . . . . . 0.441 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 24.4 mtmm -92.6 0.3 57.41 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.038 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.7 -21.16 41.58 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 112.257 -0.337 . . . . 0.0 112.257 175.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.441 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 81.6 m95 -50.6 124.96 11.89 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.411 ' HG2' HG12 ' A' ' 988' ' ' VAL . 23.7 mt-10 -99.1 157.63 16.22 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.871 -1.059 . . . . 0.0 109.287 176.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.918 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 86.5 t80 -82.63 86.38 6.84 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 113.366 -1.743 . . . . 0.0 109.096 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 996' ' ' GLY . . . . . 0.472 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -109.66 84.04 0.35 Allowed Glycine 0 CA--C 1.49 -1.484 0 C-N-CA 120.137 -1.03 . . . . 0.0 111.369 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.47 HD11 HD11 ' A' ' 999' ' ' ILE . 0.4 OUTLIER -92.16 131.92 37.93 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 CA-C-O 121.696 0.76 . . . . 0.0 110.722 -176.37 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 998' ' ' THR . . . . . 0.443 ' OG1' ' HG3' ' A' 1005 ' ' PRO . 4.0 m -132.07 121.88 24.54 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.47 HD11 HD11 ' A' ' 997' ' ' ILE . 59.3 mt -115.24 98.25 50.08 Favored Pre-proline 0 C--N 1.316 -0.859 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -175.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 26.3 Cg_endo -62.27 132.23 37.82 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.403 2.069 . . . . 0.0 113.405 -176.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1001 ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 1.2 Cg_endo -79.46 143.92 70.26 Favored 'Cis proline' 0 CA--C 1.51 -0.698 0 C-N-CA 123.117 -1.618 . . . . 0.0 112.293 -1.364 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 5.8 t0 -147.2 -174.8 4.61 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 113.764 -1.562 . . . . 0.0 107.883 -173.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -116.16 -61.77 1.68 Allowed 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.112 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -160.52 157.85 24.5 Favored Pre-proline 0 C--N 1.315 -0.901 0 N-CA-C 101.907 -3.368 . . . . 0.0 101.907 -177.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.443 ' HG3' ' OG1' ' A' ' 998' ' ' THR . 53.7 Cg_exo -59.12 121.11 9.39 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 CA-C-N 122.172 1.811 . . . . 0.0 109.864 174.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 60.6 mttt -66.04 -29.02 69.3 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -177.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.0 t -145.29 140.65 27.94 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 114.438 -1.256 . . . . 0.0 109.286 -165.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.546 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 63.8 m95 -126.12 138.66 53.7 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 125.213 1.57 . . . . 0.0 107.322 176.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.711 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 34.5 t -139.87 166.83 20.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 -176.521 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1010 ' ' ALA . . . . . 0.44 ' H ' HG12 ' A' 1009 ' ' VAL . . . -92.98 24.41 3.71 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -171.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -135.85 137.28 41.33 Favored 'General case' 0 C--N 1.315 -0.917 0 O-C-N 121.39 -0.819 . . . . 0.0 111.06 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.417 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -92.57 132.41 36.87 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 175.851 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.509 ' H ' ' CD2' ' A' 1016 ' ' HIS . 96.2 mttt -152.53 176.83 11.28 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 -171.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.56 6.39 17.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.67 0.747 . . . . 0.0 111.008 -178.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -90.99 7.92 37.92 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 122.481 1.134 . . . . 0.0 108.243 175.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.918 ' CE1' ' HA ' ' A' ' 995' ' ' TYR . 9.9 m-70 -88.12 172.29 9.62 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 114.168 -1.378 . . . . 0.0 111.812 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -158.0 -35.77 0.07 Allowed 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 112.3 -2.227 . . . . 0.0 106.266 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1018 ' ' HIS . . . . . 0.472 ' HB2' ' O ' ' A' ' 996' ' ' GLY . 35.1 m170 -132.08 151.65 51.65 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 170.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 34.4 ptt180 -149.05 148.44 29.72 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 173.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.567 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.7 ptp180 -151.34 152.18 32.79 Favored 'General case' 0 CA--C 1.482 -1.657 0 C-N-CA 117.672 -1.611 . . . . 0.0 110.804 176.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.54 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 25.0 ptt180 -128.08 142.83 51.09 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.624 -177.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.781 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 32.8 ttm180 -78.43 123.32 26.9 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 114.243 -1.344 . . . . 0.0 110.27 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1023 ' ' LEU . . . . . . . . . . . . . 17.5 mt -103.88 129.85 51.42 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 103.978 -2.601 . . . . 0.0 103.978 168.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.445 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 17.0 m -105.87 133.68 49.56 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 O-C-N 123.63 0.582 . . . . 0.0 111.316 -172.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.454 ' HD2' ' HB3' ' A' ' 977' ' ' ASP . 13.4 tpt180 -135.52 103.98 5.66 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 172.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.6 OUTLIER -70.39 138.36 51.24 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.843 -1.54 . . . . 0.0 106.843 177.9 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.493 HH21 ' HD2' ' A' ' 970' ' ' PRO . 15.0 ptm180 -131.21 143.36 50.53 Favored 'General case' 0 CA--C 1.488 -1.439 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 -173.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.533 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 28.7 ttmt -132.77 134.35 44.6 Favored 'General case' 0 C--N 1.281 -2.371 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -175.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.583 ' C ' ' H ' ' A' 1031 ' ' LEU . 36.3 ttmt -84.17 -22.19 31.06 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 122.795 1.284 . . . . 0.0 107.815 -177.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 34.3 t70 65.6 -33.53 0.17 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 127.928 2.491 . . . . 0.0 112.566 -173.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1031 ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' 1029 ' ' LYS . 21.9 tp 87.55 9.92 0.15 Allowed 'General case' 0 C--N 1.309 -1.16 0 C-N-CA 128.698 2.799 . . . . 0.0 109.718 174.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 4.4 m -112.69 -8.93 13.76 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -87.03 -37.12 17.77 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 113.534 -1.666 . . . . 0.0 109.654 -174.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1034 ' ' THR . . . . . 0.613 ' HB ' ' HA2' ' A' ' 972' ' ' GLY . 13.7 t -96.41 131.26 43.16 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 175.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -88.23 104.19 16.49 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 22.9 p -78.89 -18.29 54.15 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.37 0.605 . . . . 0.0 110.631 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 70.9 m -98.45 97.84 9.12 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.838 175.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 25.6 p -100.9 127.89 47.18 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.087 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -130.01 -28.67 2.15 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.43 -175.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 . . . . . 0 N--CA 1.445 -0.693 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -177.565 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.471 0.605 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -112.94 149.93 42.06 Favored Pre-proline 0 C--N 1.314 -0.948 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -62.72 -28.63 76.57 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.738 2.959 . . . . 0.0 113.152 177.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -56.66 -41.37 77.12 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 123.641 0.776 . . . . 0.0 112.175 -175.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 7.5 t -107.02 153.51 22.48 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -92.62 85.24 5.21 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -111.65 -55.21 2.53 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.583 -173.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . 68.76 -70.82 0.13 Allowed 'General case' 0 C--N 1.327 -0.383 0 O-C-N 124.197 0.935 . . . . 0.0 111.803 -176.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -157.13 57.49 0.37 Allowed Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.47 -177.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.473 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 25.2 m-70 -138.24 174.34 10.66 Favored 'General case' 0 CA--C 1.503 -0.864 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 174.207 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.65 122.03 45.21 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 160.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.755 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.0 OUTLIER -108.66 175.45 5.46 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.197 175.1 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.742 ' O ' ' HG2' ' A' 1027 ' ' ARG . 85.3 t80 -159.82 119.49 2.91 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 176.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.43 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 27.9 m -73.14 123.26 23.26 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 171.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 932' ' ' ASP . . . . . 0.69 ' HB2' ' HD2' ' A' 1027 ' ' ARG . 8.5 t70 -100.33 155.86 17.56 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -155.51 147.96 23.91 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.507 -171.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.537 HG22 ' H ' ' A' ' 935' ' ' TYR . 8.1 p -144.48 -179.53 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 N-CA-C 105.589 -2.004 . . . . 0.0 105.589 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.551 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 67.8 m-85 -136.69 150.81 48.67 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -178.186 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.572 ' O ' ' HA ' ' A' 1020 ' ' ARG . 7.3 tt0 -122.93 122.36 38.39 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 937' ' ' ASN . . . . . 0.52 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 29.4 m-80 -113.11 142.57 45.6 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 122.32 1.057 . . . . 0.0 112.833 -173.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.618 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 35.7 mt-10 -135.63 161.93 34.15 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 112.672 -2.058 . . . . 0.0 105.664 171.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 939' ' ' SER . . . . . 0.476 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 34.9 p -149.56 158.97 44.66 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 118.65 0.659 . . . . 0.0 112.404 -175.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' 1017 ' ' THR . 37.5 ptt180 -156.77 159.52 38.37 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.731 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -75.94 165.26 54.59 Favored Pre-proline 0 C--N 1.311 -1.095 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 168.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -62.68 84.61 0.11 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 121.424 1.416 . . . . 0.0 110.643 171.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 132.49 -2.2 4.93 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -175.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 944' ' ' GLY . . . . . 0.512 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -96.42 -172.33 35.11 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 108.048 -2.021 . . . . 0.0 108.048 177.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -127.57 161.58 28.48 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 120.112 1.956 . . . . 0.0 105.803 170.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.658 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 54.6 m95 -64.07 134.8 55.62 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 122.282 1.039 . . . . 0.0 113.463 -169.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -136.27 175.62 3.41 Favored Pre-proline 0 C--N 1.309 -1.171 0 N-CA-C 104.391 -2.448 . . . . 0.0 104.391 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.86 126.92 24.14 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.707 1.605 . . . . 0.0 111.814 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 949' ' ' ALA . . . . . 0.476 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -80.84 15.01 1.92 Allowed 'General case' 0 C--O 1.239 0.532 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -178.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 78.37 -62.19 0.35 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 125.293 1.437 . . . . 0.0 108.623 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.83 83.77 2.79 Favored 'General case' 0 N--CA 1.417 -2.098 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.3 m -72.26 -58.72 3.18 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.694 -171.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 953' ' ' TYR . . . . . 0.551 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 88.3 m-85 -97.88 123.93 42.07 Favored 'General case' 0 C--N 1.309 -1.196 0 C-N-CA 119.053 -1.059 . . . . 0.0 110.095 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 954' ' ' THR . . . . . 0.435 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 76.5 p -136.35 171.41 14.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.359 -170.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -95.75 176.93 5.95 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 105.685 -1.969 . . . . 0.0 105.685 175.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.64 -24.42 5.54 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 178.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 957' ' ' ASN . . . . . 0.431 HD22 ' HB2' ' A' ' 959' ' ' ASP . 5.9 p30 -96.66 -4.03 41.64 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.655 -0.653 . . . . 0.0 111.35 178.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 958' ' ' GLY . . . . . 0.435 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 93.53 -1.49 69.21 Favored Glycine 0 CA--C 1.499 -0.96 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.165 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 959' ' ' ASP . . . . . 0.431 ' HB2' HD22 ' A' ' 957' ' ' ASN . 7.0 t70 -57.55 104.73 0.19 Allowed 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -51.94 133.62 32.28 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.876 0.846 . . . . 0.0 110.908 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -128.63 -173.94 3.1 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.767 -1.106 . . . . 0.0 108.991 -176.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 962' ' ' ALA . . . . . 0.47 ' HB1' ' HB3' ' A' ' 966' ' ' GLU . . . -75.99 157.81 32.64 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 176.562 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.5 m -77.52 156.96 80.65 Favored Pre-proline 0 N--CA 1.441 -0.92 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.653 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 52.4 Cg_exo -51.31 -20.12 7.68 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.457 2.772 . . . . 0.0 114.614 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.3 p -70.81 -57.8 4.27 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 966' ' ' GLU . . . . . 0.47 ' HB3' ' HB1' ' A' ' 962' ' ' ALA . 35.2 tt0 -69.09 -27.83 65.96 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.229 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 964' ' ' PRO . 31.6 mt -59.81 110.75 1.23 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 24.3 p -116.34 177.54 4.65 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.688 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.534 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 9.0 p -101.64 143.19 26.1 Favored Pre-proline 0 C--N 1.307 -1.28 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.676 178.15 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.607 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 97.4 Cg_endo -74.56 -179.37 4.77 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.029 2.486 . . . . 0.0 109.418 172.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.35 -51.78 9.75 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.922 1.748 . . . . 0.0 114.457 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.535 ' HA2' ' HB ' ' A' 1034 ' ' THR . . . -74.31 -46.24 21.47 Favored Glycine 0 N--CA 1.442 -0.961 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.992 -177.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.607 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 99.2 m95 -69.23 130.43 42.62 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.458 ' HB3' ' O ' ' A' 1028 ' ' LYS . 6.5 tp10 -118.66 143.42 46.84 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 126.499 1.92 . . . . 0.0 109.748 -173.112 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -88.55 152.64 21.72 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.551 0.691 . . . . 0.0 111.446 173.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -137.86 -36.61 0.61 Allowed 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.673 177.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 977' ' ' ASP . . . . . 0.684 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.4 m-20 -77.62 149.66 34.73 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -174.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -54.81 -51.58 65.37 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 124.782 1.301 . . . . 0.0 113.186 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -168.77 167.76 10.95 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-O 120.877 0.37 . . . . 0.0 110.321 -175.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.653 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 33.5 m95 -74.72 114.71 13.47 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 177.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 2.6 p -123.95 149.23 46.18 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -172.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 982' ' ' TYR . . . . . 0.596 ' HA ' ' O ' ' A' 1022 ' ' ARG . 1.0 OUTLIER -74.21 129.54 38.01 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.577 0.703 . . . . 0.0 111.28 -172.797 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -87.75 135.26 33.45 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.806 -170.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 26.3 pt -115.68 24.79 4.62 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.985 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 985' ' ' ASN . . . . . 0.622 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 25.3 t-20 -101.44 15.64 28.18 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.783 0.802 . . . . 0.0 110.369 -175.285 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.622 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 8.7 mpt_? -138.24 -176.74 4.55 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 -174.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -78.01 75.63 4.54 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.953 0.883 . . . . 0.0 109.443 176.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 27.6 m -141.53 152.21 19.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.111 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -55.32 169.37 0.28 Allowed 'General case' 0 C--N 1.323 -0.567 0 O-C-N 123.89 0.744 . . . . 0.0 111.113 173.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -52.58 -32.24 40.17 Favored 'General case' 0 CA--C 1.493 -1.25 0 CA-C-O 121.65 0.738 . . . . 0.0 111.751 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 991' ' ' LYS . . . . . 0.444 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 70.9 mmtt -104.2 15.17 28.95 Favored 'General case' 0 N--CA 1.417 -2.085 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.95 -176.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 89.48 -15.81 57.76 Favored Glycine 0 C--O 1.226 -0.399 0 CA-C-N 115.587 -0.733 . . . . 0.0 113.028 174.078 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.683 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 82.0 m95 -58.78 109.53 0.83 Allowed 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -177.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.91 160.27 14.51 Favored 'General case' 0 C--O 1.254 1.301 0 C-N-CA 123.756 0.823 . . . . 0.0 110.952 173.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.663 ' HE1' ' HB ' ' A' ' 997' ' ' ILE . 0.3 OUTLIER -75.7 102.77 5.51 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 125.435 1.494 . . . . 0.0 112.09 -172.454 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 996' ' ' GLY . . . . . 0.44 ' HA2' ' HB3' ' A' 1005 ' ' PRO . . . -107.72 88.8 0.55 Allowed Glycine 0 CA--C 1.492 -1.405 0 C-N-CA 119.051 -1.547 . . . . 0.0 112.261 173.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.663 ' HB ' ' HE1' ' A' ' 995' ' ' TYR . 2.5 tt -97.24 127.64 49.28 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.082 0 O-C-N 121.341 -1.093 . . . . 0.0 110.198 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 20.7 m -118.42 82.9 1.92 Allowed 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 23.3 pt -104.4 130.81 22.63 Favored Pre-proline 0 C--N 1.316 -0.88 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.291 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 36.5 Cg_endo -64.54 145.29 87.15 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.703 2.269 . . . . 0.0 112.754 -178.553 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1001 ' ' PRO . . . . . 0.434 ' O ' ' HB2' ' A' 1002 ' ' ASP . 7.9 Cg_endo -91.26 135.55 9.03 Favored 'Cis proline' 0 N--CA 1.446 -1.323 0 C-N-CA 123.024 -1.657 . . . . 0.0 112.844 -2.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1002 ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' 1001 ' ' PRO . 3.7 t70 158.69 170.37 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 111.523 -2.581 . . . . 0.0 105.822 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -149.81 33.97 0.68 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 118.646 0.657 . . . . 0.0 109.943 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 90.1 mttt -159.92 127.96 2.85 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.671 -176.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.711 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 32.8 Cg_exo -68.56 124.26 11.39 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 121.521 1.481 . . . . 0.0 109.984 172.098 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 45.8 pttt -123.35 8.16 9.06 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -174.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.3 t -138.83 116.48 11.4 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.711 ' CZ2' ' HB2' ' A' 1005 ' ' PRO . 62.0 m95 -121.96 134.49 54.83 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.939 -171.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 15.4 m -156.29 178.08 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 -175.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -94.98 104.64 16.52 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 175.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -169.71 176.38 4.91 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.255 0.347 . . . . 0.0 110.34 -176.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.62 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 10.2 tp10 -163.13 104.4 0.99 Allowed 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 122.221 1.01 . . . . 0.0 108.608 176.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' A' 1016 ' ' HIS . 73.0 mttt -135.62 157.45 46.85 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 113.667 -1.606 . . . . 0.0 109.263 -176.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 49.0 ttp -48.26 -41.64 28.31 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 125.137 1.375 . . . . 0.0 114.339 -177.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -59.23 -16.16 19.39 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.658 ' HB3' ' CH2' ' A' ' 946' ' ' TRP . 7.6 m80 -53.53 100.01 0.03 OUTLIER 'General case' 0 CA--C 1.511 -0.542 0 O-C-N 123.635 0.585 . . . . 0.0 111.345 172.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1017 ' ' THR . . . . . 0.528 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.0 OUTLIER -96.88 -22.72 16.72 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 122.845 1.307 . . . . 0.0 108.178 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -139.68 157.89 45.03 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 113.437 -1.711 . . . . 0.0 108.237 -178.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1019 ' ' ARG . . . . . 0.683 ' HG2' ' CE3' ' A' ' 993' ' ' TRP . 44.8 ttp180 -157.82 148.44 20.85 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.05 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 5.4 ptp180 -152.1 166.34 31.96 Favored 'General case' 0 CA--C 1.487 -1.478 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.643 178.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.502 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 33.6 ptt180 -145.45 150.02 35.76 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.747 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.596 ' O ' ' HA ' ' A' ' 982' ' ' TYR . 41.4 ttm180 -87.22 120.91 28.99 Favored 'General case' 0 N--CA 1.437 -1.112 0 O-C-N 123.212 0.32 . . . . 0.0 110.758 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.568 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 86.1 mt -97.61 124.38 41.88 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 170.142 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.557 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 16.4 m -109.45 141.88 23.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 CA-C-O 121.823 0.82 . . . . 0.0 111.512 -175.376 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.543 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.4 tpt180 -134.45 104.78 6.25 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 113.662 -1.608 . . . . 0.0 107.936 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.684 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -75.19 146.62 41.09 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -178.35 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.742 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 13.1 ptm180 -147.35 171.37 15.55 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -170.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.755 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 15.5 ptpt -158.58 152.4 23.5 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 178.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.56 ' C ' ' H ' ' A' 1031 ' ' LEU . 38.1 ttmt -84.23 -10.72 57.45 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 122.812 1.291 . . . . 0.0 107.682 -176.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1030 ' ' ASP . . . . . 0.478 ' HB3' ' HB2' ' A' 1033 ' ' GLN . 32.0 t70 72.23 -20.47 0.25 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 112.011 -2.359 . . . . 0.0 112.717 178.277 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1031 ' ' LEU . . . . . 0.56 ' H ' ' C ' ' A' 1029 ' ' LYS . 19.7 tp 78.17 -12.86 1.02 Allowed 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 127.78 2.432 . . . . 0.0 112.202 177.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 6.7 t -135.36 9.58 3.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 122.167 0.984 . . . . 0.0 108.822 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.478 ' HB2' ' HB3' ' A' 1030 ' ' ASP . 10.2 tp60 -69.22 -61.97 1.57 Allowed 'General case' 0 N--CA 1.438 -1.067 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 174.599 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1034 ' ' THR . . . . . 0.535 ' HB ' ' HA2' ' A' ' 972' ' ' GLY . 6.5 t -84.62 75.9 10.25 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-O 122.885 1.326 . . . . 0.0 108.071 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -83.04 -19.83 36.16 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.704 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 58.8 m -79.33 117.25 20.15 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 175.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 40.4 m -92.36 130.58 38.01 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 14.6 t -77.88 -17.28 57.51 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 121.063 0.458 . . . . 0.0 110.44 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -108.53 174.88 5.68 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 21.8 ttt180 . . . . . 0 C--N 1.318 -0.775 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -179.393 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 3.3 mp . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 69.63 131.74 0.04 OUTLIER Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 124.016 0.926 . . . . 0.0 111.396 -178.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -65.12 -22.09 62.06 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.149 1.899 . . . . 0.0 111.06 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -65.03 -32.54 74.31 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.192 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 32.6 m -89.32 78.95 7.14 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 176.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -85.26 -19.37 31.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.052 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 924' ' ' ASP . . . . . 0.471 ' HA ' ' CD2' ' A' ' 927' ' ' HIS . 28.7 t70 -115.99 118.52 33.16 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.434 -178.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -113.36 12.66 18.86 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.001 175.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 120.86 52.89 0.24 Allowed Glycine 0 N--CA 1.442 -0.932 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.256 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.471 ' CD2' ' HA ' ' A' ' 924' ' ' ASP . 9.6 m-70 -105.86 -152.31 0.47 Allowed 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 173.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.5 m -166.18 115.54 0.95 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 101.404 -3.554 . . . . 0.0 101.404 169.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.531 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 1.4 pm0 -142.92 136.04 28.2 Favored 'General case' 0 C--N 1.286 -2.193 0 CA-C-N 119.684 1.129 . . . . 0.0 109.005 177.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.459 ' O ' ' HG2' ' A' 1027 ' ' ARG . 79.2 t80 -137.64 137.75 38.76 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -177.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.639 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 17.1 m -76.3 133.65 39.97 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.345 0.117 . . . . 0.0 110.995 178.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -111.08 163.82 13.47 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.541 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 10.6 pt-20 -151.24 150.74 30.94 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -173.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' 1022 ' ' ARG . 7.1 p -138.82 175.39 8.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 N-CA-C 106.191 -1.781 . . . . 0.0 106.191 175.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.7 ' HA ' ' O ' ' A' 1021 ' ' ARG . 68.2 m-85 -139.43 146.47 40.14 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -175.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.73 ' O ' ' HA ' ' A' 1020 ' ' ARG . 30.0 tt0 -121.59 120.33 34.5 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -174.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 937' ' ' ASN . . . . . 0.525 ' HA ' ' O ' ' A' 1019 ' ' ARG . 26.2 m-80 -109.14 140.43 42.74 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.361 1.077 . . . . 0.0 112.891 -172.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.581 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 66.1 mt-10 -133.83 158.68 42.78 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 104.345 -2.465 . . . . 0.0 104.345 170.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 17.4 m -142.56 151.8 41.94 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 119.017 0.826 . . . . 0.0 111.48 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.662 ' O ' ' HA ' ' A' 1017 ' ' THR . 32.1 ptt180 -148.98 159.52 44.14 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.568 178.241 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -79.68 164.46 53.37 Favored Pre-proline 0 C--N 1.302 -1.499 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 171.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -64.04 91.44 0.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 121.123 1.215 . . . . 0.0 109.909 172.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 123.95 0.53 9.0 Favored Glycine 0 N--CA 1.44 -1.065 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 -175.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 944' ' ' GLY . . . . . 0.566 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -101.26 -175.08 28.82 Favored Glycine 0 CA--C 1.505 -0.586 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 178.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -119.37 166.7 12.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.977 1.889 . . . . 0.0 105.989 169.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.581 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 40.8 m95 -71.72 138.73 48.72 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-O 122.146 0.974 . . . . 0.0 112.408 -171.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -129.16 174.32 4.69 Favored Pre-proline 0 C--N 1.307 -1.251 0 N-CA-C 103.736 -2.691 . . . . 0.0 103.736 175.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -56.74 133.29 57.06 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 CA-C-N 121.364 1.523 . . . . 0.0 111.335 174.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.86 -170.88 0.12 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.681 0.753 . . . . 0.0 112.456 177.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.51 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.0 OUTLIER -91.51 -36.82 13.51 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -178.012 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -120.43 105.65 11.07 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 104.912 -2.255 . . . . 0.0 104.912 169.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.1 m -66.62 -64.3 0.88 Allowed 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.101 -176.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 953' ' ' TYR . . . . . 0.628 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 73.4 m-85 -93.02 135.56 34.08 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 118.834 -1.146 . . . . 0.0 110.446 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 954' ' ' THR . . . . . 0.436 ' HA ' ' H ' ' A' ' 961' ' ' ALA . 77.0 p -147.2 -177.27 5.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -174.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -103.29 -178.05 3.55 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 170.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.59 -26.08 12.44 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 176.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -87.52 -51.33 5.97 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 121.907 -0.496 . . . . 0.0 110.869 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 146.05 -7.63 1.43 Allowed Glycine 0 CA--C 1.493 -1.344 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.741 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.96 108.64 1.25 Allowed 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 175.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 960' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 961' ' ' ALA . 50.7 tttm -47.19 119.94 2.88 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.598 1.186 . . . . 0.0 110.526 178.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.479 ' O ' ' HG2' ' A' ' 960' ' ' LYS . . . -90.2 175.4 7.15 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 962' ' ' ALA . . . . . 0.529 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -72.44 -52.82 14.2 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.148 -1.021 . . . . 0.0 112.683 -175.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 57.1 p 138.48 156.53 0.0 OUTLIER Pre-proline 0 C--N 1.309 -1.191 0 C-N-CA 126.913 2.085 . . . . 0.0 109.919 -171.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.482 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 4.8 Cg_endo -58.92 -26.34 80.68 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 121.879 1.719 . . . . 0.0 112.291 172.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 50.7 m -74.19 -53.31 10.1 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 175.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 966' ' ' GLU . . . . . 0.529 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 33.3 mt-10 -75.42 5.26 6.0 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.437 ' HA ' HD13 ' A' ' 967' ' ' LEU . 0.4 OUTLIER -96.79 111.94 23.9 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 172.205 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 18.7 p -110.74 174.31 5.92 Favored 'General case' 0 C--N 1.296 -1.761 0 CA-C-O 121.221 0.534 . . . . 0.0 111.491 -174.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.421 ' HA ' ' NH2' ' A' 1027 ' ' ARG . 16.1 p -108.73 128.85 24.77 Favored Pre-proline 0 N--CA 1.436 -1.152 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 173.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.647 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 73.5 Cg_endo -73.49 166.02 30.93 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.995 2.464 . . . . 0.0 110.337 177.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -49.64 -30.75 22.91 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.111 2.54 . . . . 0.0 114.13 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.689 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -107.31 23.17 27.54 Favored Glycine 0 N--CA 1.437 -1.235 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.577 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.647 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 75.7 m95 -135.74 132.84 37.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 117.629 0.714 . . . . 0.0 110.335 172.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.617 ' HB3' ' O ' ' A' 1028 ' ' LYS . 3.9 tp10 -111.54 142.15 44.2 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.547 ' CE3' ' HG2' ' A' 1025 ' ' ARG . 75.7 m95 -76.3 138.56 40.6 Favored 'General case' 0 C--N 1.298 -1.663 0 C-N-CA 118.014 -1.474 . . . . 0.0 111.106 170.234 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 976' ' ' GLU . . . . . 0.46 ' CG ' ' HB3' ' A' 1026 ' ' LYS . 4.2 pt-20 -108.92 -34.66 6.57 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 977' ' ' ASP . . . . . 0.425 ' HB3' ' HG3' ' A' 1025 ' ' ARG . 5.5 t0 -87.16 159.39 18.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 175.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -89.58 -31.99 17.33 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.647 -172.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -157.14 170.28 22.86 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 -174.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.555 ' HA ' ' O ' ' A' 1024 ' ' VAL . 23.6 m95 -94.73 110.07 21.96 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 175.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 50.0 m -124.57 158.94 31.8 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -178.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 982' ' ' TYR . . . . . 0.459 ' HA ' ' O ' ' A' 1022 ' ' ARG . 6.6 p90 -74.65 144.82 43.65 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -167.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -95.53 120.95 36.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.217 -176.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.45 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.6 pp -105.62 9.4 9.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.907 -177.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -94.46 39.68 1.09 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.793 1.282 . . . . 0.0 107.921 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.419 HH21 ' CD ' ' A' ' 994' ' ' GLU . 57.6 mtp85 -145.47 176.88 9.26 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -175.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -77.86 85.5 4.12 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 174.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.45 HG21 ' HA ' ' A' ' 984' ' ' ILE . 20.5 m -127.08 -173.34 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.933 -178.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -96.7 -174.15 2.93 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -66.22 -34.01 77.06 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.42 0.628 . . . . 0.0 109.404 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -91.31 6.12 46.55 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.124 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 992' ' ' GLY . . . . . 0.445 ' HA2' ' HB ' ' A' ' 988' ' ' VAL . . . 67.35 80.34 0.2 Allowed Glycine 0 C--O 1.215 -1.089 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -179.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.511 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 98.2 m95 -151.98 145.25 24.69 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.474 ' HB2' ' HB3' ' A' 1008 ' ' TRP . 4.9 pt-20 -119.4 157.29 28.5 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 122.33 1.062 . . . . 0.0 113.83 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.754 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 6.8 t80 -74.21 101.84 4.11 Favored 'General case' 0 C--O 1.209 -1.067 0 C-N-CA 128.686 2.795 . . . . 0.0 112.689 -173.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 996' ' ' GLY . . . . . 0.413 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -119.82 111.7 2.07 Favored Glycine 0 N--CA 1.434 -1.479 0 C-N-CA 119.63 -1.271 . . . . 0.0 111.299 173.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.608 HG22 ' HA ' ' A' 1016 ' ' HIS . 10.3 pt -121.54 145.12 28.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 175.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 13.6 t -139.04 140.39 38.09 Favored 'General case' 0 N--CA 1.425 -1.711 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 176.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.474 ' O ' HD12 ' A' ' 999' ' ' ILE . 2.3 pp -107.38 130.23 23.14 Favored Pre-proline 0 C--N 1.306 -1.306 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.087 -179.34 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 55.9 Cg_endo -71.69 139.98 34.88 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.345 2.03 . . . . 0.0 112.815 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1001 ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 5.7 Cg_endo -92.85 156.63 19.99 Favored 'Cis proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.747 -1.772 . . . . 0.0 112.028 -3.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 12.3 t70 -168.77 -93.98 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.001 175.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 167.83 -75.64 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.5 0 C-N-CA 125.057 1.343 . . . . 0.0 109.335 -177.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -129.14 141.06 40.48 Favored Pre-proline 0 C--N 1.317 -0.823 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -171.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.442 ' HG2' ' HB2' ' A' 1018 ' ' HIS . 80.4 Cg_exo -54.45 143.66 65.72 Favored 'Trans proline' 0 CA--C 1.511 -0.628 0 C-N-CA 123.326 2.684 . . . . 0.0 110.3 167.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 43.9 mmtt -106.16 -45.23 4.37 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 -176.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 14.4 m -97.35 144.69 26.86 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 112.624 -2.08 . . . . 0.0 111.359 -169.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.725 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 66.0 m95 -135.22 136.09 41.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.797 1.239 . . . . 0.0 107.862 -178.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.541 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 57.4 t -146.77 173.39 2.64 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.745 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -172.147 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1010 ' ' ALA . . . . . 0.448 ' N ' HG12 ' A' 1009 ' ' VAL . . . -78.91 -18.79 53.26 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -177.132 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -92.9 107.68 19.41 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -169.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.434 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 18.2 tp10 -72.19 121.59 19.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.914 0.864 . . . . 0.0 109.78 171.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.455 ' H ' ' CE1' ' A' 1016 ' ' HIS . 28.6 mtpp -124.09 152.85 42.24 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.811 -174.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 51.6 ttp -57.34 -37.99 73.41 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 124.212 0.945 . . . . 0.0 112.4 178.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -72.55 19.76 0.08 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.754 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.9 OUTLIER -69.77 175.07 4.52 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-O 122.174 0.987 . . . . 0.0 112.473 174.914 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1017 ' ' THR . . . . . 0.662 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.7 OUTLIER -158.52 -35.44 0.07 Allowed 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 113.307 -1.77 . . . . 0.0 109.102 -172.924 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1018 ' ' HIS . . . . . 0.442 ' HB2' ' HG2' ' A' 1005 ' ' PRO . 0.2 OUTLIER -138.58 147.48 43.05 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.72 -178.675 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1019 ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 937' ' ' ASN . 40.3 ttp180 -145.91 143.7 29.72 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 177.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.73 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.6 ptp180 -150.88 165.92 32.14 Favored 'General case' 0 C--O 1.2 -1.502 0 O-C-N 123.881 0.738 . . . . 0.0 109.362 176.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.7 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.1 ptt180 -144.59 148.55 34.51 Favored 'General case' 0 C--N 1.295 -1.788 0 O-C-N 123.613 0.57 . . . . 0.0 110.693 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.541 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 37.2 ttm180 -84.48 119.48 25.2 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 123.924 0.765 . . . . 0.0 110.254 178.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.415 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 69.4 mt -97.99 126.64 43.49 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 168.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.555 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 11.1 m -104.75 143.55 16.02 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.656 0 CA-C-O 121.01 0.433 . . . . 0.0 111.716 -174.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.547 ' HG2' ' CE3' ' A' ' 975' ' ' TRP . 0.5 OUTLIER -148.09 113.66 5.66 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.133 167.797 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.639 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.5 tmtp? -77.56 154.09 32.71 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 177.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 11.4 ptm180 -142.37 153.21 43.6 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 -176.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.617 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 36.3 ttmt -142.08 136.64 30.34 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 -172.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.689 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.0 ttmt -90.23 -24.65 20.9 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 123.057 1.408 . . . . 0.0 107.586 -177.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1030 ' ' ASP . . . . . 0.466 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 16.2 t0 54.7 12.33 0.55 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 112.23 -2.259 . . . . 0.0 111.043 -170.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 19.0 tp 66.71 -42.18 0.4 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.339 2.256 . . . . 0.0 112.229 -176.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 14.9 p -97.61 30.49 2.91 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -175.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.555 ' CD ' ' HB2' ' A' ' 974' ' ' GLU . 4.3 mm100 -58.16 -49.41 77.12 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.304 173.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 8.0 t -138.9 83.19 1.94 Allowed 'General case' 0 N--CA 1.434 -1.24 0 CA-C-O 122.74 1.257 . . . . 0.0 110.568 177.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -107.49 125.4 51.22 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.654 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 21.6 p -126.64 14.34 7.55 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.337 0.589 . . . . 0.0 111.089 -178.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 20.4 m -81.77 129.09 34.61 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 89.2 m -74.83 119.62 19.26 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -73.71 90.51 1.84 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.003 -176.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 . . . . . 0 C--N 1.318 -0.768 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 174.545 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 33.4 pt . . . . . 0 N--CA 1.475 0.785 0 CA-C-O 121.21 0.528 . . . . 0.0 109.647 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 919' ' ' ASP . . . . . 0.425 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 19.8 t70 -130.74 120.6 18.68 Favored Pre-proline 0 C--O 1.243 0.747 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.599 -176.106 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 920' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 19.1 Cg_exo -69.74 116.54 4.6 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.32 2.68 . . . . 0.0 110.898 176.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -55.45 121.41 8.94 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.457 -178.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 37.0 p 56.86 108.4 0.01 OUTLIER 'General case' 0 C--O 1.237 0.402 0 C-N-CA 125.717 1.607 . . . . 0.0 112.821 -174.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -78.24 -36.8 46.51 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 924' ' ' ASP . . . . . 0.411 ' HA ' ' HD2' ' A' ' 927' ' ' HIS . 17.9 t70 -124.55 99.99 6.44 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.594 175.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -90.6 5.99 45.64 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.168 176.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 120.44 49.07 0.3 Allowed Glycine 0 CA--C 1.499 -0.942 0 C-N-CA 121.249 -0.5 . . . . 0.0 111.913 -178.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.442 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 16.8 m-70 -100.53 -153.12 0.44 Allowed 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 175.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.64 120.75 5.27 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 101.71 -3.441 . . . . 0.0 101.71 165.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.531 ' HG3' ' HE2' ' A' 1026 ' ' LYS . 0.5 OUTLIER -145.27 150.26 36.34 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 176.18 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.571 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.1 t80 -143.21 140.13 30.58 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 175.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 27.8 m -77.91 127.78 32.91 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.789 -0.764 . . . . 0.0 109.886 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -96.55 149.34 21.87 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 104.627 -2.361 . . . . 0.0 104.627 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -150.03 151.49 33.36 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 118.694 0.679 . . . . 0.0 110.721 -172.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.583 HG22 ' H ' ' A' ' 935' ' ' TYR . 9.8 p -147.8 -178.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 N-CA-C 105.026 -2.213 . . . . 0.0 105.026 176.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.583 ' H ' HG22 ' A' ' 934' ' ' VAL . 77.0 m-85 -141.13 151.12 43.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.678 ' O ' ' HA ' ' A' 1020 ' ' ARG . 32.6 tt0 -119.74 113.47 20.68 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 -174.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -105.0 147.13 28.13 Favored 'General case' 0 C--N 1.313 -1.012 0 O-C-N 123.679 0.612 . . . . 0.0 110.684 -176.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.639 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 41.7 mt-10 -142.88 159.43 42.24 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 170.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 939' ' ' SER . . . . . 0.675 ' HB3' ' CD2' ' A' 1018 ' ' HIS . 12.8 p -141.7 145.81 35.32 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' 1017 ' ' THR . 22.9 ptt180 -148.36 161.44 41.56 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 124.59 1.156 . . . . 0.0 107.949 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -67.28 158.21 82.61 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 172.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.96 88.95 0.07 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 121.656 1.571 . . . . 0.0 111.16 174.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 103.07 71.06 0.86 Allowed Glycine 0 N--CA 1.43 -1.712 0 N-CA-C 108.153 -1.979 . . . . 0.0 108.153 -175.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.04 -146.75 4.81 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.731 -174.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -129.79 132.23 46.46 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 124.475 1.11 . . . . 0.0 110.311 -176.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.639 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 40.9 m95 -76.13 151.91 36.86 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 121.792 0.806 . . . . 0.0 112.052 -173.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -143.79 153.13 57.36 Favored Pre-proline 0 C--N 1.307 -1.271 0 N-CA-C 103.807 -2.664 . . . . 0.0 103.807 176.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -49.2 126.26 15.14 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.667 2.244 . . . . 0.0 112.626 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -75.61 23.87 0.12 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -171.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 79.3 -61.03 0.34 Allowed 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.738 1.615 . . . . 0.0 109.196 177.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -100.88 73.74 1.58 Allowed 'General case' 0 N--CA 1.415 -2.199 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 25.4 m -63.1 -60.42 3.46 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.414 -173.097 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 953' ' ' TYR . . . . . 0.564 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 68.4 m-85 -93.49 123.28 36.69 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 119.661 -0.816 . . . . 0.0 111.265 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 15.6 p -142.66 173.88 11.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 113.962 -1.472 . . . . 0.0 110.702 -170.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 955' ' ' ASP . . . . . 0.475 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 13.0 t70 -92.42 170.07 10.06 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 104.854 -2.276 . . . . 0.0 104.854 170.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.99 -30.89 27.03 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 118.591 0.632 . . . . 0.0 111.526 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -91.44 8.44 36.32 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 89.35 -7.49 81.9 Favored Glycine 0 CA--C 1.503 -0.718 0 C-N-CA 120.14 -1.029 . . . . 0.0 114.033 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 959' ' ' ASP . . . . . 0.475 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 20.3 t70 -52.89 101.76 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 172.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -54.9 125.86 22.01 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.885 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -125.76 175.86 7.33 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.741 -177.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 962' ' ' ALA . . . . . 0.595 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -70.38 160.23 32.7 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 963' ' ' SER . . . . . 0.41 ' HB3' ' HD2' ' A' ' 964' ' ' PRO . 7.2 m -89.23 159.93 43.79 Favored Pre-proline 0 N--CA 1.427 -1.624 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.62 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.4 Cg_exo -47.66 -28.94 10.02 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.184 3.256 . . . . 0.0 116.771 -174.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 25.0 m -76.32 -43.17 42.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 119.041 0.837 . . . . 0.0 109.79 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 966' ' ' GLU . . . . . 0.595 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 35.5 mt-10 -64.9 -30.08 71.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.056 176.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.443 HD13 ' CH2' ' A' ' 980' ' ' TRP . 77.5 mt -72.34 114.42 10.44 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.909 176.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 41.6 p -121.34 170.33 9.72 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.622 -175.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 5.1 p -87.16 141.52 32.99 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 121.076 0.465 . . . . 0.0 111.356 178.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.595 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 27.8 Cg_endo -87.49 166.4 7.73 Favored 'Trans proline' 0 C--O 1.242 0.713 0 C-N-CA 122.437 2.092 . . . . 0.0 111.256 176.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.23 108.56 0.99 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 121.617 1.545 . . . . 0.0 110.292 173.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.688 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 115.53 5.67 18.45 Favored Glycine 0 N--CA 1.44 -1.057 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.874 -176.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.595 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 93.7 m95 -138.98 136.56 35.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 117.784 0.792 . . . . 0.0 111.937 178.005 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.511 ' HB3' ' O ' ' A' 1028 ' ' LYS . 4.8 tp10 -116.19 134.05 55.35 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 125.635 1.574 . . . . 0.0 107.706 -174.027 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.676 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 81.0 m95 -79.66 104.74 10.46 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 118.885 -1.126 . . . . 0.0 109.528 173.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -75.84 -42.61 49.16 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.83 143.0 55.98 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.74 -38.21 73.51 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -175.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.03 152.19 7.47 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 120.593 0.235 . . . . 0.0 110.392 -173.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.622 ' HA ' ' O ' ' A' 1024 ' ' VAL . 40.4 m95 -65.5 113.83 4.44 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 1.5 p -122.65 159.78 27.17 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -171.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 17.1 p90 -74.38 141.18 45.14 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 119.515 1.052 . . . . 0.0 111.205 -174.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.438 ' HB3' ' HB3' ' A' 1022 ' ' ARG . 7.8 t70 -81.56 120.8 25.51 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.701 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 12.6 pt -126.37 42.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -110.59 6.35 21.78 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 113.882 -1.508 . . . . 0.0 107.665 -172.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.513 ' HD3' ' NH1' ' A' 1022 ' ' ARG . 52.2 mtm180 -136.06 -176.25 4.25 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.534 -171.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.27 80.5 3.04 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.996 174.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.491 HG11 ' NH2' ' A' ' 986' ' ' ARG . 22.1 m -135.7 162.04 37.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.016 -174.591 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -56.13 173.48 0.16 Allowed 'General case' 0 N--CA 1.468 0.466 0 O-C-N 124.526 1.142 . . . . 0.0 111.207 172.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -53.28 -35.57 60.22 Favored 'General case' 0 CA--C 1.493 -1.246 0 C-N-CA 123.689 0.796 . . . . 0.0 111.671 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 991' ' ' LYS . . . . . 0.466 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 75.6 mmtt -106.46 12.91 29.13 Favored 'General case' 0 N--CA 1.417 -2.101 0 C-N-CA 118.878 -1.129 . . . . 0.0 111.805 -175.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 92.84 -11.46 72.05 Favored Glycine 0 CA--C 1.504 -0.648 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 174.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.509 ' CD2' ' HD2' ' A' 1019 ' ' ARG . 83.1 m95 -54.37 133.29 45.28 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 122.272 1.034 . . . . 0.0 111.848 177.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.706 ' HG2' ' O ' ' A' 1020 ' ' ARG . 5.5 pt-20 -117.82 152.04 36.14 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.579 -1.192 . . . . 0.0 109.864 -178.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.726 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 43.2 t80 -69.4 90.99 0.54 Allowed 'General case' 0 C--O 1.201 -1.451 0 CA-C-N 112.43 -2.168 . . . . 0.0 110.862 -175.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 996' ' ' GLY . . . . . 0.614 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -114.18 79.91 0.28 Allowed Glycine 0 N--CA 1.436 -1.361 0 C-N-CA 118.952 -1.594 . . . . 0.0 111.874 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 997' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -92.88 149.56 4.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 C-N-CA 117.123 -1.831 . . . . 0.0 108.355 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 36.9 m -124.71 98.02 5.54 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.758 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 22.2 pt -74.55 130.32 82.05 Favored Pre-proline 0 C--N 1.319 -0.728 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.479 176.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 55.3 Cg_endo -70.51 141.56 42.5 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.914 2.409 . . . . 0.0 113.071 -179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1001 ' ' PRO . . . . . 0.427 ' O ' ' HB2' ' A' 1002 ' ' ASP . 7.4 Cg_endo -91.29 149.84 18.27 Favored 'Cis proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.406 -1.497 . . . . 0.0 111.534 -2.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1002 ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' 1001 ' ' PRO . 2.6 t70 163.69 160.55 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.987 0 O-C-N 124.972 1.42 . . . . 0.0 107.509 -177.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 16.2 p80 -134.61 33.88 3.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.314 0.578 . . . . 0.0 109.7 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 88.3 mttt -158.82 123.54 2.22 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.807 -174.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.465 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 33.4 Cg_exo -71.51 133.11 21.75 Favored 'Trans proline' 0 C--O 1.239 0.543 0 C-N-CA 122.278 1.985 . . . . 0.0 110.476 168.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 54.2 mmtt -94.27 -49.61 5.64 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 10.3 t -92.08 148.94 21.79 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.243 -177.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.669 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 58.0 m95 -138.37 137.54 37.41 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 176.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.672 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 33.0 t -144.42 169.78 8.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -172.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1010 ' ' ALA . . . . . 0.419 ' N ' HG12 ' A' 1009 ' ' VAL . . . -79.65 -12.96 59.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -179.217 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -91.81 109.42 20.74 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -174.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.547 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 1.0 OUTLIER -81.85 105.11 12.71 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 172.88 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.508 ' H ' ' CE1' ' A' 1016 ' ' HIS . 61.3 mtpt -107.83 161.92 14.47 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.246 -1.343 . . . . 0.0 112.123 -176.25 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 57.0 ttp -55.15 -44.53 75.21 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.245 -0.889 . . . . 0.0 113.158 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -72.73 18.09 0.1 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.726 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.8 OUTLIER -67.24 114.48 6.0 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.668 172.258 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1017 ' ' THR . . . . . 0.447 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.0 OUTLIER -93.11 -25.27 17.96 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 122.8 1.286 . . . . 0.0 108.173 176.239 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1018 ' ' HIS . . . . . 0.675 ' CD2' ' HB3' ' A' ' 939' ' ' SER . 46.2 m80 -141.75 150.5 41.85 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.879 -1.509 . . . . 0.0 109.937 178.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1019 ' ' ARG . . . . . 0.509 ' HD2' ' CD2' ' A' ' 993' ' ' TRP . 31.2 ptt180 -141.94 148.84 39.31 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 171.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.706 ' O ' ' HG2' ' A' ' 994' ' ' GLU . 37.7 ttp180 -152.61 165.51 34.97 Favored 'General case' 0 C--N 1.283 -2.283 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 29.0 ptt180 -155.35 159.26 39.8 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 178.213 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.513 ' NH1' ' HD3' ' A' ' 986' ' ' ARG . 38.6 ttm180 -86.46 132.81 33.84 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 45.6 mt -102.35 129.34 48.77 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 104.663 -2.347 . . . . 0.0 104.663 166.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.622 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 20.1 m -109.64 141.92 23.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.495 -171.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.502 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.9 tpt180 -141.12 98.52 3.39 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 114.048 -1.433 . . . . 0.0 107.945 172.299 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.531 ' HE2' ' HG3' ' A' ' 929' ' ' GLU . 0.3 OUTLIER -71.62 134.76 46.59 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 -177.55 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.676 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.3 ptm180 -128.68 143.15 50.87 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -172.375 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.511 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.0 ttmt -137.89 139.28 39.76 Favored 'General case' 0 C--N 1.283 -2.307 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -172.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.688 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 32.4 ttmt -91.49 -17.52 25.57 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 123.737 1.732 . . . . 0.0 107.561 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1030 ' ' ASP . . . . . 0.442 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 21.5 t70 53.02 8.99 0.11 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 111.37 -2.65 . . . . 0.0 112.48 -169.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 22.9 tp 69.4 -33.46 0.25 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.207 1.803 . . . . 0.0 111.75 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1032 ' ' THR . . . . . 0.414 ' H ' ' C ' ' A' 1030 ' ' ASP . 12.6 t -79.03 -3.48 45.36 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -175.249 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -77.73 -24.95 48.98 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.84 -0.744 . . . . 0.0 111.012 177.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 8.8 t 175.77 148.83 0.1 Allowed 'General case' 0 C--O 1.238 0.471 0 O-C-N 123.939 0.775 . . . . 0.0 109.69 178.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -88.47 -61.0 1.81 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.536 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 7.1 m -141.88 16.57 2.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.744 0.307 . . . . 0.0 111.041 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 16.9 m -118.89 169.95 9.43 Favored 'General case' 0 C--N 1.319 -0.719 0 O-C-N 121.783 -0.573 . . . . 0.0 111.507 -175.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 11.4 p -96.17 139.35 32.46 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 174.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -84.44 9.3 13.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.696 0.76 . . . . 0.0 110.988 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 . . . . . 0 N--CA 1.441 -0.905 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.318 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 69.5 mt . . . . . 0 N--CA 1.469 0.495 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 919' ' ' ASP . . . . . 0.493 ' HA ' ' HB2' ' A' ' 923' ' ' ALA . 19.2 m-20 66.48 96.11 0.05 OUTLIER Pre-proline 0 N--CA 1.471 0.58 0 C-N-CA 123.984 0.914 . . . . 0.0 112.087 -177.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -63.88 -59.5 0.2 Allowed 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 121.894 1.729 . . . . 0.0 108.724 173.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -123.44 -53.76 1.79 Allowed 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 169.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 11.7 p -145.9 108.06 4.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.687 175.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 923' ' ' ALA . . . . . 0.493 ' HB2' ' HA ' ' A' ' 919' ' ' ASP . . . -85.64 -29.07 24.34 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -110.81 139.17 46.35 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.18 -1.373 . . . . 0.0 109.332 173.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -124.91 11.62 8.36 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.483 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 926' ' ' GLY . . . . . 0.428 ' O ' HD22 ' A' 1031 ' ' LEU . . . 121.14 44.45 0.4 Allowed Glycine 0 CA--C 1.492 -1.379 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.781 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.458 ' HA ' ' O ' ' A' 1030 ' ' ASP . 13.6 m-70 -115.29 -150.9 0.47 Allowed 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 172.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.15 108.99 1.94 Allowed 'General case' 0 N--CA 1.412 -2.35 0 N-CA-C 101.428 -3.545 . . . . 0.0 101.428 169.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.3 OUTLIER -137.39 144.57 42.52 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 178.233 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.497 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.8 t80 -137.39 138.06 39.48 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 105.888 -1.893 . . . . 0.0 105.888 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.632 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 26.9 m -74.08 129.98 38.9 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 176.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 932' ' ' ASP . . . . . 0.535 ' HB2' ' HD2' ' A' 1027 ' ' ARG . 4.6 t70 -102.34 156.26 17.7 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.528 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.0 pt-20 -150.53 153.64 36.16 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.155 0.502 . . . . 0.0 111.324 -172.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.524 ' O ' ' HA ' ' A' 1022 ' ' ARG . 9.4 p -146.53 179.01 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 N-CA-C 106.182 -1.784 . . . . 0.0 106.182 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.52 ' HA ' ' O ' ' A' 1021 ' ' ARG . 28.3 m-85 -144.07 113.95 7.25 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 119.653 1.115 . . . . 0.0 111.297 -174.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 936' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -81.36 132.78 35.35 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 123.57 0.544 . . . . 0.0 110.211 172.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 937' ' ' ASN . . . . . 0.481 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 27.6 m-80 -121.55 155.85 34.13 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 124.385 1.074 . . . . 0.0 113.116 -176.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.678 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 42.4 mt-10 -142.29 152.82 43.36 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 105.252 -2.129 . . . . 0.0 105.252 169.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 34.5 m -128.59 144.83 51.23 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 123.488 0.492 . . . . 0.0 111.018 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.493 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 20.7 ptt180 -149.92 161.75 41.68 Favored 'General case' 0 N--CA 1.433 -1.299 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -176.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -66.18 163.15 40.97 Favored Pre-proline 0 C--N 1.312 -1.023 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 172.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -66.64 90.41 0.28 Allowed 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 121.32 1.347 . . . . 0.0 111.271 177.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 97.15 72.19 1.09 Allowed Glycine 0 N--CA 1.434 -1.444 0 N-CA-C 107.88 -2.088 . . . . 0.0 107.88 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.67 -152.57 6.94 Favored Glycine 0 N--CA 1.44 -1.061 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.769 -174.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -108.38 136.29 48.27 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.377 -0.912 . . . . 0.0 109.54 -177.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.678 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 44.8 m95 -85.29 145.81 27.35 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-O 121.782 0.801 . . . . 0.0 109.486 -178.049 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -127.53 169.11 13.08 Favored Pre-proline 0 C--N 1.298 -1.665 0 N-CA-C 104.232 -2.507 . . . . 0.0 104.232 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -57.68 124.24 15.59 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 121.497 1.464 . . . . 0.0 109.599 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.04 10.7 0.05 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -174.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 79.4 -51.39 0.42 Allowed 'General case' 0 CA--C 1.481 -1.691 0 C-N-CA 124.533 1.133 . . . . 0.0 109.577 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -113.22 94.57 4.94 Favored 'General case' 0 N--CA 1.402 -2.84 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.1 m -72.89 -56.94 4.47 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.216 -173.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -94.92 122.4 37.53 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-O 122.164 0.983 . . . . 0.0 111.694 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 77.4 p -137.77 173.09 12.01 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.503 -173.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -95.85 172.63 7.9 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 171.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.96 -32.37 45.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 119.286 0.948 . . . . 0.0 110.843 174.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -80.39 -2.33 45.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.606 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 89.52 -9.12 78.23 Favored Glycine 0 CA--C 1.496 -1.108 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.843 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -51.8 103.44 0.06 Allowed 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 124.532 0.784 . . . . 0.0 110.733 175.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -51.86 121.91 7.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.444 -1.253 . . . . 0.0 108.472 177.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -123.32 -172.95 2.62 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.177 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -82.97 162.15 21.56 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 963' ' ' SER . . . . . 0.462 ' HB3' ' HD2' ' A' ' 964' ' ' PRO . 3.8 m -88.61 157.63 49.33 Favored Pre-proline 0 N--CA 1.43 -1.429 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.662 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 6.9 Cg_exo -43.03 -32.46 2.8 Favored 'Trans proline' 0 CA--C 1.542 0.884 1 C-N-CA 125.607 4.204 . . . . 0.0 117.901 -174.81 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 19.9 m -86.64 -35.25 19.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 122.194 0.997 . . . . 0.0 108.951 -176.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -72.96 -12.14 60.83 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.31 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 28.2 mt -89.35 110.36 21.17 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 21.1 p -114.25 -172.01 2.02 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.921 -174.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.588 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 15.4 p -114.96 129.49 25.01 Favored Pre-proline 0 C--N 1.317 -0.825 0 O-C-N 121.96 -0.463 . . . . 0.0 111.172 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.612 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 72.8 Cg_endo -70.69 169.82 19.19 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 123.213 2.609 . . . . 0.0 110.826 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -48.09 -33.56 21.28 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.887 2.391 . . . . 0.0 113.659 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.642 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -110.61 34.01 5.61 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-O 119.233 -0.76 . . . . 0.0 113.76 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.612 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 61.0 m95 -146.24 141.13 27.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.922 0.861 . . . . 0.0 110.878 169.192 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.6 ' HB3' ' O ' ' A' 1028 ' ' LYS . 7.5 tp10 -125.56 147.83 49.13 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 -176.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.467 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 63.6 m95 -75.91 143.54 41.62 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 122.237 1.018 . . . . 0.0 112.875 175.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 976' ' ' GLU . . . . . 0.623 ' HG2' ' HB3' ' A' 1028 ' ' LYS . 2.4 mm-40 -109.41 -44.38 3.91 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.564 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -91.51 159.13 16.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.137 -170.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.22 -52.81 60.73 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.067 0.947 . . . . 0.0 112.889 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -162.92 160.27 24.68 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 -173.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.662 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 23.8 m95 -75.38 116.8 16.48 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 20.8 m -125.15 159.91 30.37 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 -175.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -74.98 134.86 41.39 Favored 'General case' 0 C--N 1.298 -1.634 0 C-N-CA 119.34 -0.944 . . . . 0.0 110.629 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.513 ' HB2' HG13 ' A' 1024 ' ' VAL . 39.7 t0 -82.01 124.78 30.09 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.36 -176.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.0 pp -121.89 11.97 5.87 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 121.71 0.767 . . . . 0.0 110.516 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -87.54 23.26 1.97 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.396 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 986' ' ' ARG . 37.8 mtp-105 -146.47 -176.82 5.33 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.151 -174.112 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.38 83.72 7.39 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.49 HG12 ' HG2' ' A' ' 994' ' ' GLU . 27.6 m -135.37 160.49 40.22 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.745 -178.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -55.3 169.11 0.29 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.102 0.561 . . . . 0.0 110.006 169.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -59.62 -33.03 70.97 Favored 'General case' 0 CA--C 1.503 -0.842 0 O-C-N 122.012 -0.43 . . . . 0.0 111.64 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -95.36 4.15 53.68 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 119.851 -0.74 . . . . 0.0 111.046 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.07 -21.79 40.42 Favored Glycine 0 C--O 1.223 -0.571 0 CA-C-N 116.575 -0.284 . . . . 0.0 112.827 175.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.519 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 81.8 m95 -50.92 121.88 6.65 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.49 ' HG2' HG12 ' A' ' 988' ' ' VAL . 19.2 mt-10 -98.96 149.45 22.96 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.556 0.694 . . . . 0.0 110.185 177.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.688 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 55.5 t80 -76.5 87.06 3.22 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 126.304 1.842 . . . . 0.0 109.963 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 996' ' ' GLY . . . . . 0.614 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -112.86 91.44 0.59 Allowed Glycine 0 CA--C 1.485 -1.81 0 C-N-CA 119.966 -1.111 . . . . 0.0 110.359 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.557 HG22 ' HA ' ' A' 1016 ' ' HIS . 9.5 pt -104.48 151.14 7.07 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.521 -175.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.6 t -137.42 135.85 37.29 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 172.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 62.7 mt -117.44 106.21 47.05 Favored Pre-proline 0 C--N 1.313 -0.995 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 20.5 Cg_endo -61.94 137.74 69.29 Favored 'Trans proline' 0 C--O 1.241 0.634 0 C-N-CA 122.618 2.212 . . . . 0.0 112.873 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1001 ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 5.4 Cg_endo -82.9 141.85 44.76 Favored 'Cis proline' 0 N--CA 1.45 -1.06 0 C-N-CA 122.756 -1.768 . . . . 0.0 113.336 0.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 28.8 t70 -158.36 -98.62 0.03 OUTLIER 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 112.634 -2.076 . . . . 0.0 108.626 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 9.8 p80 164.08 -45.78 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.719 1.262 . . . . 0.0 113.189 175.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 52.9 mttp -164.86 141.58 4.91 Favored Pre-proline 0 CA--C 1.51 -0.579 0 N-CA-C 106.033 -1.839 . . . . 0.0 106.033 -169.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.42 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 68.1 Cg_exo -50.16 122.33 9.09 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 121.246 1.297 . . . . 0.0 111.409 173.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1006 ' ' LYS . . . . . 0.407 ' H ' ' HG2' ' A' 1006 ' ' LYS . 37.6 pttt -107.2 5.5 27.78 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.784 -175.267 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1007 ' ' SER . . . . . 0.458 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 44.7 t -141.63 138.47 32.57 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -176.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.637 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 49.1 m95 -135.39 135.55 40.73 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.569 ' HB ' ' HB3' ' A' ' 995' ' ' TYR . 81.6 t -143.27 166.37 14.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -172.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -88.63 10.05 21.97 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -122.18 130.97 53.7 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 119.091 0.859 . . . . 0.0 112.927 -175.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.582 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 19.1 tp10 -79.09 112.67 16.52 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 122.064 0.935 . . . . 0.0 108.876 175.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.484 ' H ' ' CE1' ' A' 1016 ' ' HIS . 45.0 mttp -125.11 158.91 32.7 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.929 -1.487 . . . . 0.0 110.7 -175.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 45.0 ttp -53.95 -43.74 70.1 Favored 'General case' 0 C--N 1.311 -1.094 0 O-C-N 124.241 0.963 . . . . 0.0 112.952 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -49.7 -11.19 0.05 Allowed 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 175.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.688 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 16.8 m80 -58.93 154.4 15.38 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.86 1.314 . . . . 0.0 112.007 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -160.31 -34.45 0.05 Allowed 'General case' 0 C--N 1.286 -2.161 0 CA-C-N 111.141 -2.754 . . . . 0.0 105.765 -168.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.97 153.0 46.76 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 113.097 -1.865 . . . . 0.0 108.311 174.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1019 ' ' ARG . . . . . 0.519 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 40.9 ptt180 -160.1 152.57 20.94 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 173.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.551 ' HG2' ' CZ3' ' A' 1008 ' ' TRP . 4.0 ptp180 -152.29 148.64 27.78 Favored 'General case' 0 CA--C 1.486 -1.492 0 C-N-CA 118.352 -1.339 . . . . 0.0 110.309 177.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.9 ptt180 -124.65 140.63 52.76 Favored 'General case' 0 C--N 1.293 -1.873 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.927 -177.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.528 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 38.7 ttm180 -81.07 123.12 28.12 Favored 'General case' 0 N--CA 1.422 -1.853 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.725 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 77.2 mt -95.8 127.01 41.46 Favored 'General case' 0 N--CA 1.422 -1.827 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 168.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.513 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.1 m -106.55 139.6 27.44 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.386 -174.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.531 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.7 tpt180 -143.19 101.4 3.8 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.186 -1.37 . . . . 0.0 107.845 171.166 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.632 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -71.44 147.46 47.84 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.214 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.535 ' HD2' ' HB2' ' A' ' 932' ' ' ASP . 12.1 ptm180 -140.91 151.46 44.27 Favored 'General case' 0 C--O 1.206 -1.213 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -172.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.827 ' HG2' ' H ' ' A' 1030 ' ' ASP . 30.4 ttmt -138.24 140.26 39.59 Favored 'General case' 0 C--O 1.197 -1.705 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 -174.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 29.3 ttmt -88.92 -4.47 58.45 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.844 0.831 . . . . 0.0 109.557 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1030 ' ' ASP . . . . . 0.827 ' H ' ' HG2' ' A' 1028 ' ' LYS . 2.1 t70 83.15 -68.6 0.06 Allowed 'General case' 0 CA--C 1.498 -1.055 0 CA-C-N 113.041 -1.891 . . . . 0.0 106.25 -173.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1031 ' ' LEU . . . . . 0.438 ' HB2' ' HA ' ' A' ' 927' ' ' HIS . 34.0 tp 149.9 -29.2 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.706 0 O-C-N 127.171 2.795 . . . . 0.0 108.584 173.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 25.6 p -114.67 14.08 17.5 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.675 0.75 . . . . 0.0 111.218 -170.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.528 ' HB2' ' O ' ' A' 1029 ' ' LYS . 29.5 tt0 -70.93 -30.59 66.95 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.278 -177.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 2.4 p -106.29 107.06 17.88 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 169.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -77.15 130.3 37.13 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -170.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1036 ' ' SER . . . . . 0.784 ' HB3' ' HA ' ' A' 1040 ' ' ARG . 39.0 m -85.5 86.53 7.36 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 107.516 -1.291 . . . . 0.0 107.516 172.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 14.5 t -96.29 -60.58 1.59 Allowed 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -175.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 29.5 p -99.87 -17.48 17.6 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 121.806 0.813 . . . . 0.0 109.623 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -114.26 -174.86 2.56 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 176.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1040 ' ' ARG . . . . . 0.784 ' HA ' ' HB3' ' A' 1036 ' ' SER . 75.3 ttt180 . . . . . 0 C--O 1.25 1.092 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.523 0 CA-C-O 121.809 0.814 . . . . 0.0 110.565 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 919' ' ' ASP . . . . . 0.44 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 2.7 m-20 -122.37 135.68 25.77 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.269 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 920' ' ' PRO . . . . . 0.486 ' HB2' ' HB2' ' A' ' 923' ' ' ALA . 35.3 Cg_exo -64.44 -31.24 61.84 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 122.836 2.357 . . . . 0.0 112.503 175.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 66.5 -74.62 0.06 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.614 1.165 . . . . 0.0 111.83 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 23.7 p -79.27 -48.36 14.27 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 923' ' ' ALA . . . . . 0.486 ' HB2' ' HB2' ' A' ' 920' ' ' PRO . . . 58.11 85.61 0.09 Allowed 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 124.656 1.223 . . . . 0.0 110.483 -177.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -73.79 33.96 0.08 Allowed 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 124.142 0.977 . . . . 0.0 112.507 -174.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -88.43 93.04 9.4 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 122.991 0.516 . . . . 0.0 111.324 -177.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 64.4 31.52 81.14 Favored Glycine 0 N--CA 1.453 -0.222 0 CA-C-N 115.721 -0.672 . . . . 0.0 114.724 175.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -136.3 142.34 43.89 Favored 'General case' 0 CA--C 1.487 -1.475 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 169.609 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.4 116.42 32.6 Favored 'General case' 0 N--CA 1.409 -2.495 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 163.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.717 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.5 OUTLIER -126.55 132.24 51.38 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 179.874 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.48 ' O ' ' HG2' ' A' 1027 ' ' ARG . 87.4 t80 -124.52 139.17 54.13 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 20.5 m -74.19 123.39 24.4 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -97.82 150.31 21.41 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 105.048 -2.205 . . . . 0.0 105.048 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.553 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 9.1 pt-20 -143.66 146.89 33.57 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 118.622 0.647 . . . . 0.0 110.899 -175.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.524 HG22 ' H ' ' A' ' 935' ' ' TYR . 11.2 p -135.45 174.72 12.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.58 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 59.5 m-85 -135.54 146.38 47.98 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 118.674 0.67 . . . . 0.0 110.54 -175.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.587 ' O ' ' HA ' ' A' 1020 ' ' ARG . 53.2 mt-30 -112.87 116.57 30.23 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 124.567 1.167 . . . . 0.0 108.072 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -101.95 137.64 39.96 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 121.957 0.884 . . . . 0.0 112.312 -177.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 948' ' ' PRO . 29.3 mt-10 -138.43 150.48 46.54 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 113.261 -1.791 . . . . 0.0 106.619 170.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 47.1 t -144.4 154.91 43.47 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.132 -169.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.516 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 36.6 ptt180 -141.83 157.38 45.08 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.319 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -75.91 172.94 8.03 Favored Pre-proline 0 C--N 1.305 -1.353 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -66.73 48.74 0.29 Allowed 'Trans proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.99 2.46 . . . . 0.0 112.259 171.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 943' ' ' GLY . . . . . 0.586 ' HA2' ' SD ' ' A' 1014 ' ' MET . . . 155.98 37.15 0.02 OUTLIER Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.537 -176.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 944' ' ' GLY . . . . . 0.516 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -132.62 -173.39 13.29 Favored Glycine 0 CA--C 1.499 -0.949 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -120.14 165.92 14.12 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 174.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.526 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 34.3 m95 -72.56 124.52 25.4 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-O 121.15 0.5 . . . . 0.0 110.306 -173.017 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -124.97 159.7 57.75 Favored Pre-proline 0 C--N 1.304 -1.388 0 N-CA-C 104.411 -2.44 . . . . 0.0 104.411 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.558 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 88.4 Cg_exo -49.08 138.85 27.42 Favored 'Trans proline' 0 CA--C 1.527 0.152 0 C-N-CA 122.226 1.951 . . . . 0.0 112.493 -178.131 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -76.78 -161.78 0.22 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.585 -178.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -95.84 -38.24 10.38 Favored 'General case' 0 CA--C 1.481 -1.679 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 951' ' ' ASP . . . . . 0.714 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 27.8 m-20 -116.45 100.71 8.06 Favored 'General case' 0 N--CA 1.404 -2.726 0 N-CA-C 104.588 -2.375 . . . . 0.0 104.588 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 7.4 m -60.03 -56.78 17.49 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 123.689 0.618 . . . . 0.0 111.421 -172.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 953' ' ' TYR . . . . . 0.58 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 92.8 m-85 -103.86 135.3 45.65 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-O 121.455 0.645 . . . . 0.0 111.56 -179.234 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 76.7 p -148.98 -176.05 5.19 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -174.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -106.19 -174.22 2.48 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 173.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.6 -31.05 34.46 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 175.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -77.72 -50.24 12.8 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.959 -0.463 . . . . 0.0 111.215 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 133.65 -3.02 4.6 Favored Glycine 0 CA--C 1.494 -1.28 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -177.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -58.35 107.3 0.47 Allowed 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.174 -1.013 . . . . 0.0 109.678 175.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 960' ' ' LYS . . . . . 0.714 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 26.2 tptp -47.16 112.69 0.56 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 113.709 -1.587 . . . . 0.0 110.12 175.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -112.68 178.7 4.2 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.279 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 962' ' ' ALA . . . . . 0.497 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -71.48 155.84 40.13 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 963' ' ' SER . . . . . 0.402 ' HB2' ' HD2' ' A' ' 964' ' ' PRO . 5.9 p -77.81 162.43 67.82 Favored Pre-proline 0 N--CA 1.434 -1.256 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.077 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.415 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 10.3 Cg_endo -58.61 -25.6 75.52 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.779 2.319 . . . . 0.0 112.559 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 1.2 m -68.35 -49.93 56.74 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 966' ' ' GLU . . . . . 0.497 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 47.4 mt-10 -64.66 -33.92 77.08 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.26 -1.336 . . . . 0.0 112.68 177.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.487 HD13 ' CH2' ' A' ' 980' ' ' TRP . 69.4 mt -67.29 112.16 4.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.811 0.815 . . . . 0.0 111.929 -178.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 21.7 p -117.4 171.19 8.15 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.286 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 19.2 p -87.1 138.54 32.57 Favored Pre-proline 0 C--N 1.319 -0.755 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.637 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.6 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 68.9 Cg_endo -82.88 163.61 15.87 Favored 'Trans proline' 0 C--O 1.243 0.734 0 C-N-CA 122.365 2.043 . . . . 0.0 111.083 178.276 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 971' ' ' PRO . . . . . 0.64 ' HA ' ' OG ' ' A' 1036 ' ' SER . 31.4 Cg_exo -61.82 102.98 0.26 Allowed 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 121.928 1.752 . . . . 0.0 110.15 173.033 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.483 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 127.21 -7.64 7.14 Favored Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.468 -0.873 . . . . 0.0 111.159 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.6 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.6 m95 -136.49 139.8 42.57 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.611 0.72 . . . . 0.0 111.105 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 974' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -123.66 136.9 54.75 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 126.26 1.824 . . . . 0.0 108.539 -173.276 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.632 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 91.3 m95 -84.6 158.73 20.79 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 119.436 1.016 . . . . 0.0 110.724 175.1 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -139.99 -36.78 0.49 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.09 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 977' ' ' ASP . . . . . 0.555 ' HB3' ' HD2' ' A' 1025 ' ' ARG . 9.9 t70 -67.43 150.52 48.8 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.372 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -68.32 -43.72 76.97 Favored 'General case' 0 C--N 1.314 -0.941 0 O-C-N 123.161 0.288 . . . . 0.0 111.577 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.07 159.27 12.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.749 0.309 . . . . 0.0 110.494 -172.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.541 ' HA ' ' O ' ' A' 1024 ' ' VAL . 17.1 m95 -76.43 91.45 3.31 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -177.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 18.5 t -103.45 162.11 13.3 Favored 'General case' 0 C--O 1.205 -1.254 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 982' ' ' TYR . . . . . 0.424 ' HA ' ' O ' ' A' 1022 ' ' ARG . 8.2 p90 -73.55 139.27 45.52 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 121.646 0.736 . . . . 0.0 111.801 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.466 ' HB2' HG13 ' A' 1024 ' ' VAL . 26.2 t70 -99.89 130.88 46.12 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.406 -175.251 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.466 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.4 pp -114.85 18.79 7.4 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.884 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.99 34.3 1.39 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -175.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.424 ' HB2' HG13 ' A' ' 988' ' ' VAL . 63.1 mtp180 -145.47 179.91 7.1 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -177.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -81.8 82.09 7.6 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 172.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.466 HG21 ' HA ' ' A' ' 984' ' ' ILE . 18.6 m -128.96 -170.79 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.794 -173.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -96.39 -172.23 2.48 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 105.265 -2.124 . . . . 0.0 105.265 -178.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -58.28 -33.42 69.41 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 122.94 0.496 . . . . 0.0 111.155 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -112.12 23.79 13.33 Favored 'General case' 0 N--CA 1.427 -1.601 0 C-N-CA 118.761 -1.176 . . . . 0.0 112.927 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 90.78 -11.91 70.38 Favored Glycine 0 C--O 1.229 -0.212 0 C-N-CA 120.112 -1.042 . . . . 0.0 112.899 173.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.59 ' HA ' ' HB3' ' A' 1021 ' ' ARG . 94.8 m95 -52.18 143.85 13.61 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 175.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.583 ' O ' ' HG3' ' A' 1019 ' ' ARG . 9.6 pt-20 -130.3 143.28 50.68 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 174.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.556 ' CD2' ' HA ' ' A' 1011 ' ' ALA . 1.4 t80 -104.54 115.96 31.25 Favored 'General case' 0 C--N 1.285 -2.226 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.894 -165.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 996' ' ' GLY . . . . . 0.447 ' HA2' ' O ' ' A' 1007 ' ' SER . . . -132.63 144.76 16.68 Favored Glycine 0 N--CA 1.435 -1.383 0 CA-C-O 122.016 0.787 . . . . 0.0 112.354 -177.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.684 ' HA ' ' HA ' ' A' 1016 ' ' HIS . 0.1 OUTLIER -93.24 173.66 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.502 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 998' ' ' THR . . . . . 0.405 ' HG1' ' HG3' ' A' 1005 ' ' PRO . 39.6 m -169.17 98.63 0.36 Allowed 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 104.995 -2.224 . . . . 0.0 104.995 178.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.448 ' O ' ' HB2' ' A' 1002 ' ' ASP . 68.0 mt -116.11 108.71 45.66 Favored Pre-proline 0 C--N 1.314 -0.969 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 -175.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.03 140.4 78.63 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 123.38 2.72 . . . . 0.0 113.609 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -76.17 150.28 93.33 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.029 -1.655 . . . . 0.0 111.295 -1.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1002 ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.5 t70 -172.15 -153.69 0.08 Allowed 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.14 -0.936 . . . . 0.0 108.899 -172.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.3 m170 -151.87 -82.48 0.09 Allowed 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.44 0.696 . . . . 0.0 110.351 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 80.6 mttt -128.84 154.4 80.05 Favored Pre-proline 0 C--N 1.309 -1.188 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 177.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.405 ' HG3' ' HG1' ' A' ' 998' ' ' THR . 52.4 Cg_exo -55.52 125.34 18.81 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 121.888 1.725 . . . . 0.0 111.305 174.087 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 20.4 pttp -100.06 4.51 44.72 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.313 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1007 ' ' SER . . . . . 0.447 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 48.5 t -142.89 122.99 13.65 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.217 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.488 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 66.8 m95 -122.89 133.15 54.42 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.36 1.464 . . . . 0.0 107.055 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.416 HG23 ' HB3' ' A' ' 995' ' ' TYR . 15.8 m -143.98 -164.98 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -178.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -91.64 -35.31 14.28 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 120.246 1.385 . . . . 0.0 110.045 174.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1011 ' ' ALA . . . . . 0.556 ' HA ' ' CD2' ' A' ' 995' ' ' TYR . . . 171.72 172.66 0.09 Allowed 'General case' 0 CA--C 1.508 -0.64 0 O-C-N 123.81 0.694 . . . . 0.0 111.962 -172.027 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' 1013 ' ' LYS . 10.9 pt-20 160.22 -61.93 0.0 OUTLIER 'General case' 0 C--N 1.345 0.4 0 O-C-N 126.691 2.494 . . . . 0.0 112.626 174.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.431 ' N ' ' HG3' ' A' 1012 ' ' GLU . 59.1 mttp -131.14 149.56 52.54 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -165.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1014 ' ' MET . . . . . 0.586 ' SD ' ' HA2' ' A' ' 943' ' ' GLY . 59.4 ttp -65.02 -23.96 67.36 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.738 -1.574 . . . . 0.0 112.63 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1015 ' ' TYR . . . . . 0.42 ' O ' HG22 ' A' ' 997' ' ' ILE . 60.2 m-85 -61.06 -6.94 2.18 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 175.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.684 ' HA ' ' HA ' ' A' ' 997' ' ' ILE . 46.9 m-70 -90.71 106.08 18.26 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.656 -2.35 . . . . 0.0 104.656 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 17.9 p -100.24 -6.45 26.0 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -169.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -129.45 142.5 50.77 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 122.062 -0.399 . . . . 0.0 110.826 -174.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1019 ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 994' ' ' GLU . 10.4 ttm180 -150.94 146.99 26.63 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 177.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.587 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 3.5 ptp180 -148.55 166.51 28.02 Favored 'General case' 0 C--O 1.199 -1.566 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 177.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.59 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 23.7 ptt180 -146.35 150.85 36.49 Favored 'General case' 0 C--N 1.287 -2.128 0 O-C-N 123.389 0.431 . . . . 0.0 110.005 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.553 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.4 ttm180 -88.91 129.57 35.59 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 123.487 0.492 . . . . 0.0 111.422 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.559 HD21 ' OE1' ' A' ' 936' ' ' GLN . 70.8 mt -104.98 137.71 42.32 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 105.217 -2.142 . . . . 0.0 105.217 165.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.541 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 12.8 m -113.16 141.24 29.52 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 CA-C-O 122.027 0.918 . . . . 0.0 111.958 -176.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.555 ' HD2' ' HB3' ' A' ' 977' ' ' ASP . 11.8 tpt180 -138.7 100.69 4.14 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 113.579 -1.646 . . . . 0.0 106.682 172.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -74.14 146.22 43.67 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -178.186 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.632 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 10.3 ptm180 -142.62 166.65 24.08 Favored 'General case' 0 CA--C 1.493 -1.234 0 N-CA-C 105.842 -1.91 . . . . 0.0 105.842 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.717 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 13.3 ptpt -156.13 155.8 33.16 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-O 121.033 0.445 . . . . 0.0 110.348 -178.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 29.3 ttmt -83.73 -21.65 32.21 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 22.0 t70 44.36 23.51 0.07 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 111.298 -2.683 . . . . 0.0 112.024 -171.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 23.0 tp 66.12 -39.42 0.32 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.097 2.159 . . . . 0.0 113.455 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 9.8 t -69.95 -22.58 63.16 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 123.132 0.573 . . . . 0.0 112.092 -176.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' 1029 ' ' LYS . 18.6 mt-30 -99.74 127.19 45.88 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 119.018 -1.073 . . . . 0.0 112.489 178.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 17.7 m -143.48 -23.11 0.6 Allowed 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.074 -1.421 . . . . 0.0 107.234 170.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -141.94 162.83 34.51 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 174.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1036 ' ' SER . . . . . 0.64 ' OG ' ' HA ' ' A' ' 971' ' ' PRO . 39.0 m -129.17 25.73 5.5 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.649 0.737 . . . . 0.0 110.416 -178.029 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 15.4 m -112.54 35.29 3.89 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -177.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 4.3 m -66.55 -38.78 87.83 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.345 -175.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -95.73 138.92 32.7 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.732 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 . . . . . 0 N--CA 1.443 -0.817 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.792 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.469 0.519 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -82.42 150.64 64.05 Favored Pre-proline 0 C--N 1.317 -0.814 0 CA-C-N 116.374 -0.376 . . . . 0.0 109.992 -176.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.65 111.25 2.08 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.112 2.541 . . . . 0.0 112.483 -177.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -80.52 -20.03 44.45 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.083 -1.417 . . . . 0.0 108.284 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 8.9 t -76.9 -8.73 57.89 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.684 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . 65.28 -74.45 0.05 Allowed 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.755 1.222 . . . . 0.0 111.649 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -87.52 100.39 12.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.396 0.617 . . . . 0.0 110.683 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -111.0 12.43 22.09 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.295 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 130.17 73.43 0.13 Allowed Glycine 0 N--CA 1.44 -1.049 0 N-CA-C 109.159 -1.577 . . . . 0.0 109.159 -174.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 16.6 m80 -158.9 -60.39 0.07 Allowed 'General case' 0 CA--C 1.488 -1.433 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -175.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 928' ' ' THR . . . . . 0.426 ' HB ' ' HE3' ' A' 1029 ' ' LYS . 1.5 m 63.34 87.58 0.11 Allowed 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 124.601 1.188 . . . . 0.0 107.843 -165.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.861 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.4 OUTLIER -102.75 168.19 9.4 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 179.652 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.632 ' O ' ' HG2' ' A' 1027 ' ' ARG . 89.5 t80 -153.98 120.86 5.62 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 10.2 m -79.23 121.64 25.31 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 174.029 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -103.51 146.12 29.01 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 104.944 -2.243 . . . . 0.0 104.944 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.456 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -145.42 147.91 32.74 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 118.331 0.514 . . . . 0.0 110.965 -173.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 4.6 p -151.88 134.02 5.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 120.981 0.42 . . . . 0.0 110.085 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' 1021 ' ' ARG . 94.9 m-85 -93.4 152.1 19.33 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -175.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.59 ' HG2' ' CE1' ' A' ' 953' ' ' TYR . 21.5 mt-30 -112.09 113.69 26.1 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 105.434 -2.062 . . . . 0.0 105.434 174.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 937' ' ' ASN . . . . . 0.469 ' HB3' ' HB2' ' A' ' 949' ' ' ALA . 12.2 m-80 -106.34 139.42 40.86 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -176.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.61 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 85.3 mt-10 -135.07 152.67 51.89 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 176.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 50.5 m -145.34 137.47 25.67 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.163 0.506 . . . . 0.0 111.596 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.549 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 18.3 ptt180 -139.82 161.63 37.11 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 124.446 1.098 . . . . 0.0 108.084 -174.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -65.29 161.56 48.61 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 170.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -66.21 86.73 0.25 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 121.458 1.439 . . . . 0.0 111.912 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 99.85 70.04 0.92 Allowed Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 107.728 -2.149 . . . . 0.0 107.728 -175.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -166.08 -148.04 5.41 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.57 -173.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -110.77 128.4 55.73 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 122.737 0.415 . . . . 0.0 110.984 -176.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.61 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 56.1 m95 -73.53 152.73 40.55 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-O 121.835 0.826 . . . . 0.0 109.695 176.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -133.57 169.18 14.62 Favored Pre-proline 0 C--N 1.3 -1.549 0 N-CA-C 103.452 -2.795 . . . . 0.0 103.452 171.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.2 124.4 16.16 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 N-CA-C 107.959 -1.593 . . . . 0.0 107.959 170.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 949' ' ' ALA . . . . . 0.469 ' HB2' ' HB3' ' A' ' 937' ' ' ASN . . . -37.68 -58.25 0.91 Allowed 'General case' 0 N--CA 1.483 1.215 0 O-C-N 124.877 1.361 . . . . 0.0 113.894 -171.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -168.29 -39.81 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 104.633 -2.358 . . . . 0.0 104.633 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -131.31 160.17 35.75 Favored 'General case' 0 N--CA 1.434 -1.259 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 168.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.0 m -93.65 -57.8 2.46 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 118.205 0.457 . . . . 0.0 110.391 -175.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 953' ' ' TYR . . . . . 0.59 ' CE1' ' HG2' ' A' ' 936' ' ' GLN . 58.3 m-85 -97.46 127.4 43.39 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 122.008 0.909 . . . . 0.0 110.729 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 954' ' ' THR . . . . . 0.495 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 1.1 p -144.0 167.14 23.08 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.31 -170.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -97.63 -173.68 2.7 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 956' ' ' ALA . . . . . 0.494 ' HA ' ' CE1' ' A' ' 935' ' ' TYR . . . -51.25 -27.18 8.54 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 957' ' ' ASN . . . . . 0.563 HD21 ' HB2' ' A' ' 959' ' ' ASP . 23.1 p-10 -92.78 -37.74 12.17 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.293 0.568 . . . . 0.0 111.518 178.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 958' ' ' GLY . . . . . 0.495 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 110.38 52.15 0.6 Allowed Glycine 0 CA--C 1.484 -1.864 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 -173.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 959' ' ' ASP . . . . . 0.563 ' HB2' HD21 ' A' ' 957' ' ' ASN . 17.7 t70 -121.07 106.38 11.51 Favored 'General case' 0 N--CA 1.419 -2.004 0 N-CA-C 100.977 -3.712 . . . . 0.0 100.977 176.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -44.21 123.89 3.67 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 124.926 1.391 . . . . 0.0 112.251 -176.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -121.93 -174.93 2.99 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 113.318 -1.764 . . . . 0.0 108.933 -175.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 962' ' ' ALA . . . . . 0.525 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -71.8 147.88 46.8 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 3.7 m -75.29 158.72 83.5 Favored Pre-proline 0 C--N 1.313 -1.018 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.6 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 29.2 Cg_exo -54.75 -21.49 25.66 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.916 2.411 . . . . 0.0 114.428 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 5.7 p -74.27 -49.44 23.15 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.78 0.8 . . . . 0.0 109.31 175.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 966' ' ' GLU . . . . . 0.525 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 32.6 mt-10 -65.36 -30.01 70.79 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.295 -1.32 . . . . 0.0 110.666 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' A' ' 964' ' ' PRO . 71.4 mt -67.49 111.74 4.29 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.284 0.634 . . . . 0.0 109.557 176.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.2 p -116.55 168.51 10.11 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -171.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.538 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 5.8 p -96.86 121.9 58.17 Favored Pre-proline 0 N--CA 1.44 -0.973 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.369 175.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.658 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 28.9 Cg_endo -82.8 175.56 8.56 Favored 'Trans proline' 0 C--O 1.242 0.686 0 C-N-CA 123.92 3.08 . . . . 0.0 111.198 178.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.86 111.05 0.85 Allowed 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 122.15 1.9 . . . . 0.0 111.645 176.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.627 ' HA3' HG23 ' A' 1034 ' ' THR . . . 108.69 -3.54 32.32 Favored Glycine 0 N--CA 1.431 -1.653 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.852 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.658 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 97.3 m95 -120.4 122.62 41.15 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 122.405 1.098 . . . . 0.0 112.688 -178.623 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.566 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 7.5 tp10 -108.18 123.18 48.34 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 126.953 2.101 . . . . 0.0 111.599 -172.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 24.0 m95 -78.95 105.84 10.55 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.699 172.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 976' ' ' GLU . . . . . 0.46 ' CD ' ' HE3' ' A' 1028 ' ' LYS . 38.9 mt-10 -73.4 -43.94 59.46 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 121.581 0.705 . . . . 0.0 109.663 175.083 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.02 146.18 54.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.466 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -76.62 -32.11 57.84 Favored 'General case' 0 C--N 1.318 -0.785 0 O-C-N 123.462 0.476 . . . . 0.0 110.84 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -163.43 157.23 19.62 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.655 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 27.1 m95 -72.93 113.22 9.72 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 177.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 18.8 m -120.45 150.36 40.93 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 -172.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 982' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' A' 1022 ' ' ARG . 0.3 OUTLIER -74.2 126.57 30.9 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.688 0.756 . . . . 0.0 110.727 -175.675 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -83.03 143.19 30.78 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-N 113.516 -1.675 . . . . 0.0 111.041 -167.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 15.6 pt -133.66 23.45 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.942 0.877 . . . . 0.0 109.38 176.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 985' ' ' ASN . . . . . 0.417 ' O ' ' HD3' ' A' ' 986' ' ' ARG . 63.9 t30 -96.12 13.94 25.55 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 178.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.417 ' HD3' ' O ' ' A' ' 985' ' ' ASN . 1.0 OUTLIER -134.02 177.46 7.72 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 114.243 -1.344 . . . . 0.0 107.414 -175.071 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -88.27 82.17 7.14 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.926 0.869 . . . . 0.0 109.471 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.504 HG12 ' HG2' ' A' ' 994' ' ' GLU . 15.4 m -138.49 164.64 26.29 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 114.147 -1.388 . . . . 0.0 109.373 -177.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -55.44 169.98 0.26 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.923 0.489 . . . . 0.0 110.494 171.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -58.61 -30.92 67.6 Favored 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 121.911 -0.493 . . . . 0.0 111.664 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 991' ' ' LYS . . . . . 0.507 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 48.1 mttm -98.67 9.86 42.37 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 119.414 -0.915 . . . . 0.0 110.868 178.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.69 -13.98 65.28 Favored Glycine 0 C--O 1.226 -0.357 0 CA-C-N 116.724 -0.217 . . . . 0.0 112.646 174.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.507 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 85.1 m95 -51.54 130.97 29.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.844 0.83 . . . . 0.0 112.718 178.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.504 ' HG2' HG12 ' A' ' 988' ' ' VAL . 29.5 mt-10 -107.96 155.79 19.93 Favored 'General case' 0 C--O 1.251 1.148 0 C-N-CA 124.042 0.937 . . . . 0.0 109.413 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.66 ' HB3' ' H ' ' A' 1009 ' ' VAL . 26.2 t80 -81.08 96.72 7.25 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 112.456 -2.156 . . . . 0.0 110.216 -177.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 996' ' ' GLY . . . . . 0.402 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -121.86 106.06 1.05 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 118.863 -1.637 . . . . 0.0 111.86 174.218 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.517 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -111.0 151.1 13.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 O-C-N 120.931 -1.335 . . . . 0.0 108.484 178.539 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 5.2 m -127.69 103.3 7.23 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 176.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 62.9 mt -80.64 123.42 82.61 Favored Pre-proline 0 C--N 1.318 -0.803 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.43 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 25.1 Cg_endo -61.84 142.16 92.52 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.462 2.108 . . . . 0.0 112.938 -178.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1001 ' ' PRO . . . . . 0.43 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 11.1 Cg_endo -96.87 145.96 6.24 Favored 'Cis proline' 0 N--CA 1.452 -0.938 0 C-N-CA 123.366 -1.514 . . . . 0.0 113.636 -2.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 6.6 t70 168.28 -179.54 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 104.435 -2.431 . . . . 0.0 104.435 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 6.2 p80 -132.37 -33.86 1.25 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 118.861 0.755 . . . . 0.0 112.074 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 79.3 mttt -112.8 132.51 22.25 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -177.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.42 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 52.1 Cg_exo -59.61 134.31 57.04 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 123.179 2.586 . . . . 0.0 109.99 168.14 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1006 ' ' LYS . . . . . 0.402 ' HE2' ' HB3' ' A' 1006 ' ' LYS . 12.6 ptpt -116.94 15.86 15.16 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 122.434 1.112 . . . . 0.0 109.196 -177.124 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 41.9 t -148.01 137.81 22.51 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 113.948 -1.478 . . . . 0.0 108.235 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.617 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 56.5 m95 -136.17 137.34 40.82 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.66 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 47.0 t -143.21 178.65 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 N-CA-C 104.183 -2.525 . . . . 0.0 104.183 -173.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1010 ' ' ALA . . . . . 0.51 ' H ' HG12 ' A' 1009 ' ' VAL . . . -99.83 4.34 45.16 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 120.072 1.305 . . . . 0.0 112.657 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -86.59 -168.29 2.18 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 121.736 -0.602 . . . . 0.0 112.294 -178.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.542 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.4 OUTLIER -159.39 106.8 1.75 Allowed 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.735 0.778 . . . . 0.0 108.954 -174.739 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.44 ' H ' ' CE1' ' A' 1016 ' ' HIS . 98.2 mttt -113.55 148.32 36.34 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.761 -178.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 51.7 ttp -47.67 -39.14 16.49 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 124.146 0.904 . . . . 0.0 112.158 176.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -61.37 -0.35 0.37 Allowed 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.542 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 2.9 m80 -61.83 118.95 7.86 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 178.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1017 ' ' THR . . . . . 0.536 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 25.4 p -104.79 -18.45 14.25 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.736 174.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 5.1 m80 -140.93 151.18 44.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.9 -177.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -156.94 151.88 26.0 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 170.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.453 ' HB3' ' OD1' ' A' ' 937' ' ' ASN . 6.1 ptp180 -151.26 163.84 37.96 Favored 'General case' 0 C--O 1.187 -2.199 0 C-N-CA 118.886 -1.126 . . . . 0.0 109.567 175.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.566 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 25.6 ptt180 -141.75 148.62 39.29 Favored 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.919 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.519 ' O ' ' HA ' ' A' ' 982' ' ' TYR . 41.3 ttm180 -90.42 122.11 32.99 Favored 'General case' 0 N--CA 1.44 -0.933 0 O-C-N 123.525 0.515 . . . . 0.0 111.684 -178.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.655 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 83.6 mt -91.58 129.59 37.53 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 106.009 -1.849 . . . . 0.0 106.009 166.159 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1024 ' ' VAL . . . . . . . . . . . . . 8.0 m -112.16 137.45 44.86 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 CA-C-O 122.219 1.009 . . . . 0.0 111.518 -177.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.464 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 6.3 tpt180 -137.06 101.32 4.52 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 113.1 -1.863 . . . . 0.0 108.278 171.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.493 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -82.1 148.9 28.3 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.632 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 11.5 ptm180 -144.07 179.24 7.33 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 104.915 -2.254 . . . . 0.0 104.915 -171.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.861 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 15.8 ptpt -162.17 160.71 27.45 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 175.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.544 ' HA ' ' O ' ' A' ' 972' ' ' GLY . 35.6 ttmt -87.81 -16.47 34.01 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-O 123.027 1.394 . . . . 0.0 107.758 -177.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 22.7 t70 55.46 16.56 1.85 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 112.019 -2.355 . . . . 0.0 110.661 -172.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 37.8 tp 62.51 -56.62 0.14 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.583 1.553 . . . . 0.0 112.26 -172.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 11.6 p -87.1 0.61 54.99 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 -172.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.566 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 47.6 mt-30 -76.04 -17.53 59.62 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 118.16 -1.416 . . . . 0.0 110.302 174.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1034 ' ' THR . . . . . 0.627 HG23 ' HA3' ' A' ' 972' ' ' GLY . 12.4 p -100.08 131.73 45.86 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 171.171 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -72.2 100.2 2.52 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 174.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 49.3 m -135.13 -31.31 1.0 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.168 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 10.1 m -79.33 108.63 12.99 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 5.1 p -91.7 158.19 16.52 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.054 -173.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -107.35 -31.66 8.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.308 -177.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1040 ' ' ARG . . . . . 0.558 ' NE ' ' HA ' ' A' 1040 ' ' ARG . 1.0 OUTLIER . . . . . 0 C--O 1.242 0.69 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.634 -178.256 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 35.9 pt . . . . . 0 N--CA 1.471 0.588 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 919' ' ' ASP . . . . . 0.772 ' HB2' ' HB ' ' A' ' 922' ' ' THR . 14.7 m-20 -140.54 151.86 64.77 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 -178.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -55.81 -55.15 3.2 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.978 2.452 . . . . 0.0 113.672 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -97.02 -26.65 14.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.037 0.446 . . . . 0.0 109.991 -176.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 922' ' ' THR . . . . . 0.772 ' HB ' ' HB2' ' A' ' 919' ' ' ASP . 4.2 m -90.22 35.33 0.86 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 122.079 0.942 . . . . 0.0 109.37 176.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -72.17 -34.14 68.24 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.107 176.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -109.12 125.09 51.79 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.702 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -110.74 15.32 21.99 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.781 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 117.26 59.0 0.3 Allowed Glycine 0 CA--C 1.498 -1.019 0 C-N-CA 120.329 -0.939 . . . . 0.0 111.795 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.482 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 42.2 m-70 -117.54 -138.11 0.36 Allowed 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 106.155 -1.795 . . . . 0.0 106.155 176.48 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -168.58 116.98 0.7 Allowed 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 169.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -137.58 129.77 29.21 Favored 'General case' 0 C--N 1.288 -2.07 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 174.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -121.55 138.12 54.44 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.59 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 31.3 m -77.84 122.34 25.32 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 175.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -96.56 175.02 6.55 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.68 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.6 pt-20 -168.83 143.72 3.24 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.497 0.665 . . . . 0.0 110.958 -171.149 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.595 HG22 ' H ' ' A' ' 935' ' ' TYR . 13.0 p -135.47 -177.61 2.08 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 173.243 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.595 ' H ' HG22 ' A' ' 934' ' ' VAL . 87.3 m-85 -137.27 146.18 44.42 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 118.862 0.755 . . . . 0.0 109.09 -178.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' A' 1020 ' ' ARG . 30.9 tt0 -116.81 118.05 31.42 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 -179.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 -109.18 142.33 40.13 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-O 122.141 0.972 . . . . 0.0 111.536 -175.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.561 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 62.0 mt-10 -128.95 162.57 27.26 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 170.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 38.1 m -146.89 152.75 39.2 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.978 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.444 ' O ' ' HA ' ' A' 1017 ' ' THR . 25.9 ptt180 -149.45 159.84 43.95 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 114.947 -1.024 . . . . 0.0 108.876 177.296 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -75.82 161.71 74.82 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 170.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 942' ' ' PRO . . . . . 0.404 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 23.0 Cg_exo -66.42 92.91 0.29 Allowed 'Trans proline' 0 N--CA 1.458 -0.586 0 N-CA-C 109.169 -1.127 . . . . 0.0 109.169 171.359 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 119.68 11.03 7.38 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -172.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 944' ' ' GLY . . . . . 0.408 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -109.45 -174.07 21.01 Favored Glycine 0 CA--C 1.498 -0.988 0 N-CA-C 108.203 -1.959 . . . . 0.0 108.203 176.078 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -120.97 159.26 25.97 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 105.561 -2.014 . . . . 0.0 105.561 170.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.561 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 43.0 m95 -71.07 125.96 28.29 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-O 121.428 0.633 . . . . 0.0 111.374 -172.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -114.9 172.54 3.53 Favored Pre-proline 0 C--N 1.299 -1.607 0 N-CA-C 102.634 -3.099 . . . . 0.0 102.634 170.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -54.73 147.66 49.01 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 CA-C-N 121.649 1.624 . . . . 0.0 111.848 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -69.35 -170.06 0.25 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.777 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.47 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.0 OUTLIER -98.21 -29.01 13.45 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 -179.221 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -120.53 88.15 2.88 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 103.765 -2.68 . . . . 0.0 103.765 173.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 20.5 m -62.03 -51.97 65.87 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.004 -172.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 953' ' ' TYR . . . . . 0.47 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 79.8 m-85 -103.31 133.9 47.61 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 119.551 -0.86 . . . . 0.0 111.097 177.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 72.7 p -142.91 174.77 10.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.48 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -109.81 -173.48 2.27 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.84 -36.19 36.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 114.044 1.128 . . . . 0.0 114.044 -174.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -101.34 11.13 39.79 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 92.78 0.18 69.31 Favored Glycine 0 CA--C 1.497 -1.042 0 C-N-CA 119.53 -1.319 . . . . 0.0 111.578 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -56.82 104.11 0.14 Allowed 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 174.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 960' ' ' LYS . . . . . 0.473 ' HD3' ' C ' ' A' ' 960' ' ' LYS . 7.8 tmtm? -49.52 118.5 2.8 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 124.158 0.911 . . . . 0.0 108.887 176.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -121.71 176.0 5.95 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.13 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -66.32 149.9 49.68 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 123.638 0.586 . . . . 0.0 110.661 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 15.6 m -85.38 156.73 59.44 Favored Pre-proline 0 N--CA 1.437 -1.119 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.511 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.3 Cg_exo -48.16 -32.81 19.85 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.397 3.398 . . . . 0.0 116.636 -173.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.6 p -75.81 -45.33 36.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.461 1.124 . . . . 0.0 109.437 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -65.2 -27.26 68.56 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.037 -1.892 . . . . 0.0 110.585 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.476 HD13 ' CH2' ' A' ' 980' ' ' TRP . 33.1 mt -71.49 120.6 17.31 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.061 0.944 . . . . 0.0 110.371 175.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 26.1 p -125.07 170.94 10.68 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.979 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 6.6 p -82.87 148.53 57.52 Favored Pre-proline 0 C--N 1.315 -0.925 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.998 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.581 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 20.0 Cg_endo -91.6 165.75 3.42 Favored 'Trans proline' 0 C--O 1.239 0.568 0 C-N-CA 123.004 2.469 . . . . 0.0 111.267 174.082 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.11 108.33 1.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 121.709 1.606 . . . . 0.0 110.579 174.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.616 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 118.93 1.71 14.45 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 120.908 -0.663 . . . . 0.0 111.859 -177.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.581 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 90.1 m95 -137.43 137.54 38.87 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 122.2 1.0 . . . . 0.0 111.161 177.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.594 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 9.4 tp10 -118.23 143.23 46.71 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.155 -1.839 . . . . 0.0 106.115 -174.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.523 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 98.7 m95 -83.53 153.77 24.2 Favored 'General case' 0 C--N 1.296 -1.736 0 O-C-N 120.693 -1.255 . . . . 0.0 110.418 171.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -121.55 -42.2 2.45 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 977' ' ' ASP . . . . . 0.756 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 1.6 m-20 -77.05 155.83 32.22 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.432 178.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -75.81 -56.72 4.41 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -171.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -156.54 147.88 22.37 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -175.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.511 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 17.6 m95 -61.39 120.43 10.45 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 124.167 0.917 . . . . 0.0 109.295 -172.135 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 981' ' ' SER . . . . . 0.648 ' O ' ' HA ' ' A' 1023 ' ' LEU . 42.4 m -111.63 -166.69 1.1 Allowed 'General case' 0 C--O 1.201 -1.45 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 17.6 p90 -109.82 154.34 23.13 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 119.825 1.193 . . . . 0.0 112.208 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' 1022 ' ' ARG . 9.0 t70 -99.89 131.57 45.78 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.672 -171.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 30.8 pt -119.87 28.32 3.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 122.209 1.004 . . . . 0.0 109.011 173.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -106.4 24.35 12.69 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 123.012 1.387 . . . . 0.0 108.963 -175.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.401 HH21 ' CD ' ' A' ' 994' ' ' GLU . 38.5 mtp85 -139.5 -177.61 5.02 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -83.93 80.76 9.05 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 172.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.904 HG12 ' HG2' ' A' ' 994' ' ' GLU . 29.2 m -135.97 156.14 36.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.352 -170.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.37 170.14 0.16 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.956 170.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -52.62 -34.18 49.93 Favored 'General case' 0 CA--C 1.498 -1.02 0 C-N-CA 123.479 0.711 . . . . 0.0 111.239 176.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 991' ' ' LYS . . . . . 0.445 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 84.5 mttt -98.35 2.97 48.54 Favored 'General case' 0 N--CA 1.422 -1.842 0 CA-C-N 114.924 -1.035 . . . . 0.0 111.947 -176.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 100.67 -16.08 57.94 Favored Glycine 0 C--O 1.223 -0.576 0 C-N-CA 121.27 -0.49 . . . . 0.0 111.888 178.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.738 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 71.3 m95 -55.8 116.61 3.04 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.904 ' HG2' HG12 ' A' ' 988' ' ' VAL . 5.0 mt-10 -99.76 155.44 17.64 Favored 'General case' 0 C--O 1.257 1.451 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.432 176.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.521 ' HD2' ' HB3' ' A' 1011 ' ' ALA . 21.9 t80 -69.47 102.67 1.85 Allowed 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 129.015 2.926 . . . . 0.0 110.829 -178.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -124.13 122.41 4.8 Favored Glycine 0 CA--C 1.503 -0.659 0 C-N-CA 119.33 -1.414 . . . . 0.0 111.876 172.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.973 ' HB ' ' HD2' ' A' 1016 ' ' HIS . 1.3 tt -133.24 139.57 48.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 O-C-N 121.663 -0.904 . . . . 0.0 109.291 -179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 35.0 m -132.61 116.81 17.13 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.405 ' HA ' ' HD2' ' A' 1000 ' ' PRO . 12.2 pt -114.18 97.38 45.39 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-O 121.188 0.518 . . . . 0.0 111.891 -175.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 999' ' ' ILE . 18.7 Cg_endo -58.88 132.98 50.77 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.632 2.888 . . . . 0.0 114.415 -175.11 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -79.59 146.02 75.26 Favored 'Cis proline' 0 N--CA 1.454 -0.835 0 C-N-CA 122.743 -1.774 . . . . 0.0 112.015 -0.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 6.2 t70 -153.53 -159.91 1.05 Allowed 'General case' 0 C--N 1.293 -1.878 0 CA-C-N 113.873 -1.512 . . . . 0.0 107.91 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 14.8 p80 -138.0 -57.67 0.66 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.248 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 63.0 mttp -165.26 155.69 12.09 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 102.837 -3.023 . . . . 0.0 102.837 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -60.53 122.0 10.61 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 CA-C-N 121.758 1.664 . . . . 0.0 109.244 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 46.7 pttt -83.78 -7.51 59.45 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.566 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 9.6 t -144.01 135.22 25.62 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -174.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.597 ' HE3' ' HB2' ' A' ' 994' ' ' GLU . 42.6 m95 -134.24 135.39 42.91 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 125.436 1.71 . . . . 0.0 106.405 175.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.51 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 2.6 m -162.9 -174.01 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 -174.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -97.4 104.74 16.78 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1011 ' ' ALA . . . . . 0.521 ' HB3' ' HD2' ' A' ' 995' ' ' TYR . . . -178.25 -176.96 0.55 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -175.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.517 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.2 OUTLIER -174.63 118.03 0.2 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.805 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 46.9 mttp -132.37 153.4 50.81 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.421 -172.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 23.0 ttt -53.03 -44.03 67.03 Favored 'General case' 0 C--N 1.315 -0.918 0 O-C-N 124.607 1.192 . . . . 0.0 113.38 -177.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1015 ' ' TYR . . . . . 0.404 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 54.0 m-85 -68.47 9.63 0.33 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.973 ' HD2' ' HB ' ' A' ' 997' ' ' ILE . 22.0 m170 -69.72 175.65 4.1 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.908 0.861 . . . . 0.0 112.233 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1017 ' ' THR . . . . . 0.444 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 1.1 m -155.75 -42.0 0.08 Allowed 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 -169.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -132.02 144.31 50.68 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.49 -174.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1019 ' ' ARG . . . . . 0.738 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 42.7 ttp180 -151.92 146.09 25.36 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 5.5 ptp180 -156.15 165.48 36.28 Favored 'General case' 0 C--O 1.198 -1.627 0 C-N-CA 117.575 -1.65 . . . . 0.0 110.824 178.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.582 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 29.4 ptt180 -144.38 151.36 39.17 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.792 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.68 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 36.2 ttm180 -83.7 129.76 34.95 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.648 ' HA ' ' O ' ' A' ' 981' ' ' SER . 72.9 mt -98.95 128.22 45.05 Favored 'General case' 0 N--CA 1.414 -2.275 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 167.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.522 HG13 ' HB2' ' A' ' 983' ' ' ASP . 1.4 m -104.76 145.1 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.828 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.503 -171.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.756 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -156.22 114.08 3.29 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 124.999 1.437 . . . . 0.0 111.299 168.001 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.8 tmmm? -82.09 144.83 30.52 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 -176.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.523 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 6.3 ptm180 -135.79 137.89 42.04 Favored 'General case' 0 C--O 1.209 -1.036 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 -172.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.562 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 30.2 ttmt -123.08 137.85 54.82 Favored 'General case' 0 C--N 1.284 -2.258 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.012 -171.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.639 ' C ' ' H ' ' A' 1031 ' ' LEU . 36.8 ttmt -89.1 -21.14 23.53 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-O 123.228 1.49 . . . . 0.0 108.26 -177.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 21.5 t70 66.67 -22.91 0.1 Allowed 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 111.927 -2.397 . . . . 0.0 112.28 -169.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1031 ' ' LEU . . . . . 0.639 ' H ' ' C ' ' A' 1029 ' ' LYS . 27.6 tp 88.46 -25.34 0.08 Allowed 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 129.029 2.932 . . . . 0.0 110.899 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 34.4 p -74.77 -16.35 60.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.307 0.575 . . . . 0.0 111.363 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.594 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 98.0 mt-30 -78.92 -7.57 58.11 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.459 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1034 ' ' THR . . . . . 0.433 HG21 ' HD3' ' A' 1029 ' ' LYS . 24.6 p -122.74 110.56 15.64 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.243 178.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -74.53 110.18 8.61 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 176.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 17.4 t -88.19 -18.58 28.39 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.378 0.609 . . . . 0.0 109.579 -177.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 36.8 t -104.58 150.15 24.89 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.405 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 11.7 t -107.85 -1.83 20.45 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -87.33 117.22 25.95 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.398 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 . . . . . 0 C--N 1.313 -1.0 0 CA-C-O 117.899 -1.048 . . . . 0.0 109.393 179.621 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 2.7 pp . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 919' ' ' ASP . . . . . 0.48 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 16.1 t70 -73.98 123.47 89.3 Favored Pre-proline 0 C--O 1.236 0.389 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 174.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 920' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 16.7 Cg_exo -68.99 123.31 10.22 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 123.099 2.533 . . . . 0.0 113.654 -174.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -85.77 -11.1 54.38 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 113.725 -1.579 . . . . 0.0 109.277 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 34.1 m -149.13 100.85 3.09 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.323 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -109.67 93.4 4.48 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 106.058 -1.83 . . . . 0.0 106.058 174.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 924' ' ' ASP . . . . . 0.522 ' HA ' ' CD2' ' A' ' 927' ' ' HIS . 23.5 t70 -104.71 116.7 32.49 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -169.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -111.75 17.21 20.07 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.581 173.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 109.58 66.18 0.56 Allowed Glycine 0 N--CA 1.437 -1.237 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 -177.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.522 ' CD2' ' HA ' ' A' ' 924' ' ' ASP . 56.9 m-70 -107.75 -147.92 0.41 Allowed 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 175.53 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.6 m -161.2 124.43 3.25 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 102.804 -3.035 . . . . 0.0 102.804 168.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.473 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.4 OUTLIER -153.25 145.96 24.29 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 178.639 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -141.14 143.7 34.42 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.637 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 25.7 m -74.15 125.71 28.97 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 177.471 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -101.36 156.78 17.25 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 105.085 -2.191 . . . . 0.0 105.085 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.475 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.0 pt-20 -147.77 152.48 37.79 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.448 -174.165 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.499 HG11 ' HG3' ' A' ' 964' ' ' PRO . 12.2 p -141.95 174.76 5.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.503 ' HA ' ' O ' ' A' 1021 ' ' ARG . 68.6 m-85 -135.61 150.39 49.65 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.524 ' O ' ' HA ' ' A' 1020 ' ' ARG . 36.8 tt0 -126.18 127.53 45.85 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -178.314 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 937' ' ' ASN . . . . . 0.96 ' HB3' ' HG2' ' A' 1020 ' ' ARG . 20.5 p-10 -137.92 152.23 48.78 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.642 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 46.3 mt-10 -135.22 161.05 36.48 Favored 'General case' 0 C--O 1.245 0.834 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 178.065 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 939' ' ' SER . . . . . 0.495 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 17.9 p -133.36 147.92 51.83 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.143 0.497 . . . . 0.0 111.336 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.474 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 21.6 ptt180 -149.02 161.44 41.91 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.81 158.38 69.69 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 171.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 942' ' ' PRO . . . . . 0.456 ' HG3' HG22 ' A' 1017 ' ' THR . 24.5 Cg_exo -62.78 92.32 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 121.345 1.363 . . . . 0.0 110.259 174.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 97.0 70.58 1.03 Allowed Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 108.974 -1.65 . . . . 0.0 108.974 -176.058 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -160.5 -131.24 1.2 Allowed Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.102 -175.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -137.42 131.07 31.45 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.547 -0.827 . . . . 0.0 111.047 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.642 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 36.1 m95 -78.92 149.98 32.22 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-O 121.512 0.672 . . . . 0.0 110.485 -177.062 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -137.84 166.06 29.07 Favored Pre-proline 0 C--N 1.305 -1.352 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 171.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -49.31 127.95 19.04 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 CA-C-N 121.262 1.486 . . . . 0.0 110.285 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 949' ' ' ALA . . . . . 0.495 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -47.78 -51.7 21.46 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 124.725 1.266 . . . . 0.0 111.613 -174.61 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 163.33 -35.37 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 178.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 951' ' ' ASP . . . . . 0.433 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 15.6 m-20 -132.13 102.27 5.73 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 174.329 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 952' ' ' THR . . . . . 0.437 ' O ' ' HA ' ' A' ' 936' ' ' GLN . 24.1 m -68.96 -46.2 68.76 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -172.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 953' ' ' TYR . . . . . 0.419 ' CE1' ' HB2' ' A' ' 936' ' ' GLN . 59.7 m-85 -104.79 130.57 52.87 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.874 0.845 . . . . 0.0 110.591 175.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 5.0 p -145.02 173.09 12.19 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.264 -1.334 . . . . 0.0 111.017 -166.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 955' ' ' ASP . . . . . 0.509 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 11.3 t70 -97.72 170.74 8.79 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 175.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.49 -27.95 7.52 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 119.548 1.067 . . . . 0.0 113.67 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -95.39 2.19 54.5 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 98.07 -3.87 60.5 Favored Glycine 0 CA--C 1.497 -1.049 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.845 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 959' ' ' ASP . . . . . 0.509 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 38.6 t70 -51.74 108.41 0.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 O-C-N 124.388 0.699 . . . . 0.0 110.308 176.369 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 960' ' ' LYS . . . . . 0.433 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 51.8 tptt -47.14 111.1 0.36 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.537 1.148 . . . . 0.0 109.076 172.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -120.96 -179.91 4.17 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.604 -174.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -74.75 146.63 42.01 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 13.6 m -76.16 156.82 83.73 Favored Pre-proline 0 C--N 1.313 -1.011 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.567 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 53.1 Cg_exo -50.91 -25.13 15.14 Favored 'Trans proline' 0 N--CA 1.487 1.101 0 C-N-CA 123.537 2.825 . . . . 0.0 115.407 -177.292 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 9.3 p -71.3 -49.47 42.46 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.861 0.839 . . . . 0.0 108.993 176.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -66.2 -28.15 68.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.699 175.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.479 HD12 ' HA ' ' A' ' 964' ' ' PRO . 67.7 mt -66.46 110.72 3.24 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 10.6 p -126.27 -179.95 4.98 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.891 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.678 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 24.0 p -94.65 124.92 53.44 Favored Pre-proline 0 C--N 1.308 -1.239 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.689 178.508 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.626 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 80.3 Cg_endo -78.53 162.84 27.38 Favored 'Trans proline' 0 C--N 1.336 -0.118 0 C-N-CA 123.197 2.598 . . . . 0.0 110.461 178.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -59.45 100.91 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 121.66 1.574 . . . . 0.0 110.942 174.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.654 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 127.34 -3.57 7.2 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -176.129 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.678 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 94.7 m95 -141.21 145.98 36.33 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 122.68 0.392 . . . . 0.0 110.307 177.044 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.57 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 5.5 tp10 -131.69 157.57 43.41 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 126.004 1.722 . . . . 0.0 106.41 -175.248 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.644 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 98.4 m95 -90.34 148.05 23.09 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 120.468 -1.395 . . . . 0.0 112.691 170.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -113.2 -43.82 3.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 178.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 977' ' ' ASP . . . . . 0.474 ' HB3' ' NE ' ' A' 1025 ' ' ARG . 69.4 m-20 -78.22 161.19 27.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.788 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -84.18 -57.48 3.16 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 115.186 1.551 . . . . 0.0 115.186 -176.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -155.77 142.69 18.99 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 121.408 -0.808 . . . . 0.0 110.404 -170.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.567 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 15.4 m95 -66.84 130.49 43.33 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.118 0.485 . . . . 0.0 109.97 -173.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 981' ' ' SER . . . . . 0.443 ' O ' ' HA ' ' A' 1023 ' ' LEU . 62.3 m -128.67 166.39 19.01 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 -179.084 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 20.4 p90 -74.41 142.55 44.98 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -178.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.526 ' HB2' HG13 ' A' 1024 ' ' VAL . 31.9 t0 -97.96 122.03 40.6 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.024 -177.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.2 pp -114.46 22.66 5.65 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.385 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -97.98 27.44 4.52 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.526 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 50.6 mtp180 -141.78 -177.16 5.06 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 -173.336 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.31 84.89 6.97 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 16.8 m -141.1 157.21 22.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.477 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -53.06 169.45 0.1 Allowed 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.773 172.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -55.33 -34.17 63.98 Favored 'General case' 0 CA--C 1.507 -0.675 0 C-N-CA 123.061 0.544 . . . . 0.0 112.439 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -98.68 11.85 37.26 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.418 0.628 . . . . 0.0 110.008 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 69.85 81.27 0.24 Allowed Glycine 0 N--CA 1.431 -1.654 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.243 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.509 ' CE3' ' HD2' ' A' 1019 ' ' ARG . 99.5 m95 -148.13 131.53 16.63 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.687 ' HG2' ' O ' ' A' 1020 ' ' ARG . 6.4 pt-20 -108.02 150.88 26.58 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-O 121.611 0.719 . . . . 0.0 112.493 -177.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.693 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -74.67 94.63 2.72 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 112.556 -2.111 . . . . 0.0 111.329 -173.339 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -110.88 101.37 1.34 Allowed Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 120.33 -0.938 . . . . 0.0 111.272 177.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.492 HD12 ' HB3' ' A' 1015 ' ' TYR . 0.7 OUTLIER -110.19 133.19 56.34 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.055 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.792 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 8.7 m -118.61 97.05 5.54 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 120.608 0.242 . . . . 0.0 110.357 -177.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.444 ' O ' HD12 ' A' ' 999' ' ' ILE . 2.4 pp -81.41 133.59 53.01 Favored Pre-proline 0 C--N 1.319 -0.724 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.764 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 51.5 Cg_endo -70.55 143.36 46.8 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.825 2.35 . . . . 0.0 113.736 -175.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1001 ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 9.3 Cg_endo -93.7 143.86 9.01 Favored 'Cis proline' 0 N--CA 1.451 -1.009 0 C-N-CA 123.057 -1.643 . . . . 0.0 112.198 -3.01 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 2.7 t70 170.0 167.28 0.06 Allowed 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 113.342 -1.754 . . . . 0.0 107.718 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 13.9 p-80 -142.24 33.49 1.51 Allowed 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.845 0.355 . . . . 0.0 110.148 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -163.5 124.74 1.5 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.426 -175.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.562 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 51.5 Cg_exo -63.79 126.29 17.13 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 121.525 1.484 . . . . 0.0 109.445 166.525 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 55.2 pttt -107.21 7.71 29.58 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.949 0.88 . . . . 0.0 109.188 -178.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.0 t -144.28 138.03 27.65 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.421 -1.263 . . . . 0.0 108.651 -177.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.593 ' CE3' ' HG3' ' A' ' 994' ' ' GLU . 66.9 m95 -133.72 140.24 46.88 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 98.4 t -139.34 152.86 23.65 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -78.86 100.32 7.13 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 175.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1011 ' ' ALA . . . . . 0.563 ' HB3' ' HD2' ' A' ' 995' ' ' TYR . . . 177.19 -174.2 0.12 Allowed 'General case' 0 C--O 1.235 0.293 0 O-C-N 123.876 0.735 . . . . 0.0 110.588 -171.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.696 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.3 OUTLIER -172.34 104.52 0.17 Allowed 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 106.491 -1.67 . . . . 0.0 106.491 177.61 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.479 ' H ' ' CE1' ' A' 1016 ' ' HIS . 21.9 mttp -141.66 166.93 23.39 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 112.852 -1.976 . . . . 0.0 110.283 -170.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 55.6 ttp -49.95 -47.34 52.62 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -173.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1015 ' ' TYR . . . . . 0.492 ' HB3' HD12 ' A' ' 997' ' ' ILE . 33.2 m-85 -62.25 -0.89 0.61 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.696 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 15.3 m80 -59.28 111.05 1.22 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 118.55 0.613 . . . . 0.0 112.229 175.388 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1017 ' ' THR . . . . . 0.456 HG22 ' HG3' ' A' ' 942' ' ' PRO . 42.1 p -96.32 -28.63 14.4 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 123.478 1.609 . . . . 0.0 107.525 174.215 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 7.2 m170 -139.3 156.26 47.16 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 112.658 -2.064 . . . . 0.0 109.348 -178.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1019 ' ' ARG . . . . . 0.509 ' HD2' ' CE3' ' A' ' 993' ' ' TRP . 38.0 ptt180 -149.93 145.76 26.67 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 171.016 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.96 ' HG2' ' HB3' ' A' ' 937' ' ' ASN . 53.9 mtp180 -144.09 167.4 22.46 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.503 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.3 ptt180 -157.38 154.48 28.96 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.611 174.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.526 ' NH1' ' HD2' ' A' ' 986' ' ' ARG . 35.8 ttm180 -90.31 133.27 35.07 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 123.604 0.565 . . . . 0.0 109.775 178.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.531 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 71.9 mt -102.12 130.76 48.81 Favored 'General case' 0 N--CA 1.421 -1.909 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 165.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.526 HG13 ' HB2' ' A' ' 983' ' ' ASP . 1.8 m -106.35 145.09 14.56 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.354 -174.607 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.748 ' NE ' ' HA ' ' A' 1025 ' ' ARG . 0.6 OUTLIER -158.99 115.99 2.73 Favored 'General case' 0 C--N 1.31 -1.146 0 O-C-N 125.218 1.574 . . . . 0.0 113.017 168.233 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.8 tmmm? -76.29 142.38 41.34 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.204 0.526 . . . . 0.0 109.765 -177.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.644 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 11.2 ptm180 -130.69 144.52 51.49 Favored 'General case' 0 CA--C 1.497 -1.076 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -173.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 58.5 tttt -134.02 135.3 43.29 Favored 'General case' 0 C--N 1.286 -2.157 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.191 -167.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.654 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 34.6 ttmt -84.58 -20.26 31.77 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 123.473 1.606 . . . . 0.0 107.362 179.214 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1030 ' ' ASP . . . . . 0.453 ' H ' ' HG2' ' A' 1028 ' ' LYS . 24.6 t70 61.95 -17.71 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 111.246 -2.706 . . . . 0.0 113.555 -171.133 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1031 ' ' LEU . . . . . 0.611 ' H ' ' C ' ' A' 1029 ' ' LYS . 18.5 tp 81.25 -10.54 1.19 Allowed 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 128.43 2.692 . . . . 0.0 110.621 -178.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 17.6 p -87.69 -3.5 58.96 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.384 0.612 . . . . 0.0 111.394 -177.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.57 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 80.3 mt-30 -93.8 7.77 43.62 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.691 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 7.0 t -160.09 155.47 25.24 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -178.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -115.58 -43.37 3.04 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.426 0.632 . . . . 0.0 109.386 175.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 45.3 t -144.38 -29.46 0.48 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.985 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 48.7 m -150.47 -174.64 4.82 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.862 -0.524 . . . . 0.0 110.389 -176.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 17.2 m -60.11 -53.88 52.48 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.089 0.471 . . . . 0.0 110.688 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -91.66 6.73 44.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.16 0.505 . . . . 0.0 110.991 -178.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 . . . . . 0 C--N 1.322 -0.629 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -178.752 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.471 0.58 0 N-CA-C 110.688 -0.116 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 919' ' ' ASP . . . . . 0.442 ' HB2' ' HD3' ' A' ' 920' ' ' PRO . 7.2 m-20 -107.09 -56.25 0.06 OUTLIER Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 920' ' ' PRO . . . . . 0.442 ' HD3' ' HB2' ' A' ' 919' ' ' ASP . 11.0 Cg_exo -70.07 154.3 66.65 Favored 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 123.562 2.841 . . . . 0.0 112.914 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -91.5 -37.75 12.96 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 113.994 -1.457 . . . . 0.0 108.873 179.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 11.6 t -115.13 105.15 12.59 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -122.96 138.45 54.68 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.365 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -91.21 145.42 24.68 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.319 0.58 . . . . 0.0 112.243 -175.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -139.84 22.66 2.46 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 176.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 103.31 66.96 0.74 Allowed Glycine 0 N--CA 1.438 -1.195 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.848 -173.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.518 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 6.1 m-70 -131.81 160.85 34.41 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 176.209 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.87 127.26 48.77 Favored 'General case' 0 N--CA 1.42 -1.971 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 162.343 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.56 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 0.0 OUTLIER -138.48 149.66 45.64 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 104.853 -2.277 . . . . 0.0 104.853 171.715 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.414 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.1 t80 -154.48 138.65 16.53 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 -174.351 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 45.4 m -79.77 132.82 36.25 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -110.04 156.88 19.94 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.449 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.0 pt-20 -154.21 159.48 41.37 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 121.282 0.563 . . . . 0.0 111.118 -173.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.641 ' O ' ' HA ' ' A' 1022 ' ' ARG . 8.8 p -147.96 179.6 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 176.022 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.568 ' H ' HG22 ' A' ' 934' ' ' VAL . 77.9 m-85 -139.97 118.51 12.25 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 118.468 0.576 . . . . 0.0 110.418 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.473 ' O ' ' HA ' ' A' 1020 ' ' ARG . 47.3 mt-30 -78.46 122.47 25.87 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 170.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 937' ' ' ASN . . . . . 0.506 ' HB3' ' HB3' ' A' ' 949' ' ' ALA . 24.5 m-80 -117.5 143.24 46.26 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 123.338 0.655 . . . . 0.0 112.049 -176.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.67 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 52.4 mt-10 -136.18 150.76 49.16 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 174.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 939' ' ' SER . . . . . 0.482 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 31.8 p -134.85 146.63 49.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 117.895 0.316 . . . . 0.0 111.72 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.536 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 25.0 ptt180 -153.3 161.33 42.48 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 124.156 0.982 . . . . 0.0 108.685 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -68.71 153.21 96.16 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 172.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 942' ' ' PRO . . . . . 0.485 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 70.2 Cg_exo -55.49 97.97 0.06 OUTLIER 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 121.893 1.729 . . . . 0.0 111.219 174.069 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 93.88 66.99 1.05 Allowed Glycine 0 N--CA 1.435 -1.374 0 N-CA-C 107.849 -2.101 . . . . 0.0 107.849 -175.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -159.01 -155.68 7.73 Favored Glycine 0 N--CA 1.434 -1.485 0 C-N-CA 120.138 -1.03 . . . . 0.0 113.145 -176.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -116.47 131.23 57.0 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 113.541 -1.329 . . . . 0.0 110.032 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.67 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 48.1 m95 -79.9 154.21 28.49 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.407 0.622 . . . . 0.0 110.609 -175.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -136.53 173.96 5.0 Favored Pre-proline 0 C--N 1.306 -1.284 0 N-CA-C 103.806 -2.665 . . . . 0.0 103.806 173.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.63 128.9 32.3 Favored 'Trans proline' 0 C--N 1.346 0.436 0 CA-C-N 121.522 1.579 . . . . 0.0 109.47 173.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 949' ' ' ALA . . . . . 0.506 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . . . -71.51 37.58 0.06 Allowed 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.849 1.426 . . . . 0.0 114.849 -175.111 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 85.18 -57.45 0.09 Allowed 'General case' 0 CA--C 1.474 -1.948 0 C-N-CA 125.274 1.43 . . . . 0.0 107.981 174.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -119.04 101.56 8.11 Favored 'General case' 0 N--CA 1.401 -2.903 0 N-CA-C 104.393 -2.447 . . . . 0.0 104.393 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.2 m -64.05 -57.76 8.7 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.085 0.241 . . . . 0.0 111.545 -172.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -98.35 126.3 43.82 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 37.5 p -149.66 -178.23 6.33 Favored 'General case' 0 C--O 1.246 0.896 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -172.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -105.33 -177.15 3.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 175.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.16 -31.63 32.29 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.27 -41.46 20.15 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 129.5 -2.07 6.09 Favored Glycine 0 CA--C 1.498 -0.974 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.887 177.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.43 104.36 0.62 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 114.626 -0.787 . . . . 0.0 109.181 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 960' ' ' LYS . . . . . 0.414 ' HD3' ' N ' ' A' ' 961' ' ' ALA . 9.3 tmtt? -48.87 120.14 3.66 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.414 ' N ' ' HD3' ' A' ' 960' ' ' LYS . . . -125.39 -172.45 2.59 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.653 -175.256 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 962' ' ' ALA . . . . . 0.458 ' CB ' ' HG ' ' A' ' 967' ' ' LEU . . . -62.16 140.89 58.41 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 121.902 0.858 . . . . 0.0 111.35 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 963' ' ' SER . . . . . 0.491 ' O ' ' HB2' ' A' ' 967' ' ' LEU . 15.0 m -102.47 162.64 19.61 Favored Pre-proline 0 N--CA 1.43 -1.466 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -176.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.606 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.2 Cg_endo -51.23 -37.95 60.35 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.733 2.289 . . . . 0.0 114.249 -177.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 25.5 p -79.91 -47.46 15.02 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 121.906 -0.496 . . . . 0.0 111.03 175.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 966' ' ' GLU . . . . . 0.483 ' HB2' ' H ' ' A' ' 963' ' ' SER . 45.2 mt-10 -65.65 -8.23 19.39 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.491 ' HB2' ' O ' ' A' ' 963' ' ' SER . 1.0 OUTLIER -102.02 112.49 25.15 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 -175.322 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.91 155.5 18.88 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.089 -176.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 16.0 p -76.85 126.95 85.07 Favored Pre-proline 0 C--N 1.313 -1.005 0 C-N-CA 120.169 -0.613 . . . . 0.0 109.49 174.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.637 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 52.6 Cg_endo -80.27 166.14 20.64 Favored 'Trans proline' 0 C--O 1.238 0.479 0 C-N-CA 122.886 2.39 . . . . 0.0 111.363 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.82 102.8 0.21 Allowed 'Trans proline' 0 C--O 1.24 0.585 0 C-N-CA 121.84 1.694 . . . . 0.0 110.266 173.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.661 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 121.63 3.47 10.18 Favored Glycine 0 N--CA 1.429 -1.8 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.383 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.637 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 93.5 m95 -138.57 137.62 37.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.96 0.886 . . . . 0.0 112.177 177.094 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.632 ' HB3' ' O ' ' A' 1028 ' ' LYS . 3.5 tp10 -122.0 137.2 54.89 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.163 -1.38 . . . . 0.0 108.262 -175.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.618 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 80.9 m95 -81.07 100.41 9.0 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 120.996 -1.065 . . . . 0.0 110.48 175.342 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 976' ' ' GLU . . . . . 0.462 ' HB3' ' HB3' ' A' 1028 ' ' LYS . 8.4 pt-20 -75.9 -31.54 59.24 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 177.219 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -78.07 146.43 35.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.387 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.59 -46.38 66.45 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -166.75 156.41 11.22 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.437 0.637 . . . . 0.0 111.596 -173.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.71 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 37.7 m95 -70.75 119.63 15.18 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.422 -0.808 . . . . 0.0 108.822 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 19.6 m -125.35 148.51 48.72 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -175.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 982' ' ' TYR . . . . . 0.53 ' HA ' ' O ' ' A' 1022 ' ' ARG . 7.2 p90 -73.68 135.85 43.75 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 119.251 0.932 . . . . 0.0 110.284 -175.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.588 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 12.5 t70 -88.21 126.34 35.1 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 114.423 -1.262 . . . . 0.0 111.048 -172.611 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.467 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.3 pp -121.01 16.19 6.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.471 -179.092 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 985' ' ' ASN . . . . . 0.514 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 16.7 t-20 -90.36 16.89 7.94 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.848 -177.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.588 ' HD3' ' OD2' ' A' ' 983' ' ' ASP . 5.0 mpt_? -141.47 -175.86 4.52 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -175.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -73.85 84.21 1.68 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.286 0.565 . . . . 0.0 110.812 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.528 HG12 ' HG2' ' A' ' 994' ' ' GLU . 17.9 m -141.13 -171.89 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -104.0 -172.7 2.15 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -58.36 -35.44 71.95 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.734 0.778 . . . . 0.0 111.829 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 991' ' ' LYS . . . . . 0.413 ' HA ' ' CE2' ' A' ' 982' ' ' TYR . 80.4 mttt -106.75 9.1 31.19 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.363 -176.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.72 -121.55 7.2 Favored Glycine 0 C--O 1.205 -1.701 0 N-CA-C 105.691 -2.964 . . . . 0.0 105.691 -174.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.601 ' H ' ' HB3' ' A' 1021 ' ' ARG . 42.9 m95 52.72 99.4 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 173.075 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.528 ' HG2' HG12 ' A' ' 988' ' ' VAL . 26.2 mt-10 -98.6 148.95 23.28 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.69 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.747 ' HD2' ' HE2' ' A' 1016 ' ' HIS . 19.9 t80 -65.79 96.65 0.3 Allowed 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 127.059 2.144 . . . . 0.0 111.098 177.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -118.93 102.89 0.96 Allowed Glycine 0 N--CA 1.444 -0.825 0 C-N-CA 119.255 -1.45 . . . . 0.0 111.975 174.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.443 HG22 ' HD2' ' A' 1016 ' ' HIS . 0.1 OUTLIER -108.71 143.24 19.37 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 O-C-N 119.951 -1.911 . . . . 0.0 107.563 178.447 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 998' ' ' THR . . . . . 0.493 ' OG1' ' HG3' ' A' 1005 ' ' PRO . 7.9 m -138.92 127.97 23.84 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.7 mp -100.37 97.95 7.17 Favored Pre-proline 0 C--N 1.313 -0.99 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.26 140.85 38.02 Favored 'Trans proline' 0 C--O 1.238 0.478 0 C-N-CA 122.607 2.204 . . . . 0.0 114.071 -173.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -80.89 155.98 84.18 Favored 'Cis proline' 0 CA--C 1.512 -0.575 0 C-N-CA 123.177 -1.593 . . . . 0.0 110.857 -2.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1002 ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' 1003 ' ' HIS . 21.1 t70 -159.18 -133.84 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.336 -174.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1003 ' ' HIS . . . . . 0.424 ' H ' ' CG ' ' A' 1002 ' ' ASP . 5.8 p-80 -158.37 -45.09 0.06 Allowed 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 122.999 0.52 . . . . 0.0 111.25 -174.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 61.1 tttt -167.26 145.67 4.18 Favored Pre-proline 0 N--CA 1.448 -0.543 0 C-N-CA 119.651 -0.819 . . . . 0.0 108.793 -173.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.493 ' HG3' ' OG1' ' A' ' 998' ' ' THR . 52.1 Cg_exo -64.55 124.61 13.53 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 121.058 1.172 . . . . 0.0 109.724 167.139 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 57.8 pttt -70.64 -59.42 2.84 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 34.3 t -97.38 150.59 20.83 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 120.594 0.235 . . . . 0.0 111.179 -177.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.518 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 53.0 m95 -137.37 145.55 43.43 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 125.113 1.508 . . . . 0.0 107.454 175.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.62 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 10.8 m -161.92 -155.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 -177.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -103.14 -36.34 8.16 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 119.553 1.07 . . . . 0.0 113.104 -174.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -61.22 108.88 0.98 Allowed 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -168.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.444 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 4.9 tp10 -66.58 118.04 9.61 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 172.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.447 ' HD3' ' CZ ' ' A' 1015 ' ' TYR . 83.1 mttt -122.18 155.92 34.8 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.747 -174.26 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 23.7 ttt -55.88 -47.66 76.97 Favored 'General case' 0 CA--C 1.503 -0.864 0 O-C-N 123.951 0.782 . . . . 0.0 111.593 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1015 ' ' TYR . . . . . 0.485 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 31.6 p90 -75.09 28.07 0.09 Allowed 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.083 -0.647 . . . . 0.0 112.66 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.747 ' HE2' ' HD2' ' A' ' 995' ' ' TYR . 9.0 m170 -82.54 116.81 22.13 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 121.731 -0.606 . . . . 0.0 110.61 173.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 4.4 m -93.2 -28.99 15.94 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 123.088 1.423 . . . . 0.0 107.561 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1018 ' ' HIS . . . . . 0.415 ' CD2' ' HB3' ' A' ' 939' ' ' SER . 31.2 m80 -139.19 156.83 46.83 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 113.383 -1.735 . . . . 0.0 110.68 -176.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -156.37 150.74 25.53 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 105.75 -1.945 . . . . 0.0 105.75 169.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.473 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.9 ptp180 -149.99 163.65 37.56 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 118.267 -1.373 . . . . 0.0 110.86 176.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.601 ' HB3' ' H ' ' A' ' 993' ' ' TRP . 21.9 ptt180 -143.36 142.3 31.23 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.911 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.641 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 33.0 ttm180 -82.3 129.19 34.8 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.112 -178.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.71 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 97.0 mt -102.16 133.65 46.68 Favored 'General case' 0 N--CA 1.427 -1.609 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 166.62 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.536 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 13.8 m -111.11 138.99 37.09 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.009 -176.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.49 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 13.8 tpt180 -138.56 110.28 7.12 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.543 170.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.56 ' HE2' ' HG2' ' A' ' 929' ' ' GLU . 2.2 tmtp? -69.63 147.02 51.21 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.618 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 9.8 ptm180 -140.71 129.49 23.04 Favored 'General case' 0 C--O 1.201 -1.496 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -177.524 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.632 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 36.0 ttmt -121.55 135.5 55.01 Favored 'General case' 0 C--N 1.275 -2.661 0 CA-C-N 115.373 -0.831 . . . . 0.0 108.849 -174.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 35.5 ttmt -84.59 -23.54 29.57 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 123.709 1.719 . . . . 0.0 107.058 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1030 ' ' ASP . . . . . 0.518 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 16.7 t70 61.77 -5.24 0.15 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 110.811 -2.904 . . . . 0.0 111.62 -169.217 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1031 ' ' LEU . . . . . 0.563 ' H ' ' C ' ' A' 1029 ' ' LYS . 36.7 tp 74.56 -34.33 0.27 Allowed 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 127.67 2.388 . . . . 0.0 111.892 -177.312 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 8.1 t -68.27 -15.46 63.58 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -175.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.483 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 93.4 mt-30 -72.27 -34.46 68.23 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.429 -0.509 . . . . 0.0 110.764 177.654 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 20.7 p -94.33 -41.06 9.63 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-O 121.02 0.438 . . . . 0.0 110.121 178.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -99.58 79.75 2.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 22.9 t -92.71 95.57 9.64 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 3.4 p -80.87 158.58 25.29 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.146 -177.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 59.0 p 61.25 -74.01 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.524 1.93 . . . . 0.0 114.038 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -112.24 145.37 40.06 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.702 0.287 . . . . 0.0 110.657 -176.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 . . . . . 0 C--N 1.318 -0.798 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.822 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 41.1 pt . . . . . 0 C--O 1.241 0.622 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 919' ' ' ASP . . . . . 0.442 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 32.3 m-20 -130.32 136.98 29.83 Favored Pre-proline 0 C--N 1.316 -0.864 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 920' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 27.5 Cg_exo -68.87 95.87 0.5 Allowed 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.511 2.14 . . . . 0.0 112.02 178.154 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -73.29 -23.17 60.26 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.849 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 25.9 m -70.65 -16.46 62.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.239 176.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . 61.12 -159.38 0.32 Allowed 'General case' 0 C--O 1.243 0.738 0 C-N-CA 123.625 0.77 . . . . 0.0 109.536 -177.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -76.33 170.54 16.15 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 176.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . 73.23 153.75 0.14 Allowed 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.831 1.252 . . . . 0.0 110.531 -171.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 82.28 14.89 75.61 Favored Glycine 0 CA--C 1.491 -1.439 0 N-CA-C 109.86 -1.296 . . . . 0.0 109.86 -175.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.456 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 46.1 m-70 -123.61 -140.35 0.31 Allowed 'General case' 0 N--CA 1.421 -1.913 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 176.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.09 115.73 0.97 Allowed 'General case' 0 N--CA 1.413 -2.314 0 N-CA-C 101.495 -3.52 . . . . 0.0 101.495 172.082 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -142.22 132.08 24.32 Favored 'General case' 0 C--N 1.274 -2.686 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 177.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -128.69 140.43 51.75 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -177.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.64 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 38.7 m -70.64 126.72 30.4 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.141 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -96.35 166.36 11.75 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -161.07 149.31 15.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-O 121.204 0.526 . . . . 0.0 110.719 -172.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.571 ' O ' ' HA ' ' A' 1022 ' ' ARG . 14.8 p -145.33 175.07 2.69 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 176.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.606 ' CD2' ' HD3' ' A' 1020 ' ' ARG . 75.8 m-85 -135.62 151.47 50.28 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.495 ' O ' ' HA ' ' A' 1020 ' ' ARG . 13.0 tt0 -123.2 118.09 26.84 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 178.475 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -106.82 141.11 38.58 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.831 0.824 . . . . 0.0 111.121 -174.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 67.5 mt-10 -136.65 157.66 46.25 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 175.319 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 40.7 t -144.69 141.63 29.45 Favored 'General case' 0 N--CA 1.426 -1.632 0 CA-C-O 121.073 0.463 . . . . 0.0 109.997 -178.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.612 HH21 ' HB2' ' A' 1016 ' ' HIS . 21.6 ptt180 -139.03 159.61 41.73 Favored 'General case' 0 N--CA 1.435 -1.203 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 177.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -71.89 161.42 78.84 Favored Pre-proline 0 C--N 1.303 -1.452 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 170.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 942' ' ' PRO . . . . . 0.554 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 31.4 Cg_exo -61.84 86.16 0.1 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 121.374 1.383 . . . . 0.0 111.031 175.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 103.15 70.18 0.83 Allowed Glycine 0 N--CA 1.434 -1.484 0 N-CA-C 107.716 -2.154 . . . . 0.0 107.716 -173.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.62 -140.57 2.9 Favored Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 120.35 -0.929 . . . . 0.0 113.647 -175.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -127.97 122.62 32.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.702 -0.749 . . . . 0.0 111.532 -173.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.613 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 74.6 m95 -70.47 135.59 48.77 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -142.88 178.78 1.36 Allowed Pre-proline 0 C--N 1.302 -1.482 0 N-CA-C 103.073 -2.936 . . . . 0.0 103.073 -179.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.05 124.29 15.91 Favored 'Trans proline' 0 C--O 1.238 0.501 0 CA-C-N 122.735 2.012 . . . . 0.0 111.423 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -49.23 -49.99 40.52 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.626 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 173.88 -38.7 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 951' ' ' ASP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 960' ' ' LYS . 46.1 m-20 -122.5 116.07 23.3 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 174.035 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 6.6 m -63.64 -59.51 4.51 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -174.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 953' ' ' TYR . . . . . 0.472 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 91.7 m-85 -110.03 135.3 51.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.788 0.328 . . . . 0.0 110.425 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 954' ' ' THR . . . . . 0.434 ' HA ' ' HA ' ' A' ' 960' ' ' LYS . 58.5 p -142.74 179.91 6.72 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.55 0.691 . . . . 0.0 110.183 -171.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -98.21 174.36 6.55 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 104.911 -2.255 . . . . 0.0 104.911 172.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.54 -34.96 52.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 118.587 0.631 . . . . 0.0 110.952 174.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -86.36 -0.54 56.13 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 96.6 -10.12 66.69 Favored Glycine 0 CA--C 1.501 -0.782 0 C-N-CA 119.739 -1.219 . . . . 0.0 113.308 177.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -51.64 99.2 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 960' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 954' ' ' THR . 0.2 OUTLIER -60.36 137.9 58.06 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -177.895 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -134.24 -178.98 5.29 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.397 -175.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 962' ' ' ALA . . . . . 0.537 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -70.72 153.06 43.15 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 172.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 3.7 m -76.32 158.51 81.53 Favored Pre-proline 0 C--N 1.313 -1.017 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -178.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.596 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 53.9 Cg_exo -44.94 -31.73 5.68 Favored 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 124.263 3.308 . . . . 0.0 116.317 -178.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.8 t -71.61 -45.54 61.83 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 966' ' ' GLU . . . . . 0.537 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 35.2 mt-10 -65.19 -25.88 67.9 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.373 175.055 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.522 HD12 ' HA ' ' A' ' 964' ' ' PRO . 57.4 mt -71.43 112.05 7.24 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.702 0.763 . . . . 0.0 110.208 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 20.6 p -118.77 169.99 9.38 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.881 -172.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 20.3 p -83.91 129.21 59.9 Favored Pre-proline 0 N--CA 1.443 -0.781 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.646 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.614 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 53.5 Cg_endo -82.59 163.28 16.64 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.931 2.421 . . . . 0.0 110.642 177.437 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -59.61 104.82 0.23 Allowed 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.02 1.813 . . . . 0.0 110.657 174.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.511 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 121.19 -1.67 11.57 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.066 -177.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.614 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.4 m95 -136.81 141.57 42.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 117.256 0.528 . . . . 0.0 111.167 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.539 ' HB3' ' OE1' ' A' 1033 ' ' GLN . 2.9 pt-20 -117.94 148.37 42.25 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -177.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.54 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 85.5 m95 -84.64 98.36 10.15 Favored 'General case' 0 C--N 1.296 -1.732 0 C-N-CA 119.169 -1.013 . . . . 0.0 110.327 167.033 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 976' ' ' GLU . . . . . 0.428 ' HG2' ' HE3' ' A' 1026 ' ' LYS . 8.9 tp10 -67.83 -41.19 83.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.06 -1.427 . . . . 0.0 108.21 176.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 977' ' ' ASP . . . . . 0.554 ' HB3' ' NE ' ' A' 1025 ' ' ARG . 64.9 m-20 -84.1 158.68 21.32 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.842 -177.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -75.53 -63.79 1.21 Allowed 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 -175.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -154.21 144.38 22.02 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -171.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.596 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 6.8 m95 -68.4 130.06 41.76 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -173.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 981' ' ' SER . . . . . 0.532 ' O ' ' HA ' ' A' 1023 ' ' LEU . 22.9 t -136.18 -175.12 3.88 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 982' ' ' TYR . . . . . 0.58 ' CD2' ' HA ' ' A' ' 991' ' ' LYS . 0.1 OUTLIER -77.05 151.82 35.35 Favored 'General case' 0 C--N 1.295 -1.791 0 CA-C-N 118.986 0.812 . . . . 0.0 112.179 -175.394 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.554 ' HB2' HG13 ' A' 1024 ' ' VAL . 54.0 t0 -91.0 125.5 35.82 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 172.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.3 pp -119.06 6.76 6.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 985' ' ' ASN . . . . . 0.548 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 67.1 t30 -93.63 18.36 10.21 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.801 0.81 . . . . 0.0 110.767 -172.066 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.548 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 5.7 mpt_? -139.86 -176.35 4.55 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -177.25 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -75.29 75.55 2.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.991 0.9 . . . . 0.0 110.302 176.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.601 HG12 ' HG2' ' A' ' 994' ' ' GLU . 9.7 m -143.92 152.81 15.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.169 -1.378 . . . . 0.0 108.531 -177.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -55.8 170.52 0.28 Allowed 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 123.64 0.776 . . . . 0.0 111.966 177.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -57.5 -33.39 67.98 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 121.374 0.607 . . . . 0.0 111.074 174.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 991' ' ' LYS . . . . . 0.58 ' HA ' ' CD2' ' A' ' 982' ' ' TYR . 81.6 mttt -96.38 6.79 48.02 Favored 'General case' 0 N--CA 1.428 -1.546 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.931 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 93.62 -14.2 65.83 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.058 175.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.571 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 74.2 m95 -50.84 135.34 24.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.199 1.0 . . . . 0.0 113.262 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.601 ' HG2' HG12 ' A' ' 988' ' ' VAL . 41.7 mt-10 -114.61 148.75 37.64 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.407 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.768 ' O ' ' HA ' ' A' 1008 ' ' TRP . 3.9 t80 -81.37 100.9 9.49 Favored 'General case' 0 C--O 1.199 -1.561 0 CA-C-N 112.985 -1.916 . . . . 0.0 108.966 -177.495 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -123.29 101.64 0.71 Allowed Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 119.125 -1.512 . . . . 0.0 111.895 173.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.563 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.7 OUTLIER -102.57 151.04 6.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 O-C-N 120.864 -1.374 . . . . 0.0 107.741 179.65 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 15.8 m -127.91 102.77 6.91 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 15.8 pt -86.89 112.5 47.67 Favored Pre-proline 0 C--N 1.319 -0.721 0 C-N-CA 120.08 -0.648 . . . . 0.0 110.935 174.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -70.55 147.04 56.89 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.72 2.28 . . . . 0.0 112.975 -176.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -83.6 136.04 26.13 Favored 'Cis proline' 0 N--CA 1.451 -0.999 0 C-N-CA 122.931 -1.695 . . . . 0.0 112.993 -0.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 39.3 t0 167.23 154.98 0.03 OUTLIER 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 111.524 -2.58 . . . . 0.0 105.359 -176.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -119.11 -40.9 2.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 118.704 -1.199 . . . . 0.0 112.346 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 70.2 mttt -104.29 132.15 21.24 Favored Pre-proline 0 C--N 1.31 -1.143 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -176.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.443 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 74.5 Cg_exo -56.05 125.32 18.71 Favored 'Trans proline' 0 CA--C 1.515 -0.427 0 C-N-CA 123.117 2.545 . . . . 0.0 111.019 170.504 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -94.43 -48.07 6.29 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 35.4 t -85.15 134.72 34.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.44 -1.255 . . . . 0.0 111.093 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.768 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 54.4 m95 -131.54 136.41 47.83 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 124.457 1.098 . . . . 0.0 108.48 176.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.769 HG12 ' H ' ' A' 1010 ' ' ALA . 11.2 t -147.32 -164.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 103.664 -2.717 . . . . 0.0 103.664 -176.245 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1010 ' ' ALA . . . . . 0.769 ' H ' HG12 ' A' 1009 ' ' VAL . . . -114.98 12.16 16.69 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 120.381 1.446 . . . . 0.0 111.755 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -88.08 -166.36 1.57 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -177.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.44 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 8.5 tp10 -158.74 105.96 1.84 Allowed 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -175.327 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.545 ' O ' ' HB2' ' A' 1016 ' ' HIS . 56.5 mtpt -111.69 151.44 28.88 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 177.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1014 ' ' MET . . . . . 0.405 ' C ' ' H ' ' A' 1016 ' ' HIS . 50.8 ttp -53.24 -37.54 62.17 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 123.881 0.738 . . . . 0.0 111.013 175.186 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1015 ' ' TYR . . . . . 0.554 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 97.8 m-85 -69.2 16.08 0.06 Allowed 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 177.009 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.612 ' HB2' HH21 ' A' ' 940' ' ' ARG . 0.2 OUTLIER -79.54 115.91 19.44 Favored 'General case' 0 CA--C 1.499 -1.019 0 O-C-N 121.906 -0.496 . . . . 0.0 110.981 176.309 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 1017 ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 10.9 p -95.95 -27.03 15.35 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.701 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -139.15 153.82 48.0 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.693 -1.139 . . . . 0.0 111.648 -175.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -156.73 151.26 25.55 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 170.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.606 ' HD3' ' CD2' ' A' ' 935' ' ' TYR . 2.7 ptp180 -149.4 165.21 32.76 Favored 'General case' 0 C--O 1.193 -1.871 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 175.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.594 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.3 ptt180 -145.06 148.03 33.23 Favored 'General case' 0 C--N 1.285 -2.229 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.699 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.571 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 41.2 ttm180 -89.4 122.52 32.69 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.532 ' HA ' ' O ' ' A' ' 981' ' ' SER . 78.0 mt -98.27 125.68 43.46 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 103.706 -2.701 . . . . 0.0 103.706 168.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.554 HG13 ' HB2' ' A' ' 983' ' ' ASP . 2.5 m -106.5 151.16 8.57 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.069 -173.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.772 ' NE ' ' HA ' ' A' 1025 ' ' ARG . 0.5 OUTLIER -159.09 110.08 2.05 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 125.427 1.705 . . . . 0.0 112.614 169.421 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.64 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 3.2 tmmm? -78.21 146.86 34.72 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.398 0.618 . . . . 0.0 109.409 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.54 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 6.0 ptm180 -135.75 146.96 48.21 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 -171.555 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.456 ' O ' ' HG2' ' A' ' 974' ' ' GLU . 34.3 ttmt -129.94 136.27 49.28 Favored 'General case' 0 C--O 1.193 -1.873 0 O-C-N 123.429 0.456 . . . . 0.0 110.573 -172.319 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 38.7 ttmt -85.82 -22.3 27.69 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 123.466 1.603 . . . . 0.0 107.668 -176.475 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 9.3 t70 56.98 12.17 1.15 Allowed 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 111.431 -2.622 . . . . 0.0 110.044 -171.227 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1031 ' ' LEU . . . . . 0.456 ' HB2' ' HA ' ' A' ' 927' ' ' HIS . 22.6 tp 69.24 -52.1 0.6 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.635 1.974 . . . . 0.0 111.659 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 10.3 t -69.44 -10.08 56.43 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -173.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.539 ' OE1' ' HB3' ' A' ' 974' ' ' GLU . 23.5 mt-30 -77.81 -11.12 59.85 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.255 177.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1034 ' ' THR . . . . . 0.5 ' OG1' ' HD3' ' A' 1029 ' ' LYS . 58.4 p -120.31 137.34 54.31 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 175.584 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -120.81 140.12 52.17 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 17.1 m -76.47 -38.66 55.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 122.011 0.91 . . . . 0.0 109.013 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 61.2 p -139.71 111.95 7.62 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.277 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 28.5 m -91.36 -30.71 16.39 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.599 -1.259 . . . . 0.0 107.599 175.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -68.57 -66.95 0.51 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.528 177.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 . . . . . 0 C--O 1.24 0.553 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.235 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 8.5 tp . . . . . 0 N--CA 1.466 0.34 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 919' ' ' ASP . . . . . 0.43 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 45.3 m-20 79.12 113.31 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 124.336 1.054 . . . . 0.0 111.135 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 920' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 4.7 Cg_exo -83.21 25.35 0.69 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 123.902 3.068 . . . . 0.0 112.921 179.183 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -134.12 -156.66 0.75 Allowed 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 105.846 -1.909 . . . . 0.0 105.846 178.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.8 98.97 0.14 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 118.263 0.483 . . . . 0.0 110.003 173.276 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -78.19 85.14 4.37 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.421 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -78.51 108.35 11.82 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.286 -174.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -151.38 31.97 0.58 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.176 -1.374 . . . . 0.0 109.555 -178.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 84.76 23.46 49.8 Favored Glycine 0 CA--C 1.493 -1.33 0 C-N-CA 121.05 -0.595 . . . . 0.0 113.407 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -86.69 -32.15 20.64 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 173.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 928' ' ' THR . . . . . 0.483 ' HB ' ' HB3' ' A' 1029 ' ' LYS . 1.5 m 63.39 90.97 0.08 Allowed 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.799 -169.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -135.95 129.11 31.67 Favored 'General case' 0 N--CA 1.42 -1.94 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 173.158 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.452 ' O ' ' HG2' ' A' 1027 ' ' ARG . 70.8 t80 -122.62 139.86 53.46 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -178.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.564 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 9.0 m -76.01 121.14 22.31 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.445 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -99.54 157.38 16.49 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 -175.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.672 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 0.0 OUTLIER -159.06 156.29 28.97 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 119.433 1.015 . . . . 0.0 111.668 -175.489 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.476 HG11 HD11 ' A' ' 967' ' ' LEU . 20.3 m -145.99 142.71 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 174.581 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.486 ' CG ' ' HD3' ' A' 1020 ' ' ARG . 98.5 m-85 -101.15 113.67 26.92 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 120.861 -1.149 . . . . 0.0 111.516 178.353 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.561 ' HB3' ' CE2' ' A' ' 953' ' ' TYR . 3.8 pt20 -81.41 137.01 35.72 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 171.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 937' ' ' ASN . . . . . 0.884 ' HB3' ' HB3' ' A' 1020 ' ' ARG . 21.0 p-10 -140.56 163.23 33.41 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -175.2 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.657 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 43.2 mt-10 -136.67 161.35 36.17 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 113.334 -1.757 . . . . 0.0 107.422 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 19.6 m -138.46 147.61 43.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 120.7 0.286 . . . . 0.0 111.143 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.594 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 16.2 ptt180 -156.07 162.47 40.28 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 123.59 0.756 . . . . 0.0 109.756 -173.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -60.33 162.43 10.86 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 171.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -67.96 78.37 0.57 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.071 1.848 . . . . 0.0 112.32 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 105.28 74.31 0.94 Allowed Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 108.533 -1.827 . . . . 0.0 108.533 -175.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -165.41 -150.1 6.11 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.236 -176.109 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -101.28 130.02 47.35 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.991 -0.604 . . . . 0.0 110.07 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.657 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 45.6 m95 -82.79 139.67 33.42 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 177.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -117.52 163.79 22.28 Favored Pre-proline 0 C--N 1.292 -1.932 0 N-CA-C 101.279 -3.6 . . . . 0.0 101.279 171.275 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.22 149.02 47.07 Favored 'Trans proline' 0 C--O 1.238 0.49 0 CA-C-N 121.456 1.556 . . . . 0.0 110.353 175.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.14 -171.07 0.1 Allowed 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.161 0.505 . . . . 0.0 110.787 177.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.26 -38.61 30.58 Favored 'General case' 0 CA--C 1.476 -1.885 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -117.94 99.01 6.63 Favored 'General case' 0 N--CA 1.397 -3.085 0 N-CA-C 103.804 -2.665 . . . . 0.0 103.804 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 27.3 m -61.5 -50.35 73.09 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 123.342 0.401 . . . . 0.0 111.365 -172.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 953' ' ' TYR . . . . . 0.561 ' CE2' ' HB3' ' A' ' 936' ' ' GLN . 81.4 m-85 -101.83 132.44 47.59 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.167 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 18.4 p -142.73 177.22 8.47 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 123.393 0.677 . . . . 0.0 110.835 -171.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -104.97 171.17 7.46 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 171.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.88 -37.44 52.25 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 118.971 0.805 . . . . 0.0 110.159 174.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -73.23 -10.19 59.51 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 95.07 -7.79 69.78 Favored Glycine 0 CA--C 1.5 -0.872 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.15 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -58.7 105.76 0.34 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -47.01 124.0 5.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.54 178.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -115.76 168.54 9.95 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.903 -176.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -71.6 157.0 38.75 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.882 177.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.1 m -89.08 149.9 44.1 Favored Pre-proline 0 N--CA 1.435 -1.192 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.566 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 2.8 Cg_exo -43.57 -38.51 9.0 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 125.001 3.801 . . . . 0.0 116.925 -176.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 28.4 m -74.3 -41.8 60.59 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 122.143 0.973 . . . . 0.0 109.391 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -64.57 -28.77 69.86 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.041 -1.436 . . . . 0.0 110.565 173.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.482 HD13 ' CH2' ' A' ' 980' ' ' TRP . 39.6 mt -74.08 120.17 19.29 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 121.776 0.798 . . . . 0.0 110.616 178.22 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 22.0 p -124.38 169.09 12.17 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.042 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 16.9 p -90.44 138.96 26.66 Favored Pre-proline 0 C--N 1.312 -1.054 0 C-N-CA 120.459 -0.496 . . . . 0.0 109.906 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.616 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 92.8 Cg_endo -79.2 172.38 14.81 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.912 2.408 . . . . 0.0 111.066 173.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 971' ' ' PRO . . . . . 0.548 ' HG3' ' HA ' ' A' 1040 ' ' ARG . 98.7 Cg_exo -45.88 -43.52 19.45 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 123.211 2.607 . . . . 0.0 114.329 178.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.965 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . -102.76 22.79 35.95 Favored Glycine 0 N--CA 1.434 -1.438 0 C-N-CA 121.478 -0.391 . . . . 0.0 113.614 -175.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.616 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 78.1 m95 -135.42 138.11 42.93 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 117.946 0.873 . . . . 0.0 110.743 172.561 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.602 ' HB3' ' O ' ' A' 1028 ' ' LYS . 7.3 tp10 -118.85 131.02 56.06 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 125.671 1.588 . . . . 0.0 108.315 -175.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.443 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 82.5 m95 -77.07 98.75 5.11 Favored 'General case' 0 C--N 1.306 -1.288 0 O-C-N 120.92 -1.113 . . . . 0.0 110.129 173.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -69.72 -35.15 74.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 177.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 977' ' ' ASP . . . . . 0.768 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 1.5 m-20 -87.22 151.43 23.17 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.383 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.65 -65.08 0.75 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -170.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -153.81 146.39 24.13 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -171.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.589 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 19.7 m95 -60.62 125.64 24.47 Favored 'General case' 0 CA--C 1.502 -0.903 0 O-C-N 124.325 1.016 . . . . 0.0 109.834 -169.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 981' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' 1023 ' ' LEU . 18.0 m -111.95 -171.74 1.9 Allowed 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 -175.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -107.26 149.36 27.85 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 119.804 1.184 . . . . 0.0 109.224 175.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.532 ' O ' HG21 ' A' ' 988' ' ' VAL . 52.4 t0 -86.59 119.72 27.13 Favored 'General case' 0 C--N 1.317 -0.815 0 O-C-N 123.206 0.316 . . . . 0.0 110.216 -175.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 24.2 pt -120.11 13.33 6.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 122.227 1.013 . . . . 0.0 108.97 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.59 18.86 6.87 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.845 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -137.22 -176.24 4.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.401 -178.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.83 81.17 8.66 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 172.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.532 HG21 ' O ' ' A' ' 983' ' ' ASP . 16.5 m -134.66 162.67 38.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 114.429 -1.259 . . . . 0.0 109.555 -176.153 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -54.7 170.27 0.17 Allowed 'General case' 0 C--O 1.239 0.551 0 O-C-N 123.976 0.798 . . . . 0.0 110.026 170.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -53.04 -34.51 56.77 Favored 'General case' 0 CA--C 1.5 -0.973 0 CA-C-O 121.993 0.902 . . . . 0.0 110.538 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 991' ' ' LYS . . . . . 0.469 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 26.3 mttp -103.63 11.83 35.61 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.401 -1.272 . . . . 0.0 111.607 -174.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 90.73 -13.87 64.59 Favored Glycine 0 C--N 1.331 0.285 0 CA-C-N 116.739 -0.21 . . . . 0.0 113.483 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.634 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 97.7 m95 -51.9 146.78 7.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.566 0.698 . . . . 0.0 112.47 176.151 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -135.68 150.46 49.59 Favored 'General case' 0 C--O 1.252 1.198 0 CA-C-O 122.24 1.019 . . . . 0.0 112.216 -177.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.841 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 50.5 t80 -80.87 93.2 6.23 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 111.792 -2.458 . . . . 0.0 112.208 -172.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 996' ' ' GLY . . . . . 0.612 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -118.31 93.72 0.58 Allowed Glycine 0 CA--C 1.49 -1.478 0 C-N-CA 119.44 -1.362 . . . . 0.0 111.243 177.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.571 HG22 ' HA ' ' A' 1016 ' ' HIS . 12.0 pt -103.83 148.59 8.51 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.883 0 C-N-CA 118.204 -1.399 . . . . 0.0 108.556 -178.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 11.6 t -138.72 132.21 30.4 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.355 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.3 mp -114.45 114.47 45.12 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.03 136.34 64.74 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 123.068 2.512 . . . . 0.0 113.113 -178.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -85.23 138.42 25.69 Favored 'Cis proline' 0 N--CA 1.449 -1.11 0 C-N-CA 122.774 -1.761 . . . . 0.0 113.898 1.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 7.9 t0 162.02 126.52 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 111.271 -2.695 . . . . 0.0 104.624 -179.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -85.19 -43.04 14.16 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.739 -168.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 84.7 mttt -127.14 141.34 40.42 Favored Pre-proline 0 C--N 1.309 -1.157 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.347 -174.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -50.26 127.88 21.24 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.617 2.211 . . . . 0.0 110.614 169.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 21.2 pttm -110.62 15.52 21.98 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.012 -0.995 . . . . 0.0 108.484 -177.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 42.6 t -146.95 137.13 23.46 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.448 -175.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.673 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 59.7 m95 -137.62 135.89 36.99 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 125.367 1.667 . . . . 0.0 107.085 175.595 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.415 ' HB ' ' HB3' ' A' ' 995' ' ' TYR . 96.5 t -144.95 165.74 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 -171.574 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -82.99 -2.16 54.47 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -175.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -112.23 122.09 46.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 119.018 0.826 . . . . 0.0 112.538 -174.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.435 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 52.0 tp10 -72.13 120.58 17.93 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 174.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.538 ' H ' ' CE1' ' A' 1016 ' ' HIS . 94.5 mttt -124.66 155.79 38.6 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.004 -178.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 52.3 ttp -53.12 -40.08 63.92 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 123.863 0.727 . . . . 0.0 112.554 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -52.49 -7.98 0.08 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.568 1.321 . . . . 0.0 114.568 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.841 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 13.5 m80 -57.85 154.8 11.46 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 122.53 1.157 . . . . 0.0 112.993 179.115 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -161.55 -33.41 0.05 OUTLIER 'General case' 0 C--N 1.294 -1.827 0 CA-C-N 111.295 -2.684 . . . . 0.0 106.599 -167.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 14.2 m80 -135.21 141.49 45.83 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.697 -1.592 . . . . 0.0 108.601 174.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1019 ' ' ARG . . . . . 0.634 ' HG2' ' CE3' ' A' ' 993' ' ' TRP . 43.3 ttt180 -152.47 142.49 22.22 Favored 'General case' 0 CA--C 1.483 -1.598 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.884 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . 2.5 ptp180 -150.57 167.89 25.89 Favored 'General case' 0 C--N 1.294 -1.822 0 O-C-N 124.074 0.859 . . . . 0.0 109.626 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.552 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 26.5 ptt180 -148.62 151.47 35.05 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.663 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.672 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 32.5 ttm180 -90.21 129.45 36.47 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.261 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' A' ' 981' ' ' SER . 84.8 mt -94.46 125.87 39.38 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 167.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.517 HG13 ' HB2' ' A' ' 983' ' ' ASP . 2.5 m -105.46 136.62 38.76 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.803 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.366 -174.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.768 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -144.24 109.75 5.2 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 124.641 1.213 . . . . 0.0 111.726 168.639 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.668 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -78.73 141.98 37.43 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -178.703 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.509 ' N ' ' HD2' ' A' 1026 ' ' LYS . 12.1 ptm180 -135.78 143.19 45.1 Favored 'General case' 0 C--O 1.201 -1.452 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -171.483 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.602 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.7 ttmt -125.9 138.53 53.79 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 123.606 0.566 . . . . 0.0 109.65 -175.261 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.666 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.7 ttmt -89.33 -22.3 22.7 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 123.285 1.517 . . . . 0.0 108.124 -178.132 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 21.6 t70 55.45 21.08 4.06 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 111.098 -2.774 . . . . 0.0 109.331 -169.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 42.8 tp 57.53 -41.54 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.849 2.059 . . . . 0.0 115.227 -174.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 9.4 t -69.15 -23.6 63.98 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 122.953 0.501 . . . . 0.0 112.32 -170.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.965 ' HB3' ' HA2' ' A' ' 972' ' ' GLY . 3.8 mt-30 -63.15 -46.21 88.24 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -175.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1034 ' ' THR . . . . . 0.548 ' OG1' ' HD3' ' A' 1029 ' ' LYS . 12.2 p -75.8 -42.93 48.58 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.402 179.397 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -57.44 -44.07 84.42 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.178 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 47.4 t -79.0 -56.94 4.01 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.743 179.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 70.0 m 56.02 72.11 0.51 Allowed 'General case' 0 C--O 1.238 0.468 0 CA-C-O 122.254 1.026 . . . . 0.0 108.602 -170.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 8.2 m -83.39 -51.54 7.3 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 114.206 -1.361 . . . . 0.0 109.043 -176.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -133.79 162.28 32.43 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.143 -177.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1040 ' ' ARG . . . . . 0.548 ' HA ' ' HG3' ' A' ' 971' ' ' PRO . 13.6 ptt180 . . . . . 0 C--N 1.312 -1.024 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 31.6 pt . . . . . 0 N--CA 1.469 0.479 0 CA-C-O 121.692 0.758 . . . . 0.0 109.893 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -94.54 143.97 27.16 Favored Pre-proline 0 C--N 1.315 -0.915 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.623 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -62.25 -17.55 57.64 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.868 2.379 . . . . 0.0 113.487 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -123.81 98.43 5.81 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 13.0 t -156.01 -38.79 0.08 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.413 0.625 . . . . 0.0 110.534 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -113.45 30.51 7.17 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 924' ' ' ASP . . . . . 0.745 ' HB3' ' HD2' ' A' ' 927' ' ' HIS . 5.9 m-20 -122.84 100.51 6.94 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 111.778 -2.465 . . . . 0.0 108.915 -169.277 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -75.51 99.51 4.25 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.245 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 51.43 43.06 51.79 Favored Glycine 0 CA--C 1.506 -0.504 0 N-CA-C 115.582 0.993 . . . . 0.0 115.582 174.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.745 ' HD2' ' HB3' ' A' ' 924' ' ' ASP . 31.0 m-70 -98.24 -167.93 1.58 Allowed 'General case' 0 CA--C 1.493 -1.249 0 N-CA-C 105.37 -2.085 . . . . 0.0 105.37 171.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 928' ' ' THR . . . . . 0.661 ' HB ' ' HB2' ' A' 1029 ' ' LYS . 1.0 OUTLIER -143.72 120.01 10.89 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 102.132 -3.285 . . . . 0.0 102.132 168.442 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.521 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.0 OUTLIER -142.16 168.36 19.92 Favored 'General case' 0 C--N 1.272 -2.783 0 C-N-CA 118.865 -1.134 . . . . 0.0 110.797 -178.375 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.642 ' O ' ' HG2' ' A' 1027 ' ' ARG . 54.7 t80 -157.19 124.7 5.31 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.638 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 17.8 m -75.42 126.85 31.84 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 118.897 0.771 . . . . 0.0 109.617 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -104.72 159.18 15.99 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 -177.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.491 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -153.42 145.01 23.31 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -174.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.469 HG22 ' H ' ' A' ' 935' ' ' TYR . 12.0 p -139.5 172.89 12.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 105.365 -2.087 . . . . 0.0 105.365 178.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.582 ' HA ' ' O ' ' A' 1021 ' ' ARG . 54.8 m-85 -132.52 138.88 47.67 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 118.7 0.682 . . . . 0.0 110.248 -174.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.616 ' O ' ' HA ' ' A' 1020 ' ' ARG . 24.3 tt0 -113.77 126.21 54.97 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -176.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 937' ' ' ASN . . . . . 0.498 ' HA ' ' O ' ' A' 1019 ' ' ARG . 19.3 p-10 -124.25 141.31 52.17 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 122.127 0.965 . . . . 0.0 113.432 178.419 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 35.8 mt-10 -115.31 158.5 22.3 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 104.972 -2.232 . . . . 0.0 104.972 171.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 36.8 m -139.62 152.58 46.9 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 119.007 0.821 . . . . 0.0 109.846 -172.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.682 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 24.6 ptt180 -156.99 160.95 39.53 Favored 'General case' 0 N--CA 1.44 -0.953 0 O-C-N 124.548 1.155 . . . . 0.0 109.499 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -78.55 161.26 70.29 Favored Pre-proline 0 C--N 1.312 -1.038 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 170.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -63.36 87.09 0.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 121.374 1.383 . . . . 0.0 111.273 172.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.22 1.93 5.17 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -176.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 944' ' ' GLY . . . . . 0.611 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -100.21 -178.68 30.19 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 109.88 -1.288 . . . . 0.0 109.88 177.064 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -108.38 163.1 13.5 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 171.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.682 ' CZ3' ' HG2' ' A' ' 940' ' ' ARG . 53.5 m95 -83.87 137.61 33.59 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 117.901 0.318 . . . . 0.0 110.756 -173.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -129.78 139.1 34.66 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 170.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.498 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 6.8 Cg_endo -50.28 123.4 11.05 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.691 2.261 . . . . 0.0 112.777 -176.151 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -52.04 151.2 3.83 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -57.3 -45.97 83.64 Favored 'General case' 0 CA--C 1.484 -1.561 0 CA-C-N 114.799 -1.091 . . . . 0.0 108.453 172.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 951' ' ' ASP . . . . . 0.45 ' HB3' ' HG2' ' A' ' 960' ' ' LYS . 52.8 m-20 -96.4 77.12 2.97 Favored 'General case' 0 N--CA 1.414 -2.267 0 N-CA-C 105.113 -2.18 . . . . 0.0 105.113 175.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 3.9 m -63.77 -41.73 97.91 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.439 -168.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 953' ' ' TYR . . . . . 0.436 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 66.9 m-85 -108.74 137.73 46.21 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 122.02 0.914 . . . . 0.0 112.18 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 4.6 p -144.87 174.47 10.97 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 125.485 1.514 . . . . 0.0 108.257 -170.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -106.07 178.69 4.49 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 173.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.47 -28.35 13.02 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -93.62 -13.16 27.96 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.934 -0.479 . . . . 0.0 111.455 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 107.33 -2.95 34.82 Favored Glycine 0 CA--C 1.491 -1.461 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.099 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -58.07 107.33 0.46 Allowed 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 960' ' ' LYS . . . . . 0.45 ' HG2' ' HB3' ' A' ' 951' ' ' ASP . 1.1 tmtp? -47.03 119.64 2.66 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 124.556 1.16 . . . . 0.0 110.169 178.565 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.45 179.59 4.07 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.047 -0.978 . . . . 0.0 110.306 -175.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 962' ' ' ALA . . . . . 0.47 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -78.4 156.37 29.5 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.813 178.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 13.0 p -76.21 161.23 75.87 Favored Pre-proline 0 N--CA 1.437 -1.096 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 178.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 964' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -61.12 -18.28 57.17 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 122.716 2.278 . . . . 0.0 112.454 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 4.2 m -74.27 -48.83 26.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 174.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 966' ' ' GLU . . . . . 0.47 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 42.4 mt-10 -65.26 -37.31 86.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.499 -1.228 . . . . 0.0 112.389 177.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.47 111.0 2.14 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.236 0.541 . . . . 0.0 110.396 -177.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 73.0 p -107.24 165.36 11.43 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.863 -176.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.605 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 9.1 p -97.81 128.6 33.57 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.705 172.347 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.62 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 61.3 Cg_endo -71.11 169.0 21.66 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.488 2.125 . . . . 0.0 110.34 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -46.91 -34.78 16.96 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.125 2.55 . . . . 0.0 114.685 -178.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.544 ' O ' ' HG2' ' A' 1029 ' ' LYS . . . -101.43 8.42 56.85 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 119.943 -1.122 . . . . 0.0 112.995 -177.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.62 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 76.1 m95 -124.2 133.47 53.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.829 0.823 . . . . 0.0 110.451 179.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.546 ' HB3' ' O ' ' A' 1028 ' ' LYS . 5.5 tp10 -126.01 119.45 27.71 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 126.563 1.945 . . . . 0.0 109.569 -173.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.67 ' CE3' ' HG2' ' A' 1025 ' ' ARG . 90.2 m95 -70.35 104.56 2.73 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 121.416 -0.802 . . . . 0.0 111.716 -178.033 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -70.49 -38.55 74.37 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.563 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 977' ' ' ASP . . . . . 0.545 ' HB2' ' HG3' ' A' 1025 ' ' ARG . 83.5 m-20 -78.46 152.67 31.98 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.269 0.557 . . . . 0.0 111.811 -176.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -88.69 107.57 19.01 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 174.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . 57.13 173.04 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 123.37 1.557 . . . . 0.0 114.405 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.459 ' HA ' ' O ' ' A' 1024 ' ' VAL . 24.5 m95 -91.2 124.09 35.15 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 112.851 -1.977 . . . . 0.0 108.08 177.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 15.1 m -124.31 155.62 38.37 Favored 'General case' 0 C--O 1.206 -1.211 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -175.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 982' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' 1022 ' ' ARG . 11.0 p90 -74.46 144.68 44.1 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 119.044 0.838 . . . . 0.0 111.206 -174.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.466 ' HB3' ' HD2' ' A' 1022 ' ' ARG . 18.0 t70 -102.67 126.16 49.66 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.633 -174.271 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.0 pp -114.86 26.5 3.69 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.111 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -109.25 27.27 9.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 123.489 1.614 . . . . 0.0 107.31 -178.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.607 ' HG2' ' H ' ' A' ' 987' ' ' ALA . 11.3 ttt180 -141.24 -178.58 5.66 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 -178.394 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.607 ' H ' ' HG2' ' A' ' 986' ' ' ARG . . . -89.0 82.0 6.75 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 119.451 1.023 . . . . 0.0 109.732 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 983' ' ' ASP . 28.3 m -128.41 -172.15 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 114.337 -1.301 . . . . 0.0 109.289 -178.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -92.9 -178.8 4.93 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 177.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -57.07 -33.45 67.27 Favored 'General case' 0 CA--C 1.494 -1.181 0 C-N-CA 123.987 0.915 . . . . 0.0 111.721 179.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -108.25 17.41 22.25 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.222 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 86.13 -23.06 10.08 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.12 -0.945 . . . . 0.0 113.588 177.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.879 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 79.0 m95 -56.25 111.68 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.695 0.759 . . . . 0.0 112.5 -177.704 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.707 ' HG3' ' CE3' ' A' 1008 ' ' TRP . 7.4 pt-20 -98.62 157.25 16.37 Favored 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 124.244 1.018 . . . . 0.0 109.944 -178.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.514 ' HB3' ' H ' ' A' 1009 ' ' VAL . 59.3 t80 -64.99 99.08 0.32 Allowed 'General case' 0 C--O 1.211 -0.953 0 CA-C-N 111.803 -2.453 . . . . 0.0 113.002 -174.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -120.9 114.93 2.75 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 119.462 -1.351 . . . . 0.0 112.573 172.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.413 ' HA ' ' H ' ' A' 1017 ' ' THR . 1.6 pt -118.57 151.84 20.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 106.131 -1.803 . . . . 0.0 106.131 174.645 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 76.7 m -133.37 97.32 3.93 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-O 122.168 0.985 . . . . 0.0 110.589 174.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.401 ' HA ' ' HD3' ' A' 1000 ' ' PRO . 77.0 mt -97.42 115.52 65.75 Favored Pre-proline 0 C--N 1.317 -0.845 0 CA-C-N 114.014 -1.448 . . . . 0.0 109.184 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 999' ' ' ILE . 27.0 Cg_exo -60.57 141.87 96.43 Favored 'Trans proline' 0 C--O 1.241 0.649 0 C-N-CA 122.82 2.347 . . . . 0.0 112.864 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1001 ' ' PRO . . . . . 0.442 ' O ' ' HB2' ' A' 1002 ' ' ASP . 9.7 Cg_endo -90.41 141.13 13.37 Favored 'Cis proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.862 -1.724 . . . . 0.0 114.365 0.12 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1002 ' ' ASP . . . . . 0.442 ' HB2' ' O ' ' A' 1001 ' ' PRO . 7.8 t0 160.17 166.59 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 111.867 -2.424 . . . . 0.0 106.521 176.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -117.04 -33.63 4.66 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 174.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 33.8 mttm -105.88 134.12 19.88 Favored Pre-proline 0 N--CA 1.429 -1.507 0 CA-C-N 114.806 -1.088 . . . . 0.0 113.463 -171.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.572 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 31.7 Cg_exo -66.26 126.28 15.43 Favored 'Trans proline' 0 C--N 1.329 -0.463 0 C-N-CA 122.775 2.317 . . . . 0.0 109.782 167.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -84.03 -57.39 3.21 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 122.217 1.008 . . . . 0.0 109.409 -177.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 3.7 m -87.5 136.01 33.11 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 112.742 -2.026 . . . . 0.0 111.608 -173.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.707 ' CE3' ' HG3' ' A' ' 994' ' ' GLU . 60.4 m95 -134.65 137.2 43.42 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.514 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 11.0 m -163.11 -173.31 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -175.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -97.3 97.6 9.28 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 175.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -165.27 167.37 18.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.426 -176.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.59 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.9 tp10 -148.2 101.24 3.25 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-O 122.066 0.936 . . . . 0.0 109.553 178.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 90.4 mttt -118.0 135.92 53.85 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 113.662 -1.608 . . . . 0.0 107.363 174.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 56.8 ttp -44.87 -22.77 0.1 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -177.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -68.01 -9.03 42.5 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 178.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.59 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 2.5 m80 -50.49 107.7 0.18 Allowed 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 123.754 0.821 . . . . 0.0 112.419 176.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1017 ' ' THR . . . . . 0.413 ' H ' ' HA ' ' A' ' 997' ' ' ILE . 2.6 m -103.21 -21.38 13.87 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.78 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 1.2 m80 -145.54 123.3 11.9 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.576 -172.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1019 ' ' ARG . . . . . 0.879 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 17.8 mmt180 -100.36 136.36 40.37 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 170.147 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.616 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 41.8 ttm180 -140.25 161.97 36.39 Favored 'General case' 0 C--O 1.197 -1.674 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 178.102 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.582 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.6 ptt180 -159.28 159.21 33.8 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 118.068 0.395 . . . . 0.0 110.257 174.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.491 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.5 ttm180 -90.6 120.99 32.13 Favored 'General case' 0 N--CA 1.424 -1.771 0 O-C-N 123.842 0.714 . . . . 0.0 109.934 177.134 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.405 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 65.7 mt -102.66 126.89 49.92 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 104.648 -2.352 . . . . 0.0 104.648 167.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 6.9 m -110.29 151.54 12.48 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.895 0 CA-C-O 122.032 0.92 . . . . 0.0 111.667 -175.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.67 ' HG2' ' CE3' ' A' ' 975' ' ' TRP . 0.6 OUTLIER -149.53 111.49 4.6 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 113.054 -1.884 . . . . 0.0 108.997 169.017 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.5 tmmm? -70.86 138.05 49.9 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.654 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 14.1 ptm180 -122.02 150.95 41.37 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 104.092 -2.559 . . . . 0.0 104.092 -173.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.546 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 71.3 tttt -144.8 132.07 20.63 Favored 'General case' 0 C--N 1.283 -2.31 0 O-C-N 123.265 0.353 . . . . 0.0 110.399 -167.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.661 ' HB2' ' HB ' ' A' ' 928' ' ' THR . 24.3 mtpp -88.58 -24.42 22.87 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 123.685 1.707 . . . . 0.0 108.049 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1030 ' ' ASP . . . . . 0.482 ' HB3' HG22 ' A' 1032 ' ' THR . 29.8 t0 50.21 10.25 0.05 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 110.895 -2.866 . . . . 0.0 112.742 -168.326 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1031 ' ' LEU . . . . . 0.411 ' H ' ' C ' ' A' 1029 ' ' LYS . 20.8 tp 60.15 13.68 4.01 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.053 1.741 . . . . 0.0 111.625 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1032 ' ' THR . . . . . 0.482 HG22 ' HB3' ' A' 1030 ' ' ASP . 13.5 t -125.55 7.07 7.59 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -174.43 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.508 ' OE1' ' HB2' ' A' ' 974' ' ' GLU . 6.0 tt0 -112.28 138.03 49.57 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.914 -177.478 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 6.3 t -50.19 95.66 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 -173.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -100.05 -37.84 8.81 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 169.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 16.8 m -97.14 84.9 3.59 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.198 -1.365 . . . . 0.0 108.769 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 15.6 m -79.63 -12.38 59.83 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.31 178.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 24.6 m -60.98 128.34 35.96 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.957 177.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -75.44 86.34 2.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.362 0.601 . . . . 0.0 111.134 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 . . . . . 0 C--N 1.314 -0.959 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 175.548 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.471 0.623 0 CA-C-O 120.993 0.425 . . . . 0.0 110.875 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 919' ' ' ASP . . . . . 0.713 ' HB3' ' HB ' ' A' ' 922' ' ' THR . 6.7 t70 -133.82 147.89 66.13 Favored Pre-proline 0 C--N 1.315 -0.902 0 N-CA-C 107.832 -1.174 . . . . 0.0 107.832 177.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -42.76 -40.54 8.07 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 123.654 2.903 . . . . 0.0 114.235 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -104.98 -41.05 5.7 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 122.246 -0.284 . . . . 0.0 110.281 177.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 922' ' ' THR . . . . . 0.713 ' HB ' ' HB3' ' A' ' 919' ' ' ASP . 92.2 m -84.45 75.47 10.25 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 122.515 1.15 . . . . 0.0 109.952 177.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -80.44 -28.09 37.78 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.877 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 924' ' ' ASP . . . . . 0.404 ' CG ' ' H ' ' A' ' 926' ' ' GLY . 15.2 t70 -130.39 143.08 50.54 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.429 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -126.87 15.19 7.45 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.122 178.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 926' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' 1031 ' ' LEU . . . 106.6 56.35 0.64 Allowed Glycine 0 CA--C 1.496 -1.144 0 N-CA-C 110.565 -1.014 . . . . 0.0 110.565 -178.607 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 65.2 m-70 -105.09 -31.63 9.08 Favored 'General case' 0 CA--C 1.499 -1.008 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.735 177.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 2.9 m 60.84 85.38 0.11 Allowed 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.962 0.887 . . . . 0.0 108.784 -167.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.906 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.6 OUTLIER -104.76 165.92 10.74 Favored 'General case' 0 C--N 1.282 -2.33 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 178.225 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.574 ' O ' ' HG2' ' A' 1027 ' ' ARG . 79.2 t80 -148.45 123.56 10.13 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 -178.098 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 21.1 m -75.97 114.76 14.96 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 173.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -93.66 163.37 13.57 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.562 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 11.9 pt-20 -162.01 145.98 12.32 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 118.64 0.655 . . . . 0.0 110.368 -171.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 5.8 p -155.43 128.31 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.537 0.684 . . . . 0.0 111.381 172.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.653 ' HA ' ' O ' ' A' 1021 ' ' ARG . 70.1 m-85 -90.32 113.38 25.23 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.518 ' O ' ' HA ' ' A' 1020 ' ' ARG . 16.3 tt0 -79.52 128.62 33.59 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.792 171.257 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 937' ' ' ASN . . . . . 0.454 HD22 ' N ' ' A' ' 937' ' ' ASN . 0.5 OUTLIER -117.89 146.58 43.82 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 123.501 0.72 . . . . 0.0 109.907 -177.987 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.61 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 38.4 mt-10 -129.07 172.11 11.72 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 171.01 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 27.1 t -152.08 136.76 17.0 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 118.529 0.604 . . . . 0.0 110.622 -175.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.701 HH21 ' HB2' ' A' 1016 ' ' HIS . 22.4 ptt180 -136.85 159.63 41.3 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 176.413 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -81.21 166.92 35.56 Favored Pre-proline 0 C--N 1.308 -1.227 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 171.159 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 942' ' ' PRO . . . . . 0.453 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 15.6 Cg_exo -69.66 86.69 0.56 Allowed 'Trans proline' 0 N--CA 1.452 -0.948 0 N-CA-C 108.988 -1.197 . . . . 0.0 108.988 170.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.13 8.18 3.41 Favored Glycine 0 N--CA 1.436 -1.352 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 -173.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 944' ' ' GLY . . . . . 0.515 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -117.89 -179.26 17.32 Favored Glycine 0 CA--C 1.503 -0.713 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -112.02 158.28 19.74 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 119.822 1.811 . . . . 0.0 107.012 172.589 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.61 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 28.9 m95 -67.35 138.69 56.96 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-O 121.392 0.615 . . . . 0.0 110.798 -174.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -129.12 179.31 1.33 Allowed Pre-proline 0 C--N 1.302 -1.498 0 N-CA-C 101.412 -3.551 . . . . 0.0 101.412 174.236 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.9 144.48 99.57 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 CA-C-N 123.243 2.194 . . . . 0.0 111.406 177.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.94 -170.09 0.1 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.481 0.658 . . . . 0.0 110.818 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.518 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.0 OUTLIER -90.62 -35.74 14.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 -177.935 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -123.28 100.15 6.7 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 104.556 -2.387 . . . . 0.0 104.556 168.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 27.6 m -69.13 -59.45 3.02 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -173.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -96.0 128.25 42.73 Favored 'General case' 0 C--N 1.313 -0.99 0 O-C-N 121.277 -0.889 . . . . 0.0 109.719 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 18.1 p -148.89 -178.05 6.14 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.705 0.764 . . . . 0.0 111.352 -168.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -108.3 168.49 9.27 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 104.314 -2.476 . . . . 0.0 104.314 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.38 -30.88 31.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 119.153 0.888 . . . . 0.0 111.114 174.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -78.54 -8.34 58.47 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 95.07 -4.75 68.02 Favored Glycine 0 CA--C 1.501 -0.799 0 C-N-CA 120.263 -0.97 . . . . 0.0 112.224 178.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -62.08 102.25 0.27 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 960' ' ' LYS . . . . . 0.412 ' HD3' ' C ' ' A' ' 960' ' ' LYS . 12.5 tmtt? -50.68 122.78 7.74 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.571 1.17 . . . . 0.0 109.438 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.24 -173.2 2.41 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.317 -178.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 962' ' ' ALA . . . . . 0.619 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -78.9 152.94 30.89 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 177.493 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.3 m -79.05 157.7 75.68 Favored Pre-proline 0 C--N 1.315 -0.892 0 N-CA-C 107.435 -1.321 . . . . 0.0 107.435 178.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.582 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 7.5 Cg_exo -49.18 -24.89 8.66 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.586 2.857 . . . . 0.0 115.653 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.8 t -80.24 -43.34 21.58 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 177.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 966' ' ' GLU . . . . . 0.619 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 46.2 mm-40 -64.87 -32.2 73.79 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.768 175.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.484 HD13 ' CH2' ' A' ' 980' ' ' TRP . 83.6 mt -68.59 118.55 11.76 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 175.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 10.0 p -126.14 -175.39 3.35 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.126 -171.167 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.663 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 25.9 p -109.99 124.94 32.2 Favored Pre-proline 0 N--CA 1.435 -1.189 0 O-C-N 121.905 -0.497 . . . . 0.0 110.457 177.344 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.662 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 98.1 Cg_endo -77.04 173.24 14.77 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 122.908 2.405 . . . . 0.0 110.713 174.034 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -41.93 -48.64 6.02 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 124.271 3.314 . . . . 0.0 115.451 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.462 ' O ' ' HA ' ' A' 1029 ' ' LYS . . . -101.38 14.01 58.21 Favored Glycine 0 N--CA 1.439 -1.102 0 C-N-CA 120.141 -1.028 . . . . 0.0 113.584 -175.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.663 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 88.5 m95 -119.95 121.4 38.91 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 118.437 1.118 . . . . 0.0 111.71 179.342 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.464 ' HB2' ' OE1' ' A' 1033 ' ' GLN . 7.5 tp10 -110.08 127.69 55.01 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 126.602 1.961 . . . . 0.0 109.585 -172.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -70.77 106.89 3.73 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.722 0.772 . . . . 0.0 112.393 174.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 976' ' ' GLU . . . . . 0.449 ' H ' ' HA ' ' A' 1027 ' ' ARG . 5.5 tp10 -72.15 -47.11 53.41 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 172.535 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 977' ' ' ASP . . . . . 0.785 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 3.6 m-20 -87.41 160.6 18.26 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.704 -1.135 . . . . 0.0 112.229 -178.551 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -91.13 -53.32 4.41 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -168.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -148.32 132.67 17.53 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -173.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.582 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 17.1 m95 -61.11 123.1 16.69 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 123.989 0.805 . . . . 0.0 109.806 -172.548 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 49.8 p -122.8 156.02 35.38 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -177.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 982' ' ' TYR . . . . . 0.485 ' HB3' ' HD2' ' A' 1021 ' ' ARG . 0.0 OUTLIER -72.47 140.84 48.49 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.334 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.53 ' HB2' HG13 ' A' 1024 ' ' VAL . 52.6 t0 -91.16 130.5 37.04 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.832 -1.077 . . . . 0.0 111.117 -171.056 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.1 pp -115.59 14.25 7.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.501 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 985' ' ' ASN . . . . . 0.593 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 3.5 t-20 -97.37 16.45 20.07 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.009 0.909 . . . . 0.0 109.146 -176.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.593 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 7.6 mpt_? -139.87 179.75 6.42 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -175.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.85 86.2 3.43 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.691 0.758 . . . . 0.0 110.768 179.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 18.2 m -125.73 -179.23 2.37 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 114.933 -1.03 . . . . 0.0 109.39 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -73.67 177.82 5.17 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -64.82 -28.14 69.36 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 118.725 0.693 . . . . 0.0 111.768 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 57.3 mttt -85.87 -57.42 3.05 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 141.08 71.79 0.03 OUTLIER Glycine 0 CA--C 1.498 -1.013 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.667 177.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -145.6 140.79 27.63 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -99.93 160.08 14.59 Favored 'General case' 0 C--O 1.252 1.235 0 CA-C-N 118.944 0.793 . . . . 0.0 109.996 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.729 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 21.6 t80 -83.65 99.36 10.16 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 127.412 2.285 . . . . 0.0 109.547 -176.078 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 996' ' ' GLY . . . . . 0.521 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -120.97 120.95 4.65 Favored Glycine 0 N--CA 1.433 -1.505 0 C-N-CA 119.005 -1.569 . . . . 0.0 110.741 175.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.566 HG22 ' HA ' ' A' 1016 ' ' HIS . 13.8 pt -127.47 143.17 41.52 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 C-N-CA 118.579 -1.248 . . . . 0.0 109.148 177.019 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.7 t -146.1 155.63 42.89 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 20.5 pt -116.6 107.91 45.92 Favored Pre-proline 0 C--N 1.315 -0.927 0 C-N-CA 119.931 -0.708 . . . . 0.0 110.865 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -69.13 136.6 35.11 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.497 2.131 . . . . 0.0 112.556 -178.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -87.15 150.35 38.57 Favored 'Cis proline' 0 N--CA 1.45 -1.035 0 C-N-CA 122.938 -1.692 . . . . 0.0 112.816 -1.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 25.0 t70 -165.0 -86.68 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 113.336 -1.756 . . . . 0.0 107.707 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -178.5 -81.14 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 63.3 mttm -144.19 160.42 49.06 Favored Pre-proline 0 C--N 1.317 -0.811 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.614 ' HG2' ' HB2' ' A' 1018 ' ' HIS . 36.1 Cg_exo -58.5 144.34 97.04 Favored 'Trans proline' 0 C--O 1.241 0.675 0 C-N-CA 122.433 2.089 . . . . 0.0 110.882 169.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 39.8 mmtt -98.85 -48.18 5.01 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 -177.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 3.4 m -89.06 139.14 30.76 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 111.724 -2.489 . . . . 0.0 111.406 -173.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.636 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 61.8 m95 -135.11 132.64 38.34 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 175.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 37.1 t -142.11 170.04 12.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 -169.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -90.53 97.99 11.51 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 119.619 1.099 . . . . 0.0 108.274 172.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1011 ' ' ALA . . . . . 0.416 ' HB3' ' CD2' ' A' ' 995' ' ' TYR . . . -177.08 177.26 1.28 Allowed 'General case' 0 C--O 1.238 0.492 0 C-N-CA 122.81 0.444 . . . . 0.0 109.862 -176.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1012 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -169.48 110.62 0.46 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.505 ' H ' ' CD2' ' A' 1016 ' ' HIS . 76.3 mttt -122.34 150.81 41.87 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.384 -1.28 . . . . 0.0 108.756 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 24.2 ttt -53.43 -36.26 61.35 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1015 ' ' TYR . . . . . 0.453 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 59.7 m-85 -72.85 14.21 0.3 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.03 0.532 . . . . 0.0 111.62 -179.244 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 995' ' ' TYR . 0.2 OUTLIER -63.45 176.38 0.84 Allowed 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 121.863 0.84 . . . . 0.0 110.12 171.032 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 1017 ' ' THR . . . . . 0.644 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.7 OUTLIER -163.41 -31.04 0.04 OUTLIER 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.006 -1.452 . . . . 0.0 108.793 -168.236 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 1018 ' ' HIS . . . . . 0.614 ' HB2' ' HG2' ' A' 1005 ' ' PRO . 59.7 m80 -145.56 155.87 43.33 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.416 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -154.66 152.52 30.06 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 105.863 -1.903 . . . . 0.0 105.863 176.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.518 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 3.8 ptp180 -151.65 165.58 33.9 Favored 'General case' 0 C--O 1.195 -1.805 0 C-N-CA 118.418 -1.313 . . . . 0.0 109.837 178.188 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.653 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.3 ptt180 -149.17 145.71 27.3 Favored 'General case' 0 C--N 1.289 -2.05 0 C-N-CA 119.471 -0.891 . . . . 0.0 109.64 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.562 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.7 ttm180 -85.91 114.99 23.26 Favored 'General case' 0 N--CA 1.424 -1.749 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.509 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 65.6 mt -84.67 123.31 30.22 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 103.603 -2.74 . . . . 0.0 103.603 167.284 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.53 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.3 m -102.3 149.41 6.89 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.92 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -176.129 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.785 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -152.34 110.0 3.62 Favored 'General case' 0 C--N 1.289 -2.048 0 O-C-N 125.138 1.524 . . . . 0.0 111.542 166.558 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.437 ' HD2' ' N ' ' A' 1027 ' ' ARG . 2.7 tmmm? -84.35 146.42 27.71 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -176.432 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 12.2 ptm180 -142.98 179.9 6.76 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 104.643 -2.355 . . . . 0.0 104.643 -170.531 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.906 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 14.1 ptpt -162.56 155.58 19.83 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 118.648 0.658 . . . . 0.0 109.767 178.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 972' ' ' GLY . 33.1 ttmt -91.24 -12.56 34.86 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.166 0.984 . . . . 0.0 109.953 -172.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 33.9 t70 60.03 19.44 8.58 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.208 -1.815 . . . . 0.0 108.734 -175.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1031 ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' A' ' 926' ' ' GLY . 37.3 tp 62.33 -29.46 0.08 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.865 2.066 . . . . 0.0 115.196 -179.097 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 13.4 t -136.41 19.87 3.14 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 119.508 1.049 . . . . 0.0 110.106 -169.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.464 ' OE1' ' HB2' ' A' ' 974' ' ' GLU . 18.5 tt0 -75.94 -20.76 57.69 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.559 0.695 . . . . 0.0 110.561 -179.027 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 1.5 m -83.57 111.0 18.7 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -57.82 122.22 12.36 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.542 0.526 . . . . 0.0 110.742 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 16.0 m -95.65 -33.81 12.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 52.4 m -114.44 127.77 56.0 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.937 176.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 20.3 m -117.49 107.89 14.86 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -99.03 172.67 7.25 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.244 -0.435 . . . . 0.0 109.94 -179.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 . . . . . 0 C--N 1.315 -0.914 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.452 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 918' ' ' ILE . . . . . 0.414 HD12 ' HE2' ' A' ' 921' ' ' PHE . 27.0 pt . . . . . 0 N--CA 1.473 0.685 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -94.43 154.38 40.26 Favored Pre-proline 0 C--N 1.31 -1.134 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -64.31 95.72 0.22 Allowed 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.705 2.27 . . . . 0.0 111.816 178.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 921' ' ' PHE . . . . . 0.414 ' HE2' HD12 ' A' ' 918' ' ' ILE . 95.4 m-85 -62.34 -41.01 98.23 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.017 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 5.7 m -101.93 -9.23 20.86 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.082 -173.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . 67.33 111.16 0.04 OUTLIER 'General case' 0 C--O 1.237 0.422 0 CA-C-O 122.023 0.916 . . . . 0.0 108.536 -172.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -91.31 101.91 14.61 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 122.129 0.966 . . . . 0.0 111.304 -173.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -102.52 -150.99 0.42 Allowed 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 171.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -77.98 79.62 1.43 Allowed Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.204 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -127.74 132.31 49.58 Favored 'General case' 0 CA--C 1.487 -1.478 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.483 176.104 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 928' ' ' THR . . . . . 0.452 ' OG1' ' HB3' ' A' 1029 ' ' LYS . 0.5 OUTLIER -91.34 113.29 25.52 Favored 'General case' 0 N--CA 1.415 -2.213 0 N-CA-C 104.809 -2.293 . . . . 0.0 104.809 160.555 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.644 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.4 OUTLIER -129.28 129.62 45.14 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 176.866 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -121.64 135.14 54.99 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -179.184 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 26.0 m -71.16 123.06 21.3 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 177.279 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -98.54 156.53 16.74 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 104.651 -2.351 . . . . 0.0 104.651 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.799 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.1 pt-20 -154.93 159.21 40.26 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 118.209 0.459 . . . . 0.0 110.672 -170.708 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.443 HG12 ' CZ3' ' A' ' 980' ' ' TRP . 7.7 p -158.77 131.37 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 170.455 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.456 ' HA ' ' O ' ' A' 1021 ' ' ARG . 37.7 m-85 -82.3 150.19 27.38 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 122.284 1.04 . . . . 0.0 111.063 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.504 ' O ' ' HA ' ' A' 1020 ' ' ARG . 23.8 tt0 -126.12 125.42 42.49 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 -179.352 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 937' ' ' ASN . . . . . 0.984 ' HB3' ' HG2' ' A' 1020 ' ' ARG . 13.6 p-10 -124.1 145.68 49.11 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.787 0.804 . . . . 0.0 111.398 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.594 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 18.8 mt-10 -139.13 153.3 47.96 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 -178.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 15.2 m -136.37 149.55 48.39 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 121.168 0.509 . . . . 0.0 111.544 -172.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.591 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 20.2 ptt180 -146.62 161.34 40.74 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 114.14 -1.391 . . . . 0.0 108.343 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -66.89 158.76 79.33 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 170.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 942' ' ' PRO . . . . . 0.58 ' HG3' HG23 ' A' 1017 ' ' THR . 36.9 Cg_exo -61.13 85.85 0.09 OUTLIER 'Trans proline' 0 C--O 1.237 0.458 0 CA-C-N 120.687 1.281 . . . . 0.0 110.39 172.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 110.03 73.52 0.75 Allowed Glycine 0 N--CA 1.434 -1.457 0 N-CA-C 106.74 -2.544 . . . . 0.0 106.74 -173.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -166.34 -144.89 4.25 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 119.721 -1.228 . . . . 0.0 113.65 -172.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -128.91 123.6 33.02 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.417 -0.892 . . . . 0.0 110.639 -172.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.594 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 64.3 m95 -73.84 136.44 43.48 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 -178.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -142.34 163.16 41.12 Favored Pre-proline 0 C--N 1.295 -1.763 0 N-CA-C 102.791 -3.04 . . . . 0.0 102.791 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -49.2 137.06 30.52 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.851 1.7 . . . . 0.0 113.575 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.38 -172.7 0.08 Allowed 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.349 175.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.54 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.1 OUTLIER -84.36 -35.91 22.86 Favored 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 -178.452 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 951' ' ' ASP . . . . . 0.503 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 53.4 m-20 -123.03 97.45 5.44 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 170.382 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 25.7 m -61.16 -49.67 76.3 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -170.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -102.73 126.17 49.74 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.026 0.917 . . . . 0.0 111.783 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 10.6 p -135.16 165.59 25.05 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.702 -174.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 955' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 24.6 t70 -91.19 170.05 10.33 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 172.516 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.93 -29.88 22.05 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.101 0.864 . . . . 0.0 112.635 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -96.02 13.05 28.33 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 70.67 49.39 30.32 Favored Glycine 0 CA--C 1.484 -1.898 0 C-N-CA 121.061 -0.59 . . . . 0.0 111.711 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 959' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 16.8 t70 -107.73 109.43 21.02 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 103.617 -2.734 . . . . 0.0 103.617 177.296 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 960' ' ' LYS . . . . . 0.503 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 20.9 tptm -45.16 113.54 0.59 Allowed 'General case' 0 C--N 1.312 -1.027 0 O-C-N 124.6 1.188 . . . . 0.0 111.276 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.11 176.02 5.41 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.002 -176.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 962' ' ' ALA . . . . . 0.512 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -80.5 159.88 25.41 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.2 m -86.87 159.02 52.67 Favored Pre-proline 0 N--CA 1.433 -1.304 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.624 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 15.4 Cg_exo -46.57 -26.77 4.58 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 124.225 3.283 . . . . 0.0 115.608 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.9 t -71.93 -49.22 39.46 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 966' ' ' GLU . . . . . 0.512 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 1.5 mp0 -64.56 -33.15 75.25 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.15 0.5 . . . . 0.0 110.181 176.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.448 ' HB2' ' HA ' ' A' ' 964' ' ' PRO . 73.5 mt -64.89 110.96 2.61 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.978 0.894 . . . . 0.0 109.591 178.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.09 179.21 5.88 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.141 -173.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.508 ' HB3' ' NE1' ' A' ' 975' ' ' TRP . 25.0 p -94.74 136.87 22.65 Favored Pre-proline 0 C--N 1.321 -0.632 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.974 -176.276 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.601 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 44.7 Cg_endo -84.78 167.66 11.24 Favored 'Trans proline' 0 C--O 1.241 0.641 0 C-N-CA 122.977 2.452 . . . . 0.0 110.731 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 971' ' ' PRO . . . . . 0.595 ' HB2' ' HB2' ' A' 1035 ' ' ALA . 14.9 Cg_exo -67.01 103.96 0.79 Allowed 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 121.607 1.538 . . . . 0.0 110.289 175.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.514 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 124.59 -2.23 8.74 Favored Glycine 0 N--CA 1.438 -1.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.92 -177.14 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.601 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 94.5 m95 -133.98 130.75 38.08 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 122.035 0.921 . . . . 0.0 111.255 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 974' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -117.24 131.41 56.85 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 126.586 1.954 . . . . 0.0 109.602 -170.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.581 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 91.9 m95 -83.95 156.74 22.18 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.571 177.337 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -140.11 -36.36 0.49 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.183 -178.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -68.15 146.52 53.35 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.507 178.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.55 -43.63 80.22 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -177.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.73 168.51 12.43 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -176.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.624 ' CD1' ' HB3' ' A' ' 964' ' ' PRO . 45.2 m95 -70.07 118.37 12.81 Favored 'General case' 0 C--N 1.309 -1.159 0 O-C-N 124.435 1.085 . . . . 0.0 108.446 -179.349 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 981' ' ' SER . . . . . 0.687 ' O ' ' HA ' ' A' 1023 ' ' LEU . 21.0 m -110.3 -161.0 0.73 Allowed 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 104.853 -2.277 . . . . 0.0 104.853 -173.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 982' ' ' TYR . . . . . 0.416 ' HB2' ' HA3' ' A' ' 992' ' ' GLY . 15.4 p90 -119.75 153.06 36.24 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 121.669 2.031 . . . . 0.0 109.697 177.089 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.523 ' HB2' ' HD2' ' A' 1022 ' ' ARG . 20.8 t70 -83.28 114.95 21.75 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.719 0.771 . . . . 0.0 111.063 -173.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.436 ' HA ' HG21 ' A' ' 988' ' ' VAL . 23.4 pt -107.1 -157.89 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.649 176.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 10.1 t30 49.79 44.01 24.85 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.923 1.344 . . . . 0.0 108.589 -172.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.45 ' HD3' ' CG1' ' A' ' 988' ' ' VAL . 52.4 ttt85 -153.43 -179.71 8.01 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 -172.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.409 ' H ' ' HG2' ' A' ' 986' ' ' ARG . . . -87.95 69.82 9.42 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.832 -1.174 . . . . 0.0 107.832 176.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.45 ' CG1' ' HD3' ' A' ' 986' ' ' ARG . 24.1 m -122.79 150.66 26.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.67 -1.15 . . . . 0.0 113.154 -173.573 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 989' ' ' ASP . . . . . 0.453 ' HB3' ' HB2' ' A' ' 993' ' ' TRP . 23.8 t70 -55.25 171.68 0.16 Allowed 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 113.271 -1.786 . . . . 0.0 110.751 168.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.53 -34.01 47.89 Favored 'General case' 0 CA--C 1.499 -0.991 0 C-N-CA 123.669 0.788 . . . . 0.0 111.304 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 991' ' ' LYS . . . . . 0.543 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 71.3 mmtt -106.46 16.92 24.07 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.347 -174.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 992' ' ' GLY . . . . . 0.416 ' HA3' ' HB2' ' A' ' 982' ' ' TYR . . . 93.69 -11.1 71.79 Favored Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.586 173.296 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.623 ' CG ' ' HD3' ' A' 1019 ' ' ARG . 97.1 m95 -59.93 153.31 21.45 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.384 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -137.49 152.38 49.47 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-N 115.238 -0.892 . . . . 0.0 112.252 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.693 ' HD2' ' HB ' ' A' 1009 ' ' VAL . 0.3 OUTLIER -62.32 99.85 0.15 Allowed 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 113.429 -1.714 . . . . 0.0 111.853 -178.267 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 996' ' ' GLY . . . . . 0.509 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -117.91 84.36 0.37 Allowed Glycine 0 CA--C 1.49 -1.497 0 C-N-CA 118.964 -1.589 . . . . 0.0 111.829 172.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.772 ' O ' ' HA ' ' A' 1005 ' ' PRO . 2.3 tt -92.4 131.79 38.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 O-C-N 121.581 -0.953 . . . . 0.0 109.806 -176.093 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 29.4 m -131.23 110.93 11.48 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 61.0 mt -117.81 119.46 33.87 Favored Pre-proline 0 C--N 1.314 -0.975 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.489 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 44.9 Cg_exo -58.53 144.62 96.88 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 122.816 2.344 . . . . 0.0 112.145 177.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1001 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 12.2 Cg_endo -90.86 127.22 6.48 Favored 'Cis proline' 0 N--CA 1.445 -1.341 0 C-N-CA 123.279 -1.55 . . . . 0.0 112.805 -1.017 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 49.3 t0 156.8 141.7 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 110.878 -2.874 . . . . 0.0 105.84 -176.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.0 p80 -125.43 41.95 3.4 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 122.997 1.38 . . . . 0.0 108.7 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 59.1 mttp -138.5 139.42 24.7 Favored Pre-proline 0 N--CA 1.434 -1.257 0 CA-C-N 112.915 -1.948 . . . . 0.0 107.441 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.772 ' HA ' ' O ' ' A' ' 997' ' ' ILE . 81.5 Cg_exo -57.23 170.38 1.66 Allowed 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.234 1.956 . . . . 0.0 113.081 167.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -110.16 -46.33 3.46 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.85 -173.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 13.4 t -160.81 147.23 15.09 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -174.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1008 ' ' TRP . . . . . . . . . . . . . 42.8 m95 -112.83 124.33 52.36 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.693 ' HB ' ' HD2' ' A' ' 995' ' ' TYR . 46.3 t -143.88 161.62 15.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 -169.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -93.34 -1.2 56.21 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.835 0.35 . . . . 0.0 111.483 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1011 ' ' ALA . . . . . 0.515 ' H ' HG12 ' A' 1009 ' ' VAL . . . -101.08 116.5 32.99 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.158 0.504 . . . . 0.0 111.045 -175.322 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.41 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 42.9 tp10 -71.36 114.99 10.0 Favored 'General case' 0 N--CA 1.439 -1.025 0 CA-C-O 122.226 1.012 . . . . 0.0 111.033 177.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.484 ' H ' ' CE1' ' A' 1016 ' ' HIS . 66.4 mttm -120.59 147.92 44.57 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 113.985 -1.461 . . . . 0.0 108.51 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 54.8 ttp -51.13 -37.43 46.08 Favored 'General case' 0 C--N 1.307 -1.28 0 O-C-N 124.091 0.869 . . . . 0.0 112.799 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -55.11 -12.14 0.84 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.665 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 26.5 m80 -58.19 109.76 0.82 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.071 0.463 . . . . 0.0 111.833 175.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1017 ' ' THR . . . . . 0.58 HG23 ' HG3' ' A' ' 942' ' ' PRO . 0.0 OUTLIER -97.63 -31.34 12.34 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 123.268 1.508 . . . . 0.0 109.319 175.62 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 1018 ' ' HIS . . . . . 0.509 ' HB2' ' O ' ' A' ' 996' ' ' GLY . 30.4 m170 -136.41 155.93 49.33 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 113.774 -1.557 . . . . 0.0 108.162 -176.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1019 ' ' ARG . . . . . 0.623 ' HD3' ' CG ' ' A' ' 993' ' ' TRP . 11.3 ttm180 -153.08 139.37 18.47 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 177.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.984 ' HG2' ' HB3' ' A' ' 937' ' ' ASN . 95.9 mtt180 -134.05 166.02 23.7 Favored 'General case' 0 CA--C 1.481 -1.69 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -177.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.602 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 24.5 ptt180 -155.74 153.47 29.94 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 124.23 0.956 . . . . 0.0 108.616 168.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.799 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 34.4 ttm180 -86.52 120.75 28.18 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 176.142 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.687 ' HA ' ' O ' ' A' ' 981' ' ' SER . 77.6 mt -86.71 129.45 34.87 Favored 'General case' 0 N--CA 1.423 -1.791 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 169.095 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.456 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 14.1 m -108.3 135.26 47.61 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 CA-C-O 121.419 0.628 . . . . 0.0 112.397 -172.307 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.464 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.3 tpt180 -142.98 97.63 3.13 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 170.45 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.565 ' HD3' ' HB2' ' A' ' 929' ' ' GLU . 0.0 OUTLIER -74.65 152.79 39.15 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 -179.607 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.581 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 8.1 ptm180 -142.18 166.58 24.31 Favored 'General case' 0 CA--C 1.496 -1.098 0 N-CA-C 106.255 -1.757 . . . . 0.0 106.255 -171.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.644 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 13.6 ptpt -155.19 152.74 29.74 Favored 'General case' 0 C--O 1.196 -1.727 0 CA-C-O 121.042 0.449 . . . . 0.0 110.842 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.514 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 36.9 ttmt -91.39 -21.28 21.07 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 -178.089 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 14.3 t70 46.97 27.53 0.74 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 111.175 -2.738 . . . . 0.0 110.411 -169.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 34.8 tp 70.82 -47.52 0.65 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.332 1.853 . . . . 0.0 114.005 177.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 11.3 t -90.55 14.82 12.13 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -170.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -119.06 113.78 21.47 Favored 'General case' 0 C--O 1.216 -0.692 0 O-C-N 121.237 -0.914 . . . . 0.0 110.833 175.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1034 ' ' THR . . . . . 0.458 ' OG1' ' HB2' ' A' 1037 ' ' SER . 37.2 p -137.53 -179.37 5.7 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 175.354 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1035 ' ' ALA . . . . . 0.595 ' HB2' ' HB2' ' A' ' 971' ' ' PRO . . . -92.61 -39.12 11.5 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 177.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 50.6 m -77.95 -38.69 44.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.198 -0.91 . . . . 0.0 112.812 -177.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1037 ' ' SER . . . . . 0.458 ' HB2' ' OG1' ' A' 1034 ' ' THR . 74.4 m -85.59 85.01 7.44 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 122.235 1.017 . . . . 0.0 111.674 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 15.5 p -83.55 -42.53 16.7 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 174.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -134.17 -36.53 0.9 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.409 -1.269 . . . . 0.0 110.19 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 . . . . . 0 C--O 1.241 0.648 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.504 179.812 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 34.3 pt . . . . . 0 N--CA 1.472 0.626 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -97.59 107.05 37.19 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -98.11 -178.96 0.31 Allowed 'Trans proline' 0 N--CA 1.448 -1.15 0 C-N-CA 122.818 2.345 . . . . 0.0 112.813 -178.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -99.16 -22.92 15.43 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 174.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 5.4 m -78.13 84.18 4.38 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.162 175.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -142.3 133.7 26.44 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 924' ' ' ASP . . . . . 0.564 ' HB2' ' H ' ' A' ' 927' ' ' HIS . 2.3 p-10 -138.26 150.48 46.72 Favored 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.086 -173.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -91.23 -32.25 15.84 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 170.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -178.74 46.46 0.09 OUTLIER Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 114.29 -1.323 . . . . 0.0 112.518 174.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.564 ' H ' ' HB2' ' A' ' 924' ' ' ASP 0.259 0.6 OUTLIER -117.35 140.43 49.58 Favored 'General case' 0 CA--C 1.492 -1.277 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 174.335 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.66 122.91 35.55 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 163.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.438 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.1 OUTLIER -139.19 137.86 36.4 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 170.758 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.419 ' O ' ' HG2' ' A' 1027 ' ' ARG . 91.8 t80 -136.19 140.62 43.71 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.689 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 28.0 m -72.2 129.65 38.95 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 118.673 0.67 . . . . 0.0 112.108 178.257 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -100.19 160.56 14.23 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 105.989 -1.856 . . . . 0.0 105.989 177.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -158.94 145.24 16.84 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.323 0.582 . . . . 0.0 110.961 -171.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.552 HG11 ' HG3' ' A' ' 964' ' ' PRO . 14.6 p -141.02 171.47 12.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 177.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.426 ' H ' HG22 ' A' ' 934' ' ' VAL . 83.5 m-85 -127.89 143.13 51.11 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -176.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.615 ' O ' ' HA ' ' A' 1020 ' ' ARG . 16.9 tt0 -117.65 118.21 31.49 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.397 179.265 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -95.89 126.17 40.96 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 124.365 1.041 . . . . 0.0 111.288 -178.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.527 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 47.8 mt-10 -121.27 154.38 36.42 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 169.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 33.8 m -144.84 158.19 43.89 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.566 -0.853 . . . . 0.0 110.727 -173.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.498 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 28.7 ptt180 -151.64 159.58 43.98 Favored 'General case' 0 N--CA 1.427 -1.598 0 O-C-N 124.57 1.169 . . . . 0.0 108.612 178.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -76.51 166.85 41.68 Favored Pre-proline 0 C--N 1.309 -1.185 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.73 74.36 1.28 Allowed 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 121.359 1.373 . . . . 0.0 111.212 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 139.86 8.14 0.94 Allowed Glycine 0 CA--C 1.528 0.86 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 -176.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 944' ' ' GLY . . . . . 0.493 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -101.43 -166.33 27.54 Favored Glycine 0 C--N 1.336 0.538 0 N-CA-C 111.071 -0.811 . . . . 0.0 111.071 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -125.61 159.9 31.0 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.588 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 45.5 m95 -73.53 129.76 38.65 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 122.127 0.965 . . . . 0.0 110.304 -175.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 947' ' ' LYS . . . . . 0.409 ' HA ' ' HD3' ' A' ' 948' ' ' PRO . 17.8 pttp -146.39 138.45 13.55 Favored Pre-proline 0 C--N 1.287 -2.15 0 N-CA-C 103.627 -2.731 . . . . 0.0 103.627 172.339 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' A' ' 938' ' ' GLU . 80.2 Cg_exo -49.87 124.6 12.78 Favored 'Trans proline' 0 C--O 1.239 0.548 0 C-N-CA 123.148 2.565 . . . . 0.0 114.733 -169.719 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -52.44 -177.49 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.231 169.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -102.61 -0.08 32.49 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 115.883 -2.327 . . . . 0.0 109.215 -163.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 951' ' ' ASP . . . . . 0.511 ' HB3' ' HG3' ' A' ' 960' ' ' LYS . 20.3 m-20 -132.63 82.92 2.03 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 103.018 -2.956 . . . . 0.0 103.018 169.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.0 m -69.31 -37.04 77.57 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.342 -167.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -109.12 131.01 55.48 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.531 0.681 . . . . 0.0 112.204 -176.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 42.5 p -145.54 178.81 7.85 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.842 -169.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -99.19 171.5 7.97 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 176.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.01 -31.88 31.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 118.335 0.516 . . . . 0.0 111.231 174.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -81.21 -15.23 56.28 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.065 0.46 . . . . 0.0 112.037 177.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 101.64 -4.32 53.76 Favored Glycine 0 CA--C 1.497 -1.064 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.458 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.87 102.5 0.08 Allowed 'General case' 0 CA--C 1.503 -0.829 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 960' ' ' LYS . . . . . 0.511 ' HG3' ' HB3' ' A' ' 951' ' ' ASP . 5.3 tmmm? -51.65 130.69 28.86 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 124.432 1.082 . . . . 0.0 109.571 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -130.54 175.73 8.75 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.014 -0.993 . . . . 0.0 109.484 -173.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 962' ' ' ALA . . . . . 0.425 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -64.18 144.44 57.12 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 176.005 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.0 m -68.91 159.42 82.72 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -178.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.584 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 51.8 Cg_exo -52.65 -21.66 15.21 Favored 'Trans proline' 0 N--CA 1.48 0.733 0 C-N-CA 123.865 3.043 . . . . 0.0 114.705 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 5.2 p -70.94 -53.45 14.93 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 966' ' ' GLU . . . . . 0.425 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 3.0 mp0 -68.84 -24.8 64.4 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.297 176.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.572 ' HB2' ' HA ' ' A' ' 964' ' ' PRO . 37.3 mt -63.56 111.37 2.33 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.206 1.003 . . . . 0.0 108.68 175.248 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 2.7 p -130.08 169.52 15.2 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.85 -171.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 15.8 p -87.15 143.07 34.17 Favored Pre-proline 0 C--N 1.313 -0.985 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.981 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.573 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 96.8 Cg_endo -75.09 175.61 11.01 Favored 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 122.703 2.269 . . . . 0.0 110.017 174.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.61 -45.4 41.31 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.928 1.752 . . . . 0.0 114.272 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 972' ' ' GLY . . . . . . . . . . . . . . . -76.56 -45.4 13.72 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.073 -1.06 . . . . 0.0 112.779 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.573 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 97.5 m95 -76.82 145.15 38.63 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 -179.356 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.521 ' HB3' ' O ' ' A' 1028 ' ' LYS . 4.6 tp10 -125.59 149.78 48.08 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 -179.009 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.603 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 94.6 m95 -86.07 156.33 20.45 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 120.495 -1.378 . . . . 0.0 111.594 172.249 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -120.42 -44.98 2.45 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 977' ' ' ASP . . . . . 0.572 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.0 OUTLIER -78.75 157.14 28.56 Favored 'General case' 0 CA--C 1.499 -1.018 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.914 -176.629 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -88.62 110.05 20.61 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.863 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 979' ' ' ALA . . . . . 0.519 ' C ' ' HD3' ' A' 1025 ' ' ARG . . . 57.51 176.77 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 O-C-N 125.223 1.577 . . . . 0.0 113.71 174.778 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.584 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 36.9 m95 -89.53 120.66 31.02 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 113.905 -1.498 . . . . 0.0 107.291 176.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 36.7 m -125.64 145.28 50.22 Favored 'General case' 0 C--N 1.295 -1.77 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 -176.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -73.21 135.03 44.52 Favored 'General case' 0 C--N 1.301 -1.536 0 CA-C-O 121.691 0.757 . . . . 0.0 110.044 -174.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -85.72 133.36 34.01 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 114.195 -1.366 . . . . 0.0 111.608 -170.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.574 ' HA ' HG21 ' A' ' 988' ' ' VAL . 1.8 pp -114.22 21.85 6.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.024 177.468 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -104.39 30.5 5.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.856 0.836 . . . . 0.0 108.798 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.563 ' HB2' HG13 ' A' ' 988' ' ' VAL . 78.1 mtp180 -136.84 -179.52 5.75 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 -178.282 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -81.34 84.17 6.71 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 171.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.574 HG21 ' HA ' ' A' ' 984' ' ' ILE . 11.9 m -115.5 -178.78 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 122.485 1.136 . . . . 0.0 113.928 -173.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 989' ' ' ASP . . . . . 0.574 ' HB3' ' H ' ' A' ' 993' ' ' TRP . 3.7 t70 -74.15 179.12 4.62 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 112.727 -2.033 . . . . 0.0 108.67 178.094 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.49 -31.56 69.47 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 118.768 0.713 . . . . 0.0 111.967 178.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -102.06 -44.65 5.4 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.169 -174.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 139.19 75.37 0.05 OUTLIER Glycine 0 CA--C 1.489 -1.534 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.899 176.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.619 ' HA ' ' HB3' ' A' 1021 ' ' ARG . 72.2 m95 -139.45 179.68 6.41 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.537 ' HG3' ' CE3' ' A' 1008 ' ' TRP . 6.9 pt-20 -143.15 153.54 42.97 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 122.285 1.04 . . . . 0.0 110.917 -177.308 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.763 ' O ' ' HA ' ' A' 1008 ' ' TRP . 9.6 t80 -81.99 104.44 12.35 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 112.777 -2.011 . . . . 0.0 112.272 -173.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 996' ' ' GLY . . . . . 0.457 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -128.78 116.8 2.32 Favored Glycine 0 C--O 1.216 -0.995 0 C-N-CA 118.478 -1.82 . . . . 0.0 112.667 172.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.808 HD12 ' HE1' ' A' 1015 ' ' TYR . 0.5 OUTLIER -109.18 149.61 12.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 O-C-N 120.349 -1.677 . . . . 0.0 109.461 -179.157 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 33.1 m -138.27 115.86 11.33 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 174.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 2.6 mp -100.42 108.13 51.44 Favored Pre-proline 0 C--N 1.305 -1.326 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 177.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -68.32 150.3 76.1 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.519 2.146 . . . . 0.0 113.057 -175.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -89.33 148.33 23.77 Favored 'Cis proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.474 -1.886 . . . . 0.0 112.474 -2.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 13.4 t70 -164.05 -89.16 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.419 -1.718 . . . . 0.0 109.032 177.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 159.32 -76.85 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.0 1.32 . . . . 0.0 109.925 -177.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 90.8 mttt -126.42 150.59 70.82 Favored Pre-proline 0 N--CA 1.447 -0.589 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.049 -172.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -63.85 147.07 92.33 Favored 'Trans proline' 0 C--O 1.239 0.571 0 C-N-CA 123.555 2.837 . . . . 0.0 110.425 170.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -93.89 -50.73 5.2 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 20.7 m -102.06 152.15 21.31 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 112.774 -2.012 . . . . 0.0 112.543 -172.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.763 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 67.3 m95 -135.22 137.09 42.28 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.214 -1.357 . . . . 0.0 107.929 -178.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.68 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 20.9 t -136.63 -109.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.864 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 -175.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -167.44 -31.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 118.65 0.659 . . . . 0.0 110.939 -171.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -72.16 -169.44 0.5 Allowed 'General case' 0 C--O 1.237 0.433 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.457 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.2 tp10 -150.0 105.95 3.45 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.528 -172.336 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 87.4 mttt -115.0 139.15 50.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.761 -1.108 . . . . 0.0 109.456 176.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1014 ' ' MET . . . . . 0.473 ' HA ' ' NH2' ' A' ' 940' ' ' ARG . 24.4 ttt -45.92 -32.56 2.76 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1015 ' ' TYR . . . . . 0.808 ' HE1' HD12 ' A' ' 997' ' ' ILE . 40.5 p90 -74.79 5.27 5.16 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 118.794 -1.162 . . . . 0.0 111.366 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.588 ' HB3' ' CH2' ' A' ' 946' ' ' TRP . 0.6 OUTLIER -60.02 118.35 6.18 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.535 171.282 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 21.1 p -110.5 -13.04 14.31 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.081 174.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 27.0 m80 -140.5 147.52 39.69 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 122.653 1.216 . . . . 0.0 113.265 -174.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -151.47 144.87 24.8 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 176.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.615 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 98.0 mtt180 -138.27 168.79 19.0 Favored 'General case' 0 CA--C 1.466 -2.252 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -179.137 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.619 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 30.3 ptt180 -154.16 153.64 32.15 Favored 'General case' 0 C--N 1.284 -2.281 0 O-C-N 124.677 1.235 . . . . 0.0 108.007 168.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.442 ' HG2' HG13 ' A' 1024 ' ' VAL . 41.8 ttm180 -91.51 115.65 28.22 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 123.558 0.536 . . . . 0.0 109.837 179.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.57 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 81.3 mt -90.12 125.19 35.35 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 169.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 17.6 m -112.83 153.45 14.42 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.866 0 CA-C-O 121.776 0.798 . . . . 0.0 111.33 -174.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.543 ' HG3' ' HB2' ' A' ' 977' ' ' ASP . 31.3 ttp180 -158.83 110.28 2.14 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-N 112.798 -2.001 . . . . 0.0 109.691 168.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.689 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.7 tmmm? -76.0 149.52 37.58 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -178.285 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.603 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 7.4 ptm180 -136.17 139.41 42.83 Favored 'General case' 0 C--O 1.204 -1.336 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -169.619 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 30.2 ttmt -125.74 135.83 52.5 Favored 'General case' 0 C--N 1.283 -2.283 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.078 -173.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.55 ' C ' ' H ' ' A' 1031 ' ' LEU . 35.3 ttmt -88.34 -21.02 24.59 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 123.571 1.653 . . . . 0.0 107.781 -177.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 3.2 t70 53.65 -2.92 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 111.135 -2.757 . . . . 0.0 114.127 -170.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1031 ' ' LEU . . . . . 0.55 ' H ' ' C ' ' A' 1029 ' ' LYS . 15.9 tp 61.68 16.31 7.66 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 125.905 1.682 . . . . 0.0 111.305 178.078 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 13.5 t -123.09 3.45 9.31 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -179.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -102.6 130.97 49.64 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 113.852 -1.522 . . . . 0.0 107.141 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 40.6 p 64.08 13.3 7.66 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.742 1.617 . . . . 0.0 111.463 -172.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -129.27 172.68 11.22 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 114.363 -1.289 . . . . 0.0 107.626 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 20.9 m 66.18 90.82 0.09 Allowed 'General case' 0 C--O 1.239 0.535 0 O-C-N 124.397 1.061 . . . . 0.0 109.818 -179.244 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 20.1 m -120.11 97.74 5.74 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.587 -176.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 27.4 m -102.51 126.94 49.73 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -68.52 102.42 1.45 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 173.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 80.3 mtt180 . . . . . 0 C--N 1.318 -0.803 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -177.328 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 44.1 pt . . . . . 0 N--CA 1.477 0.882 0 CA-C-O 120.843 0.354 . . . . 0.0 110.331 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -110.42 144.91 31.13 Favored Pre-proline 0 C--N 1.32 -0.699 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -71.7 -13.38 29.67 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.111 1.874 . . . . 0.0 111.901 176.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -81.72 -31.41 32.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.936 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 5.0 p -94.16 -41.48 9.48 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.053 0.454 . . . . 0.0 110.788 177.179 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . 61.14 45.51 8.99 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 114.442 -1.253 . . . . 0.0 108.811 -175.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -46.79 118.03 1.89 Allowed 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 113.996 -1.457 . . . . 0.0 112.526 -174.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -160.88 29.18 0.15 Allowed 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.154 -1.384 . . . . 0.0 107.961 -177.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 81.11 64.23 1.8 Allowed Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.671 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.441 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 20.1 m-70 -117.65 -152.2 0.5 Allowed 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 171.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -161.92 116.79 1.94 Allowed 'General case' 0 N--CA 1.413 -2.312 0 N-CA-C 102.267 -3.234 . . . . 0.0 102.267 172.629 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -142.29 138.65 31.48 Favored 'General case' 0 C--N 1.282 -2.337 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 175.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 930' ' ' PHE . . . . . 0.433 ' O ' ' HG2' ' A' 1027 ' ' ARG . 84.4 t80 -131.13 139.55 49.83 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.557 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 33.3 m -78.75 123.0 26.73 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -99.79 159.72 14.85 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 -173.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -154.51 156.25 36.33 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 119.589 -0.845 . . . . 0.0 111.492 -171.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 934' ' ' VAL . . . . . 0.527 HG22 ' H ' ' A' ' 935' ' ' TYR . 14.2 p -150.37 177.4 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 N-CA-C 106.768 -1.568 . . . . 0.0 106.768 175.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.565 ' HA ' ' O ' ' A' 1021 ' ' ARG . 78.7 m-85 -138.28 151.22 47.4 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.4 ' O ' ' HA ' ' A' 1020 ' ' ARG . 28.0 tt0 -120.34 124.83 46.51 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 -177.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -117.79 149.71 40.34 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.528 0.68 . . . . 0.0 111.849 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.598 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 38.9 mt-10 -144.0 159.33 42.78 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 125.306 1.442 . . . . 0.0 107.44 175.486 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 46.1 m -142.3 142.63 32.56 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.452 0.644 . . . . 0.0 111.777 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.503 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 17.8 ptt180 -141.78 161.07 38.86 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -176.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -67.68 152.67 96.09 Favored Pre-proline 0 C--N 1.311 -1.103 0 N-CA-C 105.291 -2.114 . . . . 0.0 105.291 170.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 942' ' ' PRO . . . . . 0.551 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 40.8 Cg_exo -60.59 90.37 0.09 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.636 1.558 . . . . 0.0 112.131 176.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 101.44 68.58 0.83 Allowed Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -157.98 -123.15 0.72 Allowed Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.176 -1.012 . . . . 0.0 111.106 -175.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -145.98 131.03 18.28 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.77 -0.715 . . . . 0.0 109.928 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.598 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 51.2 m95 -72.35 141.3 48.79 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.942 0.877 . . . . 0.0 109.448 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -125.02 149.66 64.07 Favored Pre-proline 0 C--N 1.289 -2.032 0 N-CA-C 101.955 -3.35 . . . . 0.0 101.955 175.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.549 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 31.8 Cg_exo -56.39 152.01 41.85 Favored 'Trans proline' 0 C--N 1.323 -0.787 0 C-N-CA 121.394 1.396 . . . . 0.0 111.697 -177.501 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -70.07 -171.55 0.45 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.121 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -105.98 -18.92 13.89 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -119.18 85.82 2.44 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 103.635 -2.728 . . . . 0.0 103.635 169.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 9.6 m -56.62 -54.0 51.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.032 -173.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 953' ' ' TYR . . . . . 0.505 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 70.5 m-85 -105.73 134.22 49.2 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-O 121.666 0.746 . . . . 0.0 111.106 177.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 15.5 p -143.9 171.63 13.97 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.628 -171.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 955' ' ' ASP . . . . . 0.702 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 20.7 t0 -107.64 -176.23 3.01 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 106.187 -1.783 . . . . 0.0 106.187 178.068 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.05 -35.56 25.53 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -175.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -105.9 10.42 32.44 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 100.14 -1.9 56.41 Favored Glycine 0 CA--C 1.497 -1.091 0 C-N-CA 119.36 -1.4 . . . . 0.0 112.457 177.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 959' ' ' ASP . . . . . 0.702 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 23.9 t70 -51.48 101.95 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 O-C-N 124.791 0.936 . . . . 0.0 109.165 173.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -56.53 123.64 15.48 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.559 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -120.95 -179.88 4.16 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.817 -175.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -75.98 154.87 35.52 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 175.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 6.1 m -83.29 150.42 60.63 Favored Pre-proline 0 N--CA 1.431 -1.389 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.711 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 50.7 Cg_exo -42.71 -33.75 3.12 Favored 'Trans proline' 0 N--CA 1.48 0.686 0 C-N-CA 124.841 3.694 . . . . 0.0 117.324 -174.019 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 15.5 t -79.05 -43.62 23.85 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -66.8 -25.72 66.59 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.0 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.505 HD13 ' CH2' ' A' ' 980' ' ' TRP . 7.0 mt -66.3 110.43 3.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.398 0.618 . . . . 0.0 110.904 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.3 p -105.5 154.01 20.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.251 0.548 . . . . 0.0 112.211 -176.241 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.4 ' HB3' ' CE2' ' A' ' 975' ' ' TRP . 8.1 p -90.43 153.71 46.24 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.143 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.581 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 89.7 Cg_endo -77.58 168.89 21.89 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.05 1.833 . . . . 0.0 110.118 173.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 971' ' ' PRO . . . . . 0.407 ' HB3' ' H ' ' A' 1037 ' ' SER . 25.9 Cg_exo -65.03 -9.75 22.84 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.111 1.874 . . . . 0.0 113.74 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.616 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -115.05 17.45 17.24 Favored Glycine 0 C--O 1.221 -0.665 0 C-N-CA 121.331 -0.462 . . . . 0.0 112.6 178.124 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.581 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 75.6 m95 -137.31 134.9 36.59 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-O 122.066 0.936 . . . . 0.0 110.133 175.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.658 ' HB3' ' O ' ' A' 1028 ' ' LYS . 8.7 tp10 -116.92 133.49 55.95 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-N 113.609 -1.632 . . . . 0.0 109.573 -169.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.665 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 65.9 m95 -82.39 100.26 9.9 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.422 -0.911 . . . . 0.0 109.911 174.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -74.44 -40.14 62.14 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.61 138.3 58.46 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 114.057 -1.428 . . . . 0.0 112.081 -177.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -52.39 -60.3 3.39 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 124.115 0.884 . . . . 0.0 111.953 176.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.5 154.72 8.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.99 -171.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.711 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 28.3 m95 -65.33 117.22 7.55 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -178.119 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 19.8 m -120.98 151.75 39.36 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 -173.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -73.52 133.17 43.54 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 119.055 0.843 . . . . 0.0 110.434 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.462 ' HB2' HG13 ' A' 1024 ' ' VAL . 45.0 t0 -82.35 122.45 28.0 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.123 -172.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 31.2 pt -114.03 8.36 7.77 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.314 -177.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -93.38 33.27 1.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.809 0.814 . . . . 0.0 109.064 -175.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 986' ' ' ARG . . . . . 0.631 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 53.6 mtp180 -143.58 -176.25 4.89 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -176.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -84.79 78.65 9.84 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 172.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.425 HG21 ' O ' ' A' ' 983' ' ' ASP . 17.3 m -138.71 161.42 30.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.624 -175.154 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 989' ' ' ASP . . . . . 0.401 ' HB3' ' HB2' ' A' ' 993' ' ' TRP . 11.7 t70 -55.58 169.34 0.32 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.293 1.037 . . . . 0.0 110.914 172.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -54.76 -33.6 61.49 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.479 0.657 . . . . 0.0 110.176 178.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 991' ' ' LYS . . . . . 0.514 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 86.4 mttt -98.38 9.07 43.94 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 115.092 -0.958 . . . . 0.0 112.106 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.68 -11.81 71.11 Favored Glycine 0 C--O 1.227 -0.314 0 N-CA-C 111.674 -0.57 . . . . 0.0 111.674 175.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 993' ' ' TRP . . . . . 0.671 ' HB3' ' CD ' ' A' 1019 ' ' ARG . 59.6 m95 -54.16 138.97 36.92 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.536 -0.832 . . . . 0.0 112.91 178.099 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.42 ' HG2' HG12 ' A' ' 988' ' ' VAL . 31.2 mt-10 -113.48 155.56 25.12 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.437 0.637 . . . . 0.0 111.462 -177.131 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.709 ' HB3' ' H ' ' A' 1009 ' ' VAL . 15.1 t80 -77.46 100.53 6.05 Favored 'General case' 0 C--O 1.209 -1.074 0 C-N-CA 127.08 2.152 . . . . 0.0 111.329 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -126.59 97.84 0.5 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 119.056 -1.545 . . . . 0.0 113.218 173.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.598 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -97.75 146.7 7.41 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 O-C-N 120.628 -1.513 . . . . 0.0 107.179 178.869 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 25.0 m -115.12 79.03 1.22 Allowed 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.719 0.771 . . . . 0.0 109.418 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.505 ' HA ' ' HD3' ' A' 1000 ' ' PRO . 2.0 pp -72.98 125.46 91.07 Favored Pre-proline 0 N--CA 1.447 -0.586 0 CA-C-N 114.592 -1.186 . . . . 0.0 111.846 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.505 ' HD3' ' HA ' ' A' ' 999' ' ' ILE . 2.7 Cg_exo -71.31 143.34 43.3 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.401 2.067 . . . . 0.0 114.183 -177.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1001 ' ' PRO . . . . . 0.447 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.9 Cg_endo -97.27 137.31 3.94 Favored 'Cis proline' 0 N--CA 1.444 -1.384 0 C-N-CA 122.973 -1.678 . . . . 0.0 112.873 -3.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 3.9 t70 -177.18 177.92 1.17 Allowed 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 112.312 -2.222 . . . . 0.0 106.507 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 10.7 m170 -119.61 -43.51 2.58 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 82.1 mttt -125.15 150.6 67.42 Favored Pre-proline 0 C--N 1.307 -1.249 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.128 -174.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1005 ' ' PRO . . . . . 0.531 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 77.0 Cg_exo -57.7 124.6 16.42 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.335 2.023 . . . . 0.0 110.305 171.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1006 ' ' LYS . . . . . 0.407 ' H ' ' HG2' ' A' 1006 ' ' LYS . 41.5 pttt -112.14 11.18 20.32 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 121.918 0.866 . . . . 0.0 109.726 -177.166 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 46.8 t -148.85 140.98 23.94 Favored 'General case' 0 N--CA 1.431 -1.386 0 CA-C-N 114.611 -1.177 . . . . 0.0 107.933 -176.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.641 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 47.1 m95 -138.76 141.82 38.83 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.229 0.956 . . . . 0.0 108.836 -178.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.844 HG12 ' H ' ' A' 1010 ' ' ALA . 21.5 t -152.14 -165.08 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 102.933 -2.988 . . . . 0.0 102.933 -176.248 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1010 ' ' ALA . . . . . 0.844 ' H ' HG12 ' A' 1009 ' ' VAL . . . -101.67 -32.92 10.09 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 120.112 1.324 . . . . 0.0 112.554 -179.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -68.64 122.81 19.29 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -167.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.52 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 3.0 tp10 -70.98 117.91 13.08 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 171.127 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.454 ' HD3' ' HE2' ' A' ' 995' ' ' TYR . 56.5 mtpt -115.34 151.95 33.69 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 173.093 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 25.6 ttt -49.48 -44.6 46.04 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 124.442 1.089 . . . . 0.0 111.677 174.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1015 ' ' TYR . . . . . 0.551 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 88.4 m-85 -65.32 7.44 0.21 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.598 ' CD2' HG22 ' A' ' 997' ' ' ILE . 6.2 m170 -66.79 114.16 5.45 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 121.86 0.838 . . . . 0.0 112.366 176.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.31 -35.19 11.32 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-N 112.852 -1.976 . . . . 0.0 108.156 177.311 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -136.31 154.29 50.91 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.104 -174.694 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1019 ' ' ARG . . . . . 0.671 ' CD ' ' HB3' ' A' ' 993' ' ' TRP . 9.1 ttm180 -160.44 147.16 15.64 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 994' ' ' GLU . 2.2 ptm180 -151.06 154.73 37.56 Favored 'General case' 0 C--O 1.196 -1.743 0 C-N-CA 119.516 -0.874 . . . . 0.0 110.676 -177.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.565 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 23.2 ptt180 -135.25 149.29 49.82 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.563 -0.855 . . . . 0.0 111.428 -176.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.631 ' NH1' ' HD2' ' A' ' 986' ' ' ARG . 34.7 ttm180 -87.95 129.55 35.21 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 123.2 0.313 . . . . 0.0 110.512 178.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.509 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 61.6 mt -103.96 129.25 51.5 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 167.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.569 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 6.2 m -107.11 141.57 22.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.877 -174.694 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.549 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 9.9 tpt180 -137.46 106.11 5.87 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.164 170.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.0 tmmm? -72.5 135.85 45.77 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.665 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.2 ptm180 -131.56 134.43 46.07 Favored 'General case' 0 C--O 1.204 -1.333 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -172.323 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.658 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.1 ttmt -125.03 137.88 54.22 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 -173.058 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.616 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.9 ttmt -91.13 -17.74 25.65 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 124.053 1.882 . . . . 0.0 106.978 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1030 ' ' ASP . . . . . 0.417 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 15.6 t70 60.99 -0.41 0.32 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 111.347 -2.66 . . . . 0.0 111.624 -171.381 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1031 ' ' LEU . . . . . 0.516 ' H ' ' C ' ' A' 1029 ' ' LYS . 29.6 tp 72.58 -2.68 2.57 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 127.02 2.128 . . . . 0.0 112.56 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 10.3 t -119.62 -1.8 10.56 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -177.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.457 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 26.5 tt0 -95.21 131.0 41.73 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.438 -178.679 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 9.2 m -153.18 -26.16 0.15 Allowed 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -141.21 76.82 1.57 Allowed 'General case' 0 N--CA 1.436 -1.142 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.768 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 20.0 m -73.17 -26.17 61.08 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 167.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1037 ' ' SER . . . . . 0.407 ' H ' ' HB3' ' A' ' 971' ' ' PRO . 3.4 m -126.49 103.46 7.62 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 105.504 -2.035 . . . . 0.0 105.504 174.348 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 28.6 m -76.68 -49.86 15.08 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.042 0.449 . . . . 0.0 110.092 -175.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -160.23 -177.65 6.41 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 . . . . . 0 C--N 1.312 -1.031 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.236 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 918' ' ' ILE . . . . . 0.405 ' O ' ' HD3' ' A' ' 920' ' ' PRO . 14.3 pt . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 120.557 0.218 . . . . 0.0 110.72 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -110.25 97.95 33.3 Favored Pre-proline 0 CA--C 1.515 -0.385 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 175.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 920' ' ' PRO . . . . . 0.416 ' HB2' ' HB2' ' A' ' 923' ' ' ALA . 20.1 Cg_exo -73.69 108.14 2.57 Favored 'Trans proline' 0 N--CA 1.448 -1.15 0 C-N-CA 122.312 2.008 . . . . 0.0 110.797 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -67.24 -38.54 85.38 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 174.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 94.9 m -121.69 94.68 4.39 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.267 174.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 923' ' ' ALA . . . . . 0.416 ' HB2' ' HB2' ' A' ' 920' ' ' PRO . . . -88.82 161.44 16.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.176 -179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 924' ' ' ASP . . . . . 0.552 ' HA ' ' CD2' ' A' ' 927' ' ' HIS . 19.3 t70 -135.47 139.23 43.9 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.426 0.631 . . . . 0.0 111.824 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -138.8 13.68 2.7 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.299 175.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 123.87 53.97 0.19 Allowed Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.877 -177.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 927' ' ' HIS . . . . . 0.552 ' CD2' ' HA ' ' A' ' 924' ' ' ASP . 3.1 m-70 -127.3 157.46 39.81 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 177.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.48 131.25 55.0 Favored 'General case' 0 N--CA 1.413 -2.291 0 N-CA-C 105.85 -1.908 . . . . 0.0 105.85 160.256 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 929' ' ' GLU . . . . . 0.563 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.9 OUTLIER -143.81 147.56 34.3 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.348 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -140.89 143.89 34.94 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 176.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 931' ' ' THR . . . . . 0.597 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 24.8 m -75.32 130.53 39.2 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 120.769 0.319 . . . . 0.0 111.068 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -106.08 158.08 17.07 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 933' ' ' GLU . . . . . 0.933 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 10.6 pt-20 -149.46 156.54 42.16 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 118.54 0.609 . . . . 0.0 110.385 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 7.2 p -153.2 130.4 2.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-O 121.255 0.55 . . . . 0.0 109.944 170.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 935' ' ' TYR . . . . . 0.633 ' HA ' ' O ' ' A' 1021 ' ' ARG . 62.0 m-85 -80.34 147.09 31.24 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -176.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 936' ' ' GLN . . . . . 0.655 ' O ' ' HA ' ' A' 1020 ' ' ARG . 32.9 tt0 -116.27 111.66 20.47 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -110.56 142.19 42.72 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.811 0.815 . . . . 0.0 112.328 -172.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 49.3 mt-10 -141.78 162.11 36.28 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 113.806 -1.543 . . . . 0.0 107.196 173.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 939' ' ' SER . . . . . 0.676 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 25.4 p -150.23 157.72 43.39 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 121.7 0.762 . . . . 0.0 111.995 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 940' ' ' ARG . . . . . 0.55 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 30.9 ptt180 -149.95 158.56 44.29 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 113.459 -1.7 . . . . 0.0 108.029 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -76.56 166.51 44.33 Favored Pre-proline 0 C--N 1.308 -1.212 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 168.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -65.75 90.74 0.24 Allowed 'Trans proline' 0 N--CA 1.449 -1.104 0 N-CA-C 108.576 -1.356 . . . . 0.0 108.576 168.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.39 -8.45 5.93 Favored Glycine 0 N--CA 1.435 -1.424 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -172.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 944' ' ' GLY . . . . . 0.55 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -103.44 -177.8 26.14 Favored Glycine 0 C--N 1.341 0.809 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 -178.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -118.89 163.21 17.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 120.795 2.297 . . . . 0.0 106.969 172.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 946' ' ' TRP . . . . . 0.602 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 42.3 m95 -64.45 135.65 56.29 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.955 0.883 . . . . 0.0 112.656 -172.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -138.84 171.82 7.56 Favored Pre-proline 0 C--N 1.309 -1.173 0 N-CA-C 103.394 -2.817 . . . . 0.0 103.394 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -52.21 124.07 14.06 Favored 'Trans proline' 0 C--O 1.234 0.322 0 CA-C-N 121.806 1.681 . . . . 0.0 110.76 176.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 949' ' ' ALA . . . . . 0.676 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -51.88 -68.43 0.17 Allowed 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -174.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.401 ' CG ' ' H ' ' A' ' 951' ' ' ASP . 7.2 pt-20 -168.18 -50.59 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 104.793 -2.299 . . . . 0.0 104.793 -172.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 951' ' ' ASP . . . . . 0.401 ' H ' ' CG ' ' A' ' 950' ' ' GLU . 23.2 m-20 -132.48 125.94 31.82 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 104.216 -2.513 . . . . 0.0 104.216 171.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 20.0 m -65.7 -58.64 5.23 Favored 'General case' 0 C--N 1.313 -1.002 0 O-C-N 123.329 0.393 . . . . 0.0 111.698 -174.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 953' ' ' TYR . . . . . 0.518 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 76.4 m-85 -102.25 132.21 48.33 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.381 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 954' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' ' 960' ' ' LYS . 69.9 p -142.23 177.78 8.01 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.817 0.817 . . . . 0.0 110.829 -172.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -100.68 171.47 7.68 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 105.291 -2.115 . . . . 0.0 105.291 174.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.12 -36.18 39.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.468 0.576 . . . . 0.0 111.5 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -75.81 -39.98 55.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.219 0.533 . . . . 0.0 110.66 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 133.51 -6.79 4.94 Favored Glycine 0 CA--C 1.493 -1.287 0 C-N-CA 120.499 -0.857 . . . . 0.0 112.053 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -58.37 105.28 0.27 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 176.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 960' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 953' ' ' TYR . 7.0 ttpm? -50.84 128.24 20.5 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.718 0.771 . . . . 0.0 111.525 176.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -115.39 -172.4 2.14 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.361 -1.29 . . . . 0.0 108.089 -177.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -82.0 159.05 23.61 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.62 152.24 72.35 Favored Pre-proline 0 N--CA 1.433 -1.286 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 177.262 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 964' ' ' PRO . . . . . 0.557 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 6.1 Cg_exo -45.5 -35.41 12.24 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 124.441 3.427 . . . . 0.0 114.917 -178.353 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 19.5 m -75.26 -46.87 30.9 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -69.0 -5.09 19.6 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.905 0.882 . . . . 0.0 112.414 174.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 967' ' ' LEU . . . . . 0.461 HD13 ' CH2' ' A' ' 980' ' ' TRP . 13.9 mt -90.85 114.7 27.18 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.947 0.403 . . . . 0.0 110.271 -178.259 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 34.5 p -117.26 172.95 6.96 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.21 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 969' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 6.2 p -95.6 141.43 23.18 Favored Pre-proline 0 C--N 1.319 -0.719 0 CA-C-O 120.938 0.399 . . . . 0.0 111.375 -178.38 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 970' ' ' PRO . . . . . 0.582 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 42.0 Cg_endo -84.55 170.34 10.4 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.368 2.712 . . . . 0.0 112.716 -178.543 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -64.36 102.7 0.4 Allowed 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 122.05 1.833 . . . . 0.0 110.415 174.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 972' ' ' GLY . . . . . 0.651 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 126.13 -7.12 7.67 Favored Glycine 0 N--CA 1.433 -1.507 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.038 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 973' ' ' TRP . . . . . 0.582 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.2 m95 -135.62 138.19 42.66 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 122.246 1.022 . . . . 0.0 111.395 -177.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 974' ' ' GLU . . . . . 0.515 ' HB2' HE21 ' A' 1033 ' ' GLN . 9.4 tp10 -129.53 145.6 51.44 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 126.55 1.94 . . . . 0.0 108.932 -171.16 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 975' ' ' TRP . . . . . 0.678 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 89.2 m95 -84.73 153.85 22.79 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.826 0.822 . . . . 0.0 112.03 174.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 976' ' ' GLU . . . . . 0.745 ' HB2' ' HD2' ' A' 1028 ' ' LYS . 40.3 tt0 -129.01 -37.27 1.71 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.215 177.379 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -74.54 151.99 39.4 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.022 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.24 -30.2 18.68 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -165.4 141.34 5.32 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.524 0.602 . . . . 0.0 111.749 -173.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 980' ' ' TRP . . . . . 0.6 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 36.2 m95 -63.21 123.88 19.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.055 -0.975 . . . . 0.0 108.537 -178.802 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 981' ' ' SER . . . . . 0.761 ' O ' ' HA ' ' A' 1023 ' ' LEU . 15.0 m -116.29 -165.51 1.06 Allowed 'General case' 0 C--O 1.203 -1.36 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 -175.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -119.69 148.22 43.65 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 120.604 1.547 . . . . 0.0 110.624 177.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 983' ' ' ASP . . . . . 0.401 ' CB ' ' HD2' ' A' 1022 ' ' ARG . 15.6 t0 -96.19 116.14 28.53 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.078 0.466 . . . . 0.0 109.83 -174.036 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.586 ' HA ' HG21 ' A' ' 988' ' ' VAL . 26.9 pt -106.26 15.83 6.98 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.452 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -96.7 38.41 1.22 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.259 1.028 . . . . 0.0 108.8 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 40.4 mtt180 -140.82 -176.74 4.78 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 -175.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.01 85.73 6.68 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 171.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 988' ' ' VAL . . . . . 0.586 HG21 ' HA ' ' A' ' 984' ' ' ILE . 23.0 m -135.83 150.79 28.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.967 -176.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 989' ' ' ASP . . . . . 0.449 ' HB2' ' HB3' ' A' 1011 ' ' ALA . 21.2 t70 -52.81 169.09 0.1 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.823 171.203 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -55.32 -34.08 63.89 Favored 'General case' 0 CA--C 1.507 -0.701 0 C-N-CA 123.369 0.668 . . . . 0.0 111.869 178.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -95.97 11.73 32.92 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.51 -177.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 992' ' ' GLY . . . . . 0.414 ' O ' ' HB3' ' A' 1021 ' ' ARG . . . 69.62 77.72 0.41 Allowed Glycine 0 N--CA 1.432 -1.581 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.687 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -147.0 129.11 15.58 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 994' ' ' GLU . . . . . 0.534 ' HB2' ' HB3' ' A' 1008 ' ' TRP . 3.7 pt-20 -103.24 154.02 19.78 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 177.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 995' ' ' TYR . . . . . 0.839 ' HB3' ' HA ' ' A' 1011 ' ' ALA . 0.5 OUTLIER -110.02 127.8 55.03 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.502 -172.47 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 996' ' ' GLY . . . . . 0.487 ' HA2' ' O ' ' A' 1007 ' ' SER . . . -127.29 141.21 12.45 Favored Glycine 0 N--CA 1.422 -2.297 0 CA-C-N 113.95 -1.477 . . . . 0.0 109.731 176.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 997' ' ' ILE . . . . . 0.716 HG22 ' HA ' ' A' 1016 ' ' HIS . 1.0 OUTLIER -121.41 138.7 50.91 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 C-N-CA 122.387 0.275 . . . . 0.0 110.507 -179.808 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.1 t -145.01 150.26 36.57 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.4 mp -108.11 100.64 37.66 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 176.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1000 ' ' PRO . . . . . 0.493 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 48.9 Cg_endo -70.5 134.27 26.05 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.343 2.028 . . . . 0.0 113.42 -175.05 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1001 ' ' PRO . . . . . 0.493 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.7 Cg_endo -94.81 150.04 10.41 Favored 'Cis proline' 0 N--CA 1.445 -1.339 0 C-N-CA 122.919 -1.701 . . . . 0.0 113.572 -1.431 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 27.9 t70 -149.43 -86.49 0.08 Allowed 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 112.964 -1.925 . . . . 0.0 107.164 176.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1003 ' ' HIS . . . . . 0.524 ' HB2' ' H ' ' A' 1004 ' ' LYS . 31.9 m-70 -158.87 -82.81 0.05 OUTLIER 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 170.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1004 ' ' LYS . . . . . 0.524 ' H ' ' HB2' ' A' 1003 ' ' HIS . 63.6 mttp -150.92 160.76 31.64 Favored Pre-proline 0 N--CA 1.439 -1.015 0 CA-C-N 113.937 -1.483 . . . . 0.0 109.073 177.426 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -56.28 143.61 85.02 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.801 2.334 . . . . 0.0 111.052 168.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -124.75 12.21 8.51 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 122.321 1.058 . . . . 0.0 108.174 -175.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1007 ' ' SER . . . . . 0.487 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 33.2 t -135.96 126.28 26.58 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 114.173 -1.376 . . . . 0.0 107.755 -173.629 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1008 ' ' TRP . . . . . 0.603 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 55.2 m95 -136.74 132.54 34.97 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 124.211 0.944 . . . . 0.0 108.489 -178.314 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.648 HG12 ' H ' ' A' 1010 ' ' ALA . 3.8 t -151.18 -178.08 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 -171.605 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1010 ' ' ALA . . . . . 0.648 ' H ' HG12 ' A' 1009 ' ' VAL . . . -65.53 109.71 2.45 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 119.016 0.825 . . . . 0.0 109.64 175.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1011 ' ' ALA . . . . . 0.839 ' HA ' ' HB3' ' A' ' 995' ' ' TYR . . . -52.73 108.53 0.32 Allowed 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 124.069 0.948 . . . . 0.0 112.234 -178.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1012 ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' 1013 ' ' LYS . 13.1 pt-20 -128.6 -48.29 1.27 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 178.597 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1013 ' ' LYS . . . . . 0.451 ' N ' ' HG3' ' A' 1012 ' ' GLU . 15.4 ptmt -78.06 147.56 34.68 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -168.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 24.7 ttt -62.49 -40.72 97.6 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 175.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -68.62 2.92 2.11 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -175.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1016 ' ' HIS . . . . . 0.716 ' HA ' HG22 ' A' ' 997' ' ' ILE 0.315 14.2 p-80 -82.84 128.13 34.12 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 116.0 -2.28 . . . . 0.0 111.202 174.986 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 73.7 p -101.42 -11.51 19.31 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.245 -166.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -139.95 143.69 36.68 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -176.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -142.5 152.58 42.82 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 175.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1020 ' ' ARG . . . . . 0.655 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 2.2 ptp180 -155.32 167.51 30.13 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 175.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1021 ' ' ARG . . . . . 0.633 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 27.7 ptt180 -150.15 153.56 36.55 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.061 175.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1022 ' ' ARG . . . . . 0.933 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 26.7 ttm180 -86.65 115.19 23.95 Favored 'General case' 0 N--CA 1.427 -1.596 0 O-C-N 123.864 0.727 . . . . 0.0 109.479 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1023 ' ' LEU . . . . . 0.761 ' HA ' ' O ' ' A' ' 981' ' ' SER . 76.1 mt -85.94 127.32 34.59 Favored 'General case' 0 N--CA 1.421 -1.88 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 169.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1024 ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 10.2 m -104.08 133.36 48.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.491 -173.056 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1025 ' ' ARG . . . . . 0.549 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.9 tpt180 -141.04 102.52 4.27 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.247 171.296 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1026 ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.5 OUTLIER -76.23 145.54 39.67 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 -179.043 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 1027 ' ' ARG . . . . . 0.678 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 5.9 ptm180 -136.39 157.84 45.85 Favored 'General case' 0 C--O 1.208 -1.092 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 -171.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1028 ' ' LYS . . . . . 0.745 ' HD2' ' HB2' ' A' ' 976' ' ' GLU . 21.2 ptmt -141.91 151.34 42.55 Favored 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -174.432 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1029 ' ' LYS . . . . . 0.651 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.6 ttmt -89.49 -20.33 23.98 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-O 123.304 1.526 . . . . 0.0 106.955 177.337 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1030 ' ' ASP . . . . . 0.448 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 33.9 t70 54.93 -0.49 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 111.402 -2.635 . . . . 0.0 113.101 -172.29 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1031 ' ' LEU . . . . . 0.543 ' H ' ' C ' ' A' 1029 ' ' LYS . 12.2 tp 66.35 6.11 4.11 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 126.489 1.916 . . . . 0.0 110.582 -178.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 18.1 p -105.83 -8.19 17.87 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-O 121.947 0.879 . . . . 0.0 109.42 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1033 ' ' GLN . . . . . 0.515 HE21 ' HB2' ' A' ' 974' ' ' GLU . 0.8 OUTLIER -105.87 0.95 26.38 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.265 -179.512 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 1034 ' ' THR . . . . . 0.544 ' HB ' ' HD3' ' A' 1029 ' ' LYS . 33.2 m -151.57 89.08 1.46 Allowed 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 177.153 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -101.57 -176.34 3.11 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.081 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 48.2 t -74.34 108.01 6.85 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 13.5 t -76.23 123.17 25.46 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 175.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 17.0 p -73.61 148.69 42.65 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -173.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -80.69 -36.62 32.04 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 175.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 . . . . . 0 C--O 1.248 0.991 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 177.636 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . 0.263 95.6 m-70 . . . . . 0 CA--C 1.479 -1.755 0 N-CA-C 104.918 -2.253 . . . . 0.0 104.918 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . 0.526 HG22 ' HH2' ' A' ' 973' ' ' TRP . 1.5 m 62.76 89.41 0.09 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 125.301 1.625 . . . . 0.0 108.196 -171.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.564 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.5 OUTLIER -128.69 128.87 44.94 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 106.816 -1.549 . . . . 0.0 106.816 174.754 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.483 ' O ' ' HG2' ' A' 1027 ' ' ARG . 87.2 t80 -121.78 136.3 54.93 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 121.495 -0.753 . . . . 0.0 109.058 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.594 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 23.4 m -69.57 120.21 15.01 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 176.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -94.98 146.81 23.99 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.768 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.3 pt-20 -152.86 158.08 41.65 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 118.436 0.562 . . . . 0.0 111.229 -169.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 3.7 p -160.53 129.37 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.408 0.623 . . . . 0.0 111.137 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.639 ' HA ' ' O ' ' A' 1021 ' ' ARG . 50.5 m-85 -88.94 112.66 23.59 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.786 -176.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -85.81 142.8 28.67 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . 1.067 ' HB3' ' HB3' ' A' 1020 ' ' ARG . 0.0 OUTLIER -144.44 162.22 37.07 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -178.329 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.603 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 44.8 mt-10 -131.18 162.2 30.48 Favored 'General case' 0 C--O 1.246 0.91 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 16.6 t -135.16 146.25 48.57 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.203 176.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.59 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 18.1 ptt180 -152.58 162.42 41.25 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -176.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -67.49 152.58 96.08 Favored Pre-proline 0 C--N 1.31 -1.141 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 171.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -56.89 94.42 0.06 OUTLIER 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 122.1 1.866 . . . . 0.0 112.98 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 94.07 65.44 1.03 Allowed Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 108.071 -2.012 . . . . 0.0 108.071 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -159.33 -156.4 8.06 Favored Glycine 0 N--CA 1.435 -1.418 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.349 -173.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -105.27 125.17 50.69 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.321 -0.94 . . . . 0.0 110.04 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.603 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 56.5 m95 -80.14 147.89 31.18 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-O 121.619 0.724 . . . . 0.0 109.9 -177.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -128.66 171.33 8.81 Favored Pre-proline 0 C--N 1.298 -1.667 0 N-CA-C 103.475 -2.787 . . . . 0.0 103.475 174.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -59.17 135.97 69.56 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 CA-C-N 121.245 1.48 . . . . 0.0 109.801 175.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -58.9 174.06 0.38 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.976 0.893 . . . . 0.0 112.338 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -69.63 -38.47 77.2 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.189 -1.368 . . . . 0.0 107.494 -178.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -122.4 104.23 9.26 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 104.64 -2.356 . . . . 0.0 104.64 170.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 17.5 m -68.02 -52.84 30.9 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -172.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -97.58 125.2 42.17 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.175 173.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 13.0 p -140.9 173.28 11.64 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.681 -171.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -94.68 167.07 11.69 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 171.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.0 -28.84 18.4 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.765 0.711 . . . . 0.0 112.2 177.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -82.05 -39.76 23.01 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.22 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 139.86 -10.75 3.12 Favored Glycine 0 CA--C 1.498 -0.991 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.888 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -60.51 109.23 0.96 Allowed 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 121.193 0.52 . . . . 0.0 110.494 177.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' A' ' 961' ' ' ALA . 9.5 tmtt? -47.52 126.57 10.04 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.581 -1.645 . . . . 0.0 110.698 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.434 ' N ' ' HD3' ' A' ' 960' ' ' LYS . . . -122.74 173.57 7.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.731 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -69.08 160.87 30.21 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.874 0.369 . . . . 0.0 110.337 178.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.95 153.95 41.88 Favored Pre-proline 0 N--CA 1.435 -1.199 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -177.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.549 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.4 Cg_exo -47.18 -33.16 15.18 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 124.51 3.473 . . . . 0.0 115.866 -178.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.2 p -71.22 -45.0 64.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.879 0.847 . . . . 0.0 110.182 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -64.47 -27.43 68.98 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.42 -1.263 . . . . 0.0 110.285 175.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 81.2 mt -74.36 110.66 8.82 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 122.072 0.939 . . . . 0.0 110.11 176.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.3 p -129.01 165.11 21.79 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.99 -172.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 12.0 p -81.09 128.2 71.69 Favored Pre-proline 0 N--CA 1.441 -0.916 0 CA-C-O 121.239 0.542 . . . . 0.0 110.638 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.654 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 58.8 Cg_endo -82.27 165.73 16.57 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.562 2.174 . . . . 0.0 109.722 175.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -59.23 112.19 1.15 Allowed 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 121.551 1.501 . . . . 0.0 110.112 173.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.414 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . 114.04 -4.18 23.97 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.83 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.654 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 92.9 m95 -126.18 132.9 51.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 122.225 1.012 . . . . 0.0 111.793 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.669 ' HB2' HE22 ' A' 1033 ' ' GLN . 8.1 tp10 -112.22 129.45 56.26 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 112.797 -2.001 . . . . 0.0 108.162 -175.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.52 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 94.1 m95 -70.85 138.81 50.58 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.644 -1.222 . . . . 0.0 111.129 172.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . 0.606 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 9.8 tp10 -100.88 -47.59 4.74 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.003 -0.999 . . . . 0.0 108.543 -177.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . 0.588 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.8 m-20 -85.88 161.09 19.23 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.155 -177.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -93.17 108.97 20.47 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.377 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . 0.509 ' C ' ' HD3' ' A' 1025 ' ' ARG . . . 55.49 178.05 0.03 OUTLIER 'General case' 0 C--O 1.234 0.254 0 CA-C-O 122.72 1.248 . . . . 0.0 113.491 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.626 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 51.9 m95 -88.09 118.45 27.67 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 113.606 -1.634 . . . . 0.0 108.066 177.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . 0.687 ' O ' ' HA ' ' A' 1023 ' ' LEU . 34.7 m -110.2 -165.05 0.97 Allowed 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 -177.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -112.89 145.41 40.75 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 121.242 1.837 . . . . 0.0 109.432 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.481 ' HB2' HG13 ' A' 1024 ' ' VAL . 55.3 t0 -86.56 120.15 27.57 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -175.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.3 pp -116.24 15.45 7.72 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.349 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -99.12 30.04 3.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 123.036 1.398 . . . . 0.0 108.257 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.507 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 70.3 mtp85 -138.68 174.05 10.94 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.584 -177.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -80.74 79.62 7.35 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 171.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.619 HG12 ' HG2' ' A' ' 994' ' ' GLU . 25.7 m -135.84 161.09 38.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.97 -175.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.34 168.65 0.34 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.633 0.583 . . . . 0.0 110.553 171.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -54.73 -34.66 62.77 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-O 120.903 0.383 . . . . 0.0 111.314 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -101.03 7.36 43.47 Favored 'General case' 0 N--CA 1.427 -1.618 0 C-N-CA 119.004 -1.079 . . . . 0.0 111.469 -178.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 100.87 -20.8 46.36 Favored Glycine 0 C--O 1.224 -0.494 0 CA-C-N 116.122 -0.49 . . . . 0.0 113.803 173.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 83.1 m95 -54.19 121.7 8.72 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.619 ' HG2' HG12 ' A' ' 988' ' ' VAL . 22.6 mt-10 -99.37 153.63 18.83 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.039 177.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.733 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 27.6 t80 -79.01 94.27 5.26 Favored 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 126.783 2.033 . . . . 0.0 111.918 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -110.17 96.53 0.94 Allowed Glycine 0 N--CA 1.435 -1.423 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 177.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.591 HD12 ' HB3' ' A' 1015 ' ' TYR . 1.1 tt -98.42 130.1 47.73 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.194 0 O-C-N 122.139 -0.624 . . . . 0.0 110.197 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 7.1 m -108.12 85.45 2.12 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.989 -178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 16.2 pt -78.68 121.28 83.37 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.21 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 38.8 Cg_endo -69.94 135.67 30.62 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.05 1.833 . . . . 0.0 111.373 178.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.0 Cg_endo -92.63 144.84 11.2 Favored 'Cis proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.23 -1.571 . . . . 0.0 114.331 -0.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 22.7 t0 163.33 155.64 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 112.176 -2.284 . . . . 0.0 105.994 177.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -99.55 -34.92 10.05 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.022 0.439 . . . . 0.0 110.339 -175.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . 0.548 ' H ' ' HD2' ' A' 1004 ' ' LYS . 0.0 OUTLIER -123.55 154.0 66.26 Favored Pre-proline 0 C--N 1.317 -0.829 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.172 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -58.49 127.75 25.83 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.25 2.634 . . . . 0.0 110.291 163.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 20.5 pttm -117.88 13.32 14.02 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.196 0.998 . . . . 0.0 109.608 178.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 29.9 t -143.54 136.1 27.24 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 113.908 -1.496 . . . . 0.0 107.766 -178.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.599 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 62.9 m95 -134.09 140.15 46.42 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 124.478 1.111 . . . . 0.0 108.966 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.522 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 92.8 t -140.51 157.77 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -177.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -83.03 8.76 11.88 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -121.23 134.78 55.2 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 121.278 -0.888 . . . . 0.0 111.603 -175.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.665 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.7 tp10 -69.56 105.1 2.54 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.526 ' H ' ' CE1' ' A' 1016 ' ' HIS . 95.0 mttt -109.26 147.15 33.08 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.743 -1.571 . . . . 0.0 108.47 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 26.5 ptt? -56.27 -36.09 68.19 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -178.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . 0.591 ' HB3' HD12 ' A' ' 997' ' ' ILE . 58.9 m-85 -60.93 -4.27 0.97 Allowed 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.733 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 2.6 m80 -54.67 108.03 0.35 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.63 -25.44 16.77 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 123.585 1.659 . . . . 0.0 106.912 173.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -141.71 150.73 42.22 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 111.865 -2.425 . . . . 0.0 109.466 -177.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.515 ' HB3' ' CD2' ' A' 1016 ' ' HIS . 35.2 ptt180 -151.87 141.77 22.03 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 171.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 1.067 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . 4.9 ptp180 -149.63 161.88 41.31 Favored 'General case' 0 CA--C 1.481 -1.687 0 C-N-CA 118.532 -1.267 . . . . 0.0 109.977 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.639 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.9 ptt180 -148.0 149.39 32.05 Favored 'General case' 0 C--N 1.298 -1.673 0 C-N-CA 119.431 -0.907 . . . . 0.0 110.969 -177.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.768 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 37.2 ttm180 -83.83 115.09 22.08 Favored 'General case' 0 N--CA 1.423 -1.806 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.455 -177.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.687 ' HA ' ' O ' ' A' ' 981' ' ' SER . 72.4 mt -80.44 129.66 34.66 Favored 'General case' 0 N--CA 1.425 -1.718 0 N-CA-C 105.179 -2.156 . . . . 0.0 105.179 166.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.481 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.6 m -111.83 133.63 56.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 CA-C-O 121.733 0.778 . . . . 0.0 112.721 -174.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.557 ' HG3' ' HB2' ' A' ' 977' ' ' ASP . 14.6 ttp180 -150.26 101.66 3.01 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 112.926 -1.943 . . . . 0.0 109.373 166.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.606 ' HE2' ' HG2' ' A' ' 976' ' ' GLU . 0.0 OUTLIER -79.43 154.21 29.11 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 -178.29 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.52 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 7.5 ptm180 -136.4 165.75 25.07 Favored 'General case' 0 CA--C 1.488 -1.432 0 N-CA-C 105.076 -2.194 . . . . 0.0 105.076 -170.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 30.4 ttmt -149.9 142.6 24.6 Favored 'General case' 0 C--N 1.281 -2.403 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 -172.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -91.37 -13.2 32.89 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 123.568 1.651 . . . . 0.0 107.581 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . 0.401 ' H ' ' HG2' ' A' 1028 ' ' LYS . 25.0 t0 52.69 23.35 2.64 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 111.454 -2.612 . . . . 0.0 110.225 -173.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 25.4 tp 66.38 -47.32 0.43 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.224 2.21 . . . . 0.0 113.284 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 14.6 t -79.02 -21.7 46.56 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -171.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.669 HE22 ' HB2' ' A' ' 974' ' ' GLU . 43.2 mt-30 . . . . . 0 N--CA 1.463 0.211 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -175.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . 0.543 ' HB2' ' OE1' ' A' ' 929' ' ' GLU . 79.7 m-70 . . . . . 0 CA--C 1.5 -0.957 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . 0.471 ' HB ' ' HB3' ' A' 1029 ' ' LYS . 4.7 m 64.19 87.89 0.11 Allowed 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -167.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.709 ' HB3' ' HD3' ' A' 1028 ' ' LYS . 0.8 OUTLIER -121.67 168.02 12.26 Favored 'General case' 0 C--N 1.27 -2.863 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.544 ' O ' ' HG2' ' A' 1027 ' ' ARG . 81.6 t80 -149.51 124.74 10.14 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -176.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . . . . . . . . . 70.0 m -78.52 113.83 16.9 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 174.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -92.47 163.3 13.89 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 105.715 -1.958 . . . . 0.0 105.715 -174.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.602 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -164.28 142.31 7.01 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 120.265 -0.574 . . . . 0.0 109.791 -172.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.427 HG11 HD11 ' A' ' 967' ' ' LEU . 34.1 m -143.29 126.5 13.31 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 175.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.609 ' HA ' ' O ' ' A' 1021 ' ' ARG . 29.9 m-85 -84.18 149.47 26.13 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.67 -0.644 . . . . 0.0 110.164 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.526 ' O ' ' HA ' ' A' 1020 ' ' ARG . 13.3 tt0 -119.91 121.22 38.55 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -109.28 146.34 34.45 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.15 0.976 . . . . 0.0 112.666 -174.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.557 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 39.6 mt-10 -138.34 160.56 39.18 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 112.909 -1.95 . . . . 0.0 106.54 170.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 15.4 m -145.39 151.48 38.33 Favored 'General case' 0 C--N 1.311 -1.065 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -176.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.598 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 26.9 ptt180 -146.13 160.7 41.57 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.298 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -75.62 163.55 66.52 Favored Pre-proline 0 C--N 1.315 -0.928 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 169.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -68.5 89.22 0.41 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 CA-C-N 120.357 1.163 . . . . 0.0 109.993 172.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 129.41 -1.05 6.04 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 110.262 -1.135 . . . . 0.0 110.262 -174.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . 0.598 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -100.99 -171.93 28.77 Favored Glycine 0 CA--C 1.502 -0.749 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 177.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -122.5 154.84 37.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 119.204 1.502 . . . . 0.0 107.094 172.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.571 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 24.8 m95 -61.72 135.73 57.72 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.709 0.766 . . . . 0.0 112.302 -173.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -135.56 167.27 23.11 Favored Pre-proline 0 C--N 1.307 -1.256 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -49.16 128.42 19.71 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.496 2.13 . . . . 0.0 112.931 -179.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -74.32 -162.31 0.15 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.543 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -89.7 -52.92 4.75 Favored 'General case' 0 CA--C 1.483 -1.603 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -109.17 92.06 3.9 Favored 'General case' 0 N--CA 1.411 -2.382 0 N-CA-C 104.983 -2.229 . . . . 0.0 104.983 -176.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 10.4 m -57.97 -58.06 10.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.672 -172.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . 0.487 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 89.1 m-85 -104.97 136.68 43.98 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.062 -0.655 . . . . 0.0 111.37 178.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 3.0 p -149.66 -178.08 6.24 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.039 0.936 . . . . 0.0 112.333 -168.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . 0.494 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 6.5 t70 -108.95 164.94 11.96 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 173.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -54.4 -29.16 48.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 119.379 0.99 . . . . 0.0 111.494 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -82.41 -8.37 59.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 177.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 100.61 -3.7 56.31 Favored Glycine 0 CA--C 1.501 -0.833 0 C-N-CA 119.918 -1.134 . . . . 0.0 112.133 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . 0.494 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 30.6 t70 -59.41 99.15 0.05 Allowed 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 175.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -52.56 129.69 29.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.226 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.11 171.34 8.17 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.666 -176.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -74.53 160.62 30.67 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.1 m -85.67 151.83 56.12 Favored Pre-proline 0 N--CA 1.423 -1.792 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.471 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 2.8 Cg_endo -47.52 -29.89 11.09 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 125.119 3.879 . . . . 0.0 117.729 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 51.1 m -88.23 -35.61 17.21 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 118.98 0.809 . . . . 0.0 109.55 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -65.4 -25.94 67.77 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.009 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.486 HD13 ' CH2' ' A' ' 980' ' ' TRP . 32.9 mt -74.75 122.4 23.22 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.685 0.794 . . . . 0.0 110.351 176.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 24.0 p -124.77 169.53 11.91 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.368 -174.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.569 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 25.6 p -92.7 133.74 28.85 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.26 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.608 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 93.6 Cg_endo -75.79 170.52 20.01 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.328 2.018 . . . . 0.0 110.835 176.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -56.67 -19.93 32.54 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.201 2.601 . . . . 0.0 115.227 -176.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.685 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . -116.07 14.98 16.19 Favored Glycine 0 N--CA 1.439 -1.103 0 C-N-CA 120.474 -0.869 . . . . 0.0 112.708 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.608 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 96.4 m95 -129.13 127.78 42.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 118.014 0.907 . . . . 0.0 110.793 178.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.455 ' HB2' HE21 ' A' 1033 ' ' GLN . 8.9 tp10 -106.4 118.18 35.97 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.616 2.366 . . . . 0.0 108.528 -173.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.648 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 42.8 m95 -69.55 105.12 2.55 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.107 -1.037 . . . . 0.0 111.135 176.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -71.15 -51.09 26.93 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 174.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -74.43 144.84 44.11 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.774 -172.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.63 -36.53 68.04 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -178.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -166.8 150.27 6.84 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.96 0.41 . . . . 0.0 110.806 -174.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.607 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 35.1 m95 -64.68 120.24 12.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . 0.712 ' O ' ' HA ' ' A' 1023 ' ' LEU . 19.9 m -115.6 -172.28 2.12 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -174.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . 0.437 ' CD2' ' HA ' ' A' ' 991' ' ' LYS . 3.7 p90 -109.88 143.78 39.3 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 120.472 1.487 . . . . 0.0 109.695 -177.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.499 ' HB3' ' HD2' ' A' 1022 ' ' ARG . 17.2 t70 -106.16 131.54 53.29 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.365 -171.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.2 pp -109.33 29.63 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.631 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -106.4 30.51 5.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.952 1.358 . . . . 0.0 107.742 -174.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -138.95 -177.1 4.73 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -178.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -86.79 77.68 9.23 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 173.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.506 HG12 ' HB3' ' A' ' 994' ' ' GLU . 30.3 m -137.1 156.67 34.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.529 -172.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -55.02 165.94 0.59 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.792 -1.094 . . . . 0.0 110.995 170.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -52.88 -25.25 11.09 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 123.582 0.753 . . . . 0.0 112.871 176.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . 0.444 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 95.4 mttt -106.77 13.03 28.42 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.812 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.32 -13.23 66.97 Favored Glycine 0 C--O 1.224 -0.473 0 CA-C-N 115.967 -0.56 . . . . 0.0 113.383 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.477 ' HE3' ' HG2' ' A' 1019 ' ' ARG . 79.4 m95 -59.31 115.38 3.19 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.506 ' HB3' HG12 ' A' ' 988' ' ' VAL . 4.5 pt-20 -105.41 159.25 16.06 Favored 'General case' 0 C--O 1.257 1.451 0 CA-C-O 121.992 0.901 . . . . 0.0 112.543 176.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.788 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 57.1 t80 -83.08 103.0 12.18 Favored 'General case' 0 C--O 1.209 -1.068 0 C-N-CA 128.019 2.528 . . . . 0.0 113.714 -172.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -127.23 137.99 10.24 Favored Glycine 0 N--CA 1.439 -1.152 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 172.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.49 ' O ' ' HA ' ' A' 1005 ' ' PRO . 0.6 OUTLIER -133.44 149.65 31.41 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 177.13 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 28.8 m -127.82 103.77 7.46 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 121.203 0.525 . . . . 0.0 109.832 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 18.0 pt -95.51 114.18 63.37 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.37 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 33.0 Cg_endo -65.87 138.16 51.98 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 122.518 2.145 . . . . 0.0 112.931 -177.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 6.6 Cg_endo -89.92 138.53 12.77 Favored 'Cis proline' 0 N--CA 1.45 -1.071 0 C-N-CA 123.143 -1.607 . . . . 0.0 113.883 -1.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 30.9 t0 165.16 151.19 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 111.604 -2.544 . . . . 0.0 104.664 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . 0.403 ' HB2' ' HD2' ' A' 1004 ' ' LYS . 3.5 m-70 -112.22 -35.91 5.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 120.631 1.559 . . . . 0.0 110.588 -175.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . 0.403 ' HD2' ' HB2' ' A' 1003 ' ' HIS . 2.0 mptp? -96.84 142.33 24.38 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-O 120.934 0.397 . . . . 0.0 111.772 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.49 ' HA ' ' O ' ' A' ' 997' ' ' ILE . 77.5 Cg_exo -62.66 123.21 11.94 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 N-CA-C 107.405 -1.806 . . . . 0.0 107.405 162.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 34.3 mttm -75.5 -12.61 60.27 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.199 0.523 . . . . 0.0 111.783 -175.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 39.3 t -150.07 151.74 33.69 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 -165.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.691 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 59.4 m95 -138.41 131.95 30.65 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 125.457 1.723 . . . . 0.0 107.254 174.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.407 HG12 ' N ' ' A' 1010 ' ' ALA . 21.3 t -150.18 170.56 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -171.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . 0.407 ' N ' HG12 ' A' 1009 ' ' VAL . . . -94.37 95.22 8.74 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 176.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -169.26 172.51 7.24 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.905 -175.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.644 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.2 OUTLIER -150.7 97.68 2.52 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 122.69 1.233 . . . . 0.0 109.238 176.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.586 ' HD3' ' CE1' ' A' ' 995' ' ' TYR . 57.7 mtpt -115.87 144.25 44.29 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 112.869 -1.969 . . . . 0.0 110.084 -176.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 55.5 ttp -46.27 -35.11 4.97 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 124.887 1.275 . . . . 0.0 113.875 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -62.34 -13.0 24.27 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.812 0.339 . . . . 0.0 111.178 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.788 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.4 OUTLIER -48.94 106.14 0.1 Allowed 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.0 177.253 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -18.57 13.91 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.15 175.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -139.73 147.17 40.5 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.169 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.477 ' HG2' ' HE3' ' A' ' 993' ' ' TRP . 50.3 ttp180 -147.58 147.63 30.27 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.589 ' HG2' ' CZ3' ' A' 1008 ' ' TRP . 3.6 ptp180 -155.44 167.78 29.26 Favored 'General case' 0 C--O 1.201 -1.471 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.935 176.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.609 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 28.1 ptt180 -149.93 156.31 41.51 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 123.713 0.633 . . . . 0.0 109.753 177.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.602 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 34.5 ttm180 -88.69 128.25 35.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 117.794 0.27 . . . . 0.0 110.612 177.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.712 ' HA ' ' O ' ' A' ' 981' ' ' SER . 87.2 mt -101.67 128.28 48.04 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 106.924 -1.509 . . . . 0.0 106.924 168.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 4.5 m -107.44 139.1 30.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.14 0 CA-C-O 121.543 0.687 . . . . 0.0 111.93 -174.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.514 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.1 tpt180 -135.61 104.41 5.79 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.1 171.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.722 ' HE2' ' HE3' ' A' 1028 ' ' LYS . 0.9 OUTLIER -72.4 136.76 46.15 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.046 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.648 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.4 ptm180 -138.03 144.46 41.05 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -172.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.722 ' HE3' ' HE2' ' A' 1026 ' ' LYS . 30.4 mmtp -108.61 150.3 27.71 Favored 'General case' 0 CA--C 1.468 -2.2 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.822 -175.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 35.1 ttmt -99.26 -16.46 18.5 Favored 'General case' 0 C--N 1.275 -2.656 0 N-CA-C 103.996 -2.594 . . . . 0.0 103.996 161.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . 0.462 ' C ' ' H ' ' A' 1032 ' ' THR . 8.6 t70 49.27 16.1 0.14 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 111.217 -2.72 . . . . 0.0 111.376 -174.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 29.5 tp 55.74 -37.58 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 127.864 2.465 . . . . 0.0 113.247 -172.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . 0.462 ' H ' ' C ' ' A' 1030 ' ' ASP . 9.0 t -74.79 -14.08 60.66 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.405 1.082 . . . . 0.0 112.878 -178.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.685 ' HB3' ' HA2' ' A' ' 972' ' ' GLY . 11.5 mm-40 . . . . . 0 N--CA 1.483 1.179 0 CA-C-N 118.999 0.818 . . . . 0.0 109.908 177.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 . . . . . 0 CA--C 1.495 -1.136 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.16 124.01 47.01 Favored 'General case' 0 N--CA 1.415 -2.223 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 163.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.485 ' HB2' ' HE3' ' A' 1026 ' ' LYS . 0.1 OUTLIER -141.67 133.0 26.56 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 171.194 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.425 ' O ' ' HG2' ' A' 1027 ' ' ARG . 73.2 t80 -128.36 135.65 49.85 Favored 'General case' 0 C--N 1.295 -1.771 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 -176.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.594 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 34.0 m -77.5 124.45 27.92 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -105.06 159.4 15.86 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 105.153 -2.166 . . . . 0.0 105.153 -173.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.781 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 11.9 pt-20 -151.1 152.55 33.55 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.105 -175.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.619 ' O ' ' HA ' ' A' 1022 ' ' ARG . 8.6 p -137.03 178.63 4.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 N-CA-C 106.438 -1.689 . . . . 0.0 106.438 176.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.54 ' HA ' ' O ' ' A' 1021 ' ' ARG . 49.8 m-85 -142.79 113.11 7.23 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 118.755 0.707 . . . . 0.0 110.761 -174.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.567 ' O ' ' HA ' ' A' 1020 ' ' ARG . 31.3 tt0 -79.3 127.42 32.04 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.944 0.778 . . . . 0.0 110.046 173.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . 0.451 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 33.5 m-80 -118.53 152.41 36.02 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.632 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 43.5 mt-10 -140.86 162.11 36.21 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 171.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 24.7 p -137.62 142.37 41.23 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.54 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 15.0 ptt180 -151.63 160.05 43.8 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 123.779 0.832 . . . . 0.0 108.92 -178.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -66.29 161.23 59.33 Favored Pre-proline 0 C--N 1.311 -1.087 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 171.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.64 97.76 0.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 121.554 1.503 . . . . 0.0 111.396 175.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 89.27 62.56 1.34 Allowed Glycine 0 N--CA 1.441 -0.983 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 -178.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -156.25 -159.65 9.54 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 121.096 -0.573 . . . . 0.0 111.929 -175.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -103.24 133.08 48.92 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 123.989 0.464 . . . . 0.0 110.263 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.632 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 42.2 m95 -80.78 147.41 30.5 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-O 121.3 0.571 . . . . 0.0 109.876 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -127.56 151.29 74.91 Favored Pre-proline 0 C--N 1.296 -1.758 0 N-CA-C 103.018 -2.956 . . . . 0.0 103.018 170.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -49.35 140.15 27.3 Favored 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 122.426 2.084 . . . . 0.0 111.66 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.64 -178.17 0.38 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.435 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -89.73 -40.11 12.72 Favored 'General case' 0 CA--C 1.473 -1.995 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -120.18 88.15 2.88 Favored 'General case' 0 N--CA 1.399 -3.023 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 31.8 m -64.64 -57.79 8.09 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.715 -1.13 . . . . 0.0 112.384 -170.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -92.77 129.27 38.74 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.725 0.774 . . . . 0.0 111.436 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . 0.572 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 12.9 p -149.61 178.44 8.84 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.133 -169.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -99.27 172.99 7.0 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 105.567 -2.012 . . . . 0.0 105.567 173.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -53.07 -31.55 42.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.931 0.787 . . . . 0.0 111.437 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . 0.416 HD21 ' HB2' ' A' ' 959' ' ' ASP . 5.3 p30 -84.16 -7.78 59.27 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.588 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . 0.572 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 74.76 56.52 4.9 Favored Glycine 0 CA--C 1.49 -1.525 0 C-N-CA 120.194 -1.003 . . . . 0.0 111.27 -174.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . 0.416 ' HB2' HD21 ' A' ' 957' ' ' ASN . 11.3 t70 -105.17 109.66 21.73 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.499 -3.149 . . . . 0.0 102.499 174.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -46.58 115.95 1.18 Allowed 'General case' 0 C--N 1.319 -0.748 0 O-C-N 124.481 1.113 . . . . 0.0 111.164 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -122.42 -177.26 3.57 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.858 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . 0.617 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -80.52 161.62 24.74 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 176.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.0 m -80.69 159.94 68.01 Favored Pre-proline 0 C--N 1.314 -0.95 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.699 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 41.7 Cg_exo -46.38 -33.8 13.16 Favored 'Trans proline' 0 N--CA 1.478 0.56 0 C-N-CA 123.674 2.916 . . . . 0.0 115.047 -178.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 2.5 p -72.57 -47.51 47.49 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.507 0.67 . . . . 0.0 110.086 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . 0.617 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 40.0 mt-10 -64.84 -32.86 74.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.112 -1.403 . . . . 0.0 110.488 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.509 HD13 ' CH2' ' A' ' 980' ' ' TRP . 14.5 mt -60.9 110.41 1.33 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.923 0.868 . . . . 0.0 111.175 178.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 18.7 p -104.64 164.35 11.82 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.282 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 14.2 p -97.98 136.04 21.22 Favored Pre-proline 0 N--CA 1.442 -0.835 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.421 175.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.604 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 77.8 Cg_endo -71.76 175.57 9.44 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 123.683 2.922 . . . . 0.0 110.492 177.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.53 -46.59 30.76 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.643 2.228 . . . . 0.0 114.011 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . . . . . . . . . . . -72.11 -51.96 12.58 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.732 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.604 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 96.6 m95 -72.01 144.31 48.86 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -177.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.533 ' HB3' ' O ' ' A' 1028 ' ' LYS . 2.6 tp10 -133.47 156.51 47.6 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 113.297 -1.774 . . . . 0.0 106.455 -177.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.493 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 82.6 m95 -89.56 152.11 21.59 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.616 -0.678 . . . . 0.0 110.703 172.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -131.1 -33.78 1.5 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.54 0.686 . . . . 0.0 109.396 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . 0.454 ' HB3' ' HD2' ' A' 1025 ' ' ARG . 8.2 t0 -71.44 151.49 43.95 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.83 -47.49 74.84 Favored 'General case' 0 C--N 1.318 -0.788 0 O-C-N 123.527 0.517 . . . . 0.0 111.253 -176.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -164.72 171.97 13.64 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -174.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.699 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 31.6 m95 -84.86 87.13 7.31 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.884 0.849 . . . . 0.0 109.14 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 3.2 m -93.45 145.43 24.5 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.715 -1.129 . . . . 0.0 108.575 -176.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . 0.463 ' HA ' ' O ' ' A' 1022 ' ' ARG . 3.5 p90 -73.39 136.03 44.31 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 121.919 0.866 . . . . 0.0 110.722 -176.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.577 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 4.4 t70 -82.92 141.02 32.49 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 113.668 -1.606 . . . . 0.0 111.746 -172.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.5 pp -132.29 5.63 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.442 176.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . 0.571 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 17.1 m120 -92.31 18.91 7.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.042 0.449 . . . . 0.0 111.845 -175.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.577 ' HD3' ' OD2' ' A' ' 983' ' ' ASP . 8.2 mpt_? -143.87 -178.27 5.84 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 106.344 -1.725 . . . . 0.0 106.344 -178.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.15 83.73 2.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 118.71 0.687 . . . . 0.0 112.008 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.411 HG12 ' HG2' ' A' ' 994' ' ' GLU . 15.8 m -143.65 157.63 16.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 C-N-CA 124.666 1.186 . . . . 0.0 107.966 178.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -55.22 173.01 0.11 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.599 0.36 . . . . 0.0 110.765 175.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.59 -31.4 72.61 Favored 'General case' 0 CA--C 1.492 -1.265 0 O-C-N 121.282 -0.886 . . . . 0.0 110.422 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . 0.441 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 24.4 mtmm -92.6 0.3 57.41 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.038 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.7 -21.16 41.58 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 112.257 -0.337 . . . . 0.0 112.257 175.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.441 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 81.6 m95 -50.6 124.96 11.89 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.411 ' HG2' HG12 ' A' ' 988' ' ' VAL . 23.7 mt-10 -99.1 157.63 16.22 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.871 -1.059 . . . . 0.0 109.287 176.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.718 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 86.5 t80 -82.63 86.38 6.84 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 113.366 -1.743 . . . . 0.0 109.096 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . 0.472 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -109.66 84.04 0.35 Allowed Glycine 0 CA--C 1.49 -1.484 0 C-N-CA 120.137 -1.03 . . . . 0.0 111.369 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.47 HD11 HD11 ' A' ' 999' ' ' ILE . 0.4 OUTLIER -92.16 131.92 37.93 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 CA-C-O 121.696 0.76 . . . . 0.0 110.722 -176.37 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . 0.443 ' OG1' ' HG3' ' A' 1005 ' ' PRO . 4.0 m -132.07 121.88 24.54 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.47 HD11 HD11 ' A' ' 997' ' ' ILE . 59.3 mt -115.24 98.25 50.08 Favored Pre-proline 0 C--N 1.316 -0.859 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -175.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 26.3 Cg_endo -62.27 132.23 37.82 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.403 2.069 . . . . 0.0 113.405 -176.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 1.2 Cg_endo -79.46 143.92 70.26 Favored 'Cis proline' 0 CA--C 1.51 -0.698 0 C-N-CA 123.117 -1.618 . . . . 0.0 112.293 -1.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 5.8 t0 -147.2 -174.8 4.61 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 113.764 -1.562 . . . . 0.0 107.883 -173.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -116.16 -61.77 1.68 Allowed 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -160.52 157.85 24.5 Favored Pre-proline 0 C--N 1.315 -0.901 0 N-CA-C 101.907 -3.368 . . . . 0.0 101.907 -177.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.443 ' HG3' ' OG1' ' A' ' 998' ' ' THR . 53.7 Cg_exo -59.12 121.11 9.39 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 CA-C-N 122.172 1.811 . . . . 0.0 109.864 174.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 60.6 mttt -66.04 -29.02 69.3 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -177.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.0 t -145.29 140.65 27.94 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 114.438 -1.256 . . . . 0.0 109.286 -165.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.546 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 63.8 m95 -126.12 138.66 53.7 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 125.213 1.57 . . . . 0.0 107.322 176.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.711 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 34.5 t -139.87 166.83 20.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 -176.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . 0.44 ' H ' HG12 ' A' 1009 ' ' VAL . . . -92.98 24.41 3.71 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -171.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -135.85 137.28 41.33 Favored 'General case' 0 C--N 1.315 -0.917 0 O-C-N 121.39 -0.819 . . . . 0.0 111.06 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.613 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.3 OUTLIER -92.57 132.41 36.87 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 175.851 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 96.2 mttt -152.53 176.83 11.28 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 -171.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.56 6.39 17.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.67 0.747 . . . . 0.0 111.008 -178.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -90.99 7.92 37.92 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 122.481 1.134 . . . . 0.0 108.243 175.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.718 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 20.7 m80 -88.12 172.29 9.62 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 114.168 -1.378 . . . . 0.0 111.812 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -158.0 -35.77 0.07 Allowed 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 112.3 -2.227 . . . . 0.0 106.266 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . 0.472 ' HB2' ' O ' ' A' ' 996' ' ' GLY . 35.1 m170 -132.08 151.65 51.65 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 170.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.409 ' HB3' ' HD2' ' A' 1016 ' ' HIS . 34.4 ptt180 -149.05 148.44 29.72 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 173.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.567 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.7 ptp180 -151.34 152.18 32.79 Favored 'General case' 0 CA--C 1.482 -1.657 0 C-N-CA 117.672 -1.611 . . . . 0.0 110.804 176.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.54 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 25.0 ptt180 -128.08 142.83 51.09 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.624 -177.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.781 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 32.8 ttm180 -78.43 123.32 26.9 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 114.243 -1.344 . . . . 0.0 110.27 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . . . . . . . . . 17.5 mt -103.88 129.85 51.42 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 103.978 -2.601 . . . . 0.0 103.978 168.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.445 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 17.0 m -105.87 133.68 49.56 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 O-C-N 123.63 0.582 . . . . 0.0 111.316 -172.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.454 ' HD2' ' HB3' ' A' ' 977' ' ' ASP . 13.4 tpt180 -135.52 103.98 5.66 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 172.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.6 OUTLIER -70.39 138.36 51.24 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.843 -1.54 . . . . 0.0 106.843 177.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.493 HH21 ' HD2' ' A' ' 970' ' ' PRO . 15.0 ptm180 -131.21 143.36 50.53 Favored 'General case' 0 CA--C 1.488 -1.439 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 -173.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.533 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 28.7 ttmt -132.77 134.35 44.6 Favored 'General case' 0 C--N 1.281 -2.371 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -175.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.583 ' C ' ' H ' ' A' 1031 ' ' LEU . 36.3 ttmt -84.17 -22.19 31.06 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 122.795 1.284 . . . . 0.0 107.815 -177.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 34.3 t70 65.6 -33.53 0.17 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 127.928 2.491 . . . . 0.0 112.566 -173.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' 1029 ' ' LYS . 21.9 tp 87.55 9.92 0.15 Allowed 'General case' 0 C--N 1.309 -1.16 0 C-N-CA 128.698 2.799 . . . . 0.0 109.718 174.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 4.4 m -112.69 -8.93 13.76 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 17.6 tt0 . . . . . 0 N--CA 1.439 -1.013 0 CA-C-N 113.534 -1.666 . . . . 0.0 109.654 -174.76 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . 0.473 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 25.2 m-70 . . . . . 0 CA--C 1.503 -0.864 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.65 122.03 45.21 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 160.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.755 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.0 OUTLIER -108.66 175.45 5.46 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.197 175.1 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.742 ' O ' ' HG2' ' A' 1027 ' ' ARG . 85.3 t80 -159.82 119.49 2.91 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 176.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.43 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 27.9 m -73.14 123.26 23.26 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 171.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . 0.69 ' HB2' ' HD2' ' A' 1027 ' ' ARG . 8.5 t70 -100.33 155.86 17.56 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -155.51 147.96 23.91 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.507 -171.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.537 HG22 ' H ' ' A' ' 935' ' ' TYR . 8.1 p -144.48 -179.53 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 N-CA-C 105.589 -2.004 . . . . 0.0 105.589 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.551 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 67.8 m-85 -136.69 150.81 48.67 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -178.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.572 ' O ' ' HA ' ' A' 1020 ' ' ARG . 7.3 tt0 -122.93 122.36 38.39 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . 0.52 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 29.4 m-80 -113.11 142.57 45.6 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 122.32 1.057 . . . . 0.0 112.833 -173.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.618 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 35.7 mt-10 -135.63 161.93 34.15 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 112.672 -2.058 . . . . 0.0 105.664 171.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . 0.476 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 34.9 p -149.56 158.97 44.66 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 118.65 0.659 . . . . 0.0 112.404 -175.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' 1017 ' ' THR . 37.5 ptt180 -156.77 159.52 38.37 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.731 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -75.94 165.26 54.59 Favored Pre-proline 0 C--N 1.311 -1.095 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 168.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -62.68 84.61 0.11 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 121.424 1.416 . . . . 0.0 110.643 171.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 132.49 -2.2 4.93 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -175.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . 0.512 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -96.42 -172.33 35.11 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 108.048 -2.021 . . . . 0.0 108.048 177.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -127.57 161.58 28.48 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 120.112 1.956 . . . . 0.0 105.803 170.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.658 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 54.6 m95 -64.07 134.8 55.62 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 122.282 1.039 . . . . 0.0 113.463 -169.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -136.27 175.62 3.41 Favored Pre-proline 0 C--N 1.309 -1.171 0 N-CA-C 104.391 -2.448 . . . . 0.0 104.391 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.86 126.92 24.14 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.707 1.605 . . . . 0.0 111.814 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . 0.476 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -80.84 15.01 1.92 Allowed 'General case' 0 C--O 1.239 0.532 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -178.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 78.37 -62.19 0.35 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 125.293 1.437 . . . . 0.0 108.623 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.83 83.77 2.79 Favored 'General case' 0 N--CA 1.417 -2.098 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.3 m -72.26 -58.72 3.18 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.694 -171.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . 0.551 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 88.3 m-85 -97.88 123.93 42.07 Favored 'General case' 0 C--N 1.309 -1.196 0 C-N-CA 119.053 -1.059 . . . . 0.0 110.095 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . 0.435 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 76.5 p -136.35 171.41 14.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.359 -170.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -95.75 176.93 5.95 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 105.685 -1.969 . . . . 0.0 105.685 175.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.64 -24.42 5.54 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 178.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . 0.712 HD21 ' HB2' ' A' ' 959' ' ' ASP . 4.1 p-10 -96.66 -4.03 41.64 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.655 -0.653 . . . . 0.0 111.35 178.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . 0.435 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 93.53 -1.49 69.21 Favored Glycine 0 CA--C 1.499 -0.96 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.165 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . 0.712 ' HB2' HD21 ' A' ' 957' ' ' ASN . 7.0 t70 -57.55 104.73 0.19 Allowed 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -51.94 133.62 32.28 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.876 0.846 . . . . 0.0 110.908 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -128.63 -173.94 3.1 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.767 -1.106 . . . . 0.0 108.991 -176.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . 0.47 ' HB1' ' HB3' ' A' ' 966' ' ' GLU . . . -75.99 157.81 32.64 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 176.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.5 m -77.52 156.96 80.65 Favored Pre-proline 0 N--CA 1.441 -0.92 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.653 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 52.4 Cg_exo -51.31 -20.12 7.68 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.457 2.772 . . . . 0.0 114.614 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.3 p -70.81 -57.8 4.27 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . 0.47 ' HB3' ' HB1' ' A' ' 962' ' ' ALA . 35.2 tt0 -69.09 -27.83 65.96 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.229 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 964' ' ' PRO . 31.6 mt -59.81 110.75 1.23 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 24.3 p -116.34 177.54 4.65 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.688 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.534 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 9.0 p -101.64 143.19 26.1 Favored Pre-proline 0 C--N 1.307 -1.28 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.676 178.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.607 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 97.4 Cg_endo -74.56 -179.37 4.77 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.029 2.486 . . . . 0.0 109.418 172.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.35 -51.78 9.75 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.922 1.748 . . . . 0.0 114.457 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.439 ' O ' ' HG2' ' A' 1033 ' ' GLN . . . -74.31 -46.24 21.47 Favored Glycine 0 N--CA 1.442 -0.961 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.992 -177.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.607 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 99.2 m95 -69.23 130.43 42.62 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.955 ' HB2' HE21 ' A' 1033 ' ' GLN . 6.5 tp10 -118.66 143.42 46.84 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 126.499 1.92 . . . . 0.0 109.748 -173.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -88.55 152.64 21.72 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.551 0.691 . . . . 0.0 111.446 173.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -137.86 -36.61 0.61 Allowed 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.673 177.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . 0.684 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.4 m-20 -77.62 149.66 34.73 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -174.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -54.81 -51.58 65.37 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 124.782 1.301 . . . . 0.0 113.186 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -168.77 167.76 10.95 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-O 120.877 0.37 . . . . 0.0 110.321 -175.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.653 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 33.5 m95 -74.72 114.71 13.47 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 177.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 2.6 p -123.95 149.23 46.18 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -172.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . 0.596 ' HA ' ' O ' ' A' 1022 ' ' ARG . 1.0 OUTLIER -74.21 129.54 38.01 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.577 0.703 . . . . 0.0 111.28 -172.797 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -87.75 135.26 33.45 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.806 -170.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 26.3 pt -115.68 24.79 4.62 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.985 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . 0.622 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 25.3 t-20 -101.44 15.64 28.18 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.783 0.802 . . . . 0.0 110.369 -175.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.622 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 8.7 mpt_? -138.24 -176.74 4.55 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 -174.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -78.01 75.63 4.54 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.953 0.883 . . . . 0.0 109.443 176.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 27.6 m -141.53 152.21 19.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.111 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -55.32 169.37 0.28 Allowed 'General case' 0 C--N 1.323 -0.567 0 O-C-N 123.89 0.744 . . . . 0.0 111.113 173.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -52.58 -32.24 40.17 Favored 'General case' 0 CA--C 1.493 -1.25 0 CA-C-O 121.65 0.738 . . . . 0.0 111.751 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . 0.444 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 70.9 mmtt -104.2 15.17 28.95 Favored 'General case' 0 N--CA 1.417 -2.085 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.95 -176.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 89.48 -15.81 57.76 Favored Glycine 0 C--O 1.226 -0.399 0 CA-C-N 115.587 -0.733 . . . . 0.0 113.028 174.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.683 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 82.0 m95 -58.78 109.53 0.83 Allowed 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -177.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.91 160.27 14.51 Favored 'General case' 0 C--O 1.254 1.301 0 C-N-CA 123.756 0.823 . . . . 0.0 110.952 173.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.663 ' HE1' ' HB ' ' A' ' 997' ' ' ILE . 0.3 OUTLIER -75.7 102.77 5.51 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 125.435 1.494 . . . . 0.0 112.09 -172.454 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . 0.44 ' HA2' ' HB3' ' A' 1005 ' ' PRO . . . -107.72 88.8 0.55 Allowed Glycine 0 CA--C 1.492 -1.405 0 C-N-CA 119.051 -1.547 . . . . 0.0 112.261 173.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.663 ' HB ' ' HE1' ' A' ' 995' ' ' TYR . 2.5 tt -97.24 127.64 49.28 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.082 0 O-C-N 121.341 -1.093 . . . . 0.0 110.198 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 20.7 m -118.42 82.9 1.92 Allowed 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 23.3 pt -104.4 130.81 22.63 Favored Pre-proline 0 C--N 1.316 -0.88 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.291 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 36.5 Cg_endo -64.54 145.29 87.15 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.703 2.269 . . . . 0.0 112.754 -178.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . 0.434 ' O ' ' HB2' ' A' 1002 ' ' ASP . 7.9 Cg_endo -91.26 135.55 9.03 Favored 'Cis proline' 0 N--CA 1.446 -1.323 0 C-N-CA 123.024 -1.657 . . . . 0.0 112.844 -2.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' 1001 ' ' PRO . 3.7 t70 158.69 170.37 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 111.523 -2.581 . . . . 0.0 105.822 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -149.81 33.97 0.68 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 118.646 0.657 . . . . 0.0 109.943 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 90.1 mttt -159.92 127.96 2.85 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.671 -176.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.711 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 32.8 Cg_exo -68.56 124.26 11.39 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 121.521 1.481 . . . . 0.0 109.984 172.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 45.8 pttt -123.35 8.16 9.06 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -174.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.3 t -138.83 116.48 11.4 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.711 ' CZ2' ' HB2' ' A' 1005 ' ' PRO . 62.0 m95 -121.96 134.49 54.83 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.939 -171.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 15.4 m -156.29 178.08 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 -175.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -94.98 104.64 16.52 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 175.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -169.71 176.38 4.91 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.255 0.347 . . . . 0.0 110.34 -176.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.62 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 10.2 tp10 -163.13 104.4 0.99 Allowed 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 122.221 1.01 . . . . 0.0 108.608 176.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' A' 1016 ' ' HIS . 73.0 mttt -135.62 157.45 46.85 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 113.667 -1.606 . . . . 0.0 109.263 -176.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 49.0 ttp -48.26 -41.64 28.31 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 125.137 1.375 . . . . 0.0 114.339 -177.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -59.23 -16.16 19.39 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.658 ' HB3' ' CH2' ' A' ' 946' ' ' TRP . 7.6 m80 -53.53 100.01 0.03 OUTLIER 'General case' 0 CA--C 1.511 -0.542 0 O-C-N 123.635 0.585 . . . . 0.0 111.345 172.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . 0.528 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.0 OUTLIER -96.88 -22.72 16.72 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 122.845 1.307 . . . . 0.0 108.178 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 14.3 m170 -139.68 157.89 45.03 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 113.437 -1.711 . . . . 0.0 108.237 -178.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.683 ' HG2' ' CE3' ' A' ' 993' ' ' TRP . 44.8 ttp180 -157.82 148.44 20.85 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 5.4 ptp180 -152.1 166.34 31.96 Favored 'General case' 0 CA--C 1.487 -1.478 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.643 178.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.502 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 33.6 ptt180 -145.45 150.02 35.76 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.747 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.596 ' O ' ' HA ' ' A' ' 982' ' ' TYR . 41.4 ttm180 -87.22 120.91 28.99 Favored 'General case' 0 N--CA 1.437 -1.112 0 O-C-N 123.212 0.32 . . . . 0.0 110.758 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.568 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 86.1 mt -97.61 124.38 41.88 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 170.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.557 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 16.4 m -109.45 141.88 23.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 CA-C-O 121.823 0.82 . . . . 0.0 111.512 -175.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.543 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.4 tpt180 -134.45 104.78 6.25 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 113.662 -1.608 . . . . 0.0 107.936 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.684 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -75.19 146.62 41.09 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -178.35 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.742 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 13.1 ptm180 -147.35 171.37 15.55 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -170.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.755 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 15.5 ptpt -158.58 152.4 23.5 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 178.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.56 ' C ' ' H ' ' A' 1031 ' ' LEU . 38.1 ttmt -84.23 -10.72 57.45 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 122.812 1.291 . . . . 0.0 107.682 -176.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . 0.478 ' HB3' ' HB2' ' A' 1033 ' ' GLN . 32.0 t70 72.23 -20.47 0.25 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 112.011 -2.359 . . . . 0.0 112.717 178.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . 0.56 ' H ' ' C ' ' A' 1029 ' ' LYS . 19.7 tp 78.17 -12.86 1.02 Allowed 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 127.78 2.432 . . . . 0.0 112.202 177.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 6.7 t -135.36 9.58 3.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 122.167 0.984 . . . . 0.0 108.822 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.955 HE21 ' HB2' ' A' ' 974' ' ' GLU . 3.1 tp-100 . . . . . 0 N--CA 1.438 -1.067 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 174.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . 0.466 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 9.6 m-70 . . . . . 0 CA--C 1.51 -0.571 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.5 m -166.18 115.54 0.95 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 101.404 -3.554 . . . . 0.0 101.404 169.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.531 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 1.4 pm0 -142.92 136.04 28.2 Favored 'General case' 0 C--N 1.286 -2.193 0 CA-C-N 119.684 1.129 . . . . 0.0 109.005 177.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.459 ' O ' ' HG2' ' A' 1027 ' ' ARG . 79.2 t80 -137.64 137.75 38.76 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -177.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.639 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 17.1 m -76.3 133.65 39.97 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.345 0.117 . . . . 0.0 110.995 178.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -111.08 163.82 13.47 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.541 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 10.6 pt-20 -151.24 150.74 30.94 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -173.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' 1022 ' ' ARG . 7.1 p -138.82 175.39 8.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 N-CA-C 106.191 -1.781 . . . . 0.0 106.191 175.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.7 ' HA ' ' O ' ' A' 1021 ' ' ARG . 68.2 m-85 -139.43 146.47 40.14 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -175.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.73 ' O ' ' HA ' ' A' 1020 ' ' ARG . 30.0 tt0 -121.59 120.33 34.5 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -174.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . 0.525 ' HA ' ' O ' ' A' 1019 ' ' ARG . 26.2 m-80 -109.14 140.43 42.74 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.361 1.077 . . . . 0.0 112.891 -172.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.581 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 66.1 mt-10 -133.83 158.68 42.78 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 104.345 -2.465 . . . . 0.0 104.345 170.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 17.4 m -142.56 151.8 41.94 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 119.017 0.826 . . . . 0.0 111.48 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.662 ' O ' ' HA ' ' A' 1017 ' ' THR . 32.1 ptt180 -148.98 159.52 44.14 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.568 178.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -79.68 164.46 53.37 Favored Pre-proline 0 C--N 1.302 -1.499 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 171.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -64.04 91.44 0.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 121.123 1.215 . . . . 0.0 109.909 172.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 123.95 0.53 9.0 Favored Glycine 0 N--CA 1.44 -1.065 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 -175.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . 0.566 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -101.26 -175.08 28.82 Favored Glycine 0 CA--C 1.505 -0.586 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 178.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -119.37 166.7 12.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.977 1.889 . . . . 0.0 105.989 169.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.581 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 40.8 m95 -71.72 138.73 48.72 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-O 122.146 0.974 . . . . 0.0 112.408 -171.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -129.16 174.32 4.69 Favored Pre-proline 0 C--N 1.307 -1.251 0 N-CA-C 103.736 -2.691 . . . . 0.0 103.736 175.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -56.74 133.29 57.06 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 CA-C-N 121.364 1.523 . . . . 0.0 111.335 174.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.86 -170.88 0.12 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.681 0.753 . . . . 0.0 112.456 177.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.51 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.0 OUTLIER -91.51 -36.82 13.51 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -178.012 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -120.43 105.65 11.07 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 104.912 -2.255 . . . . 0.0 104.912 169.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.1 m -66.62 -64.3 0.88 Allowed 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.101 -176.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . 0.628 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 73.4 m-85 -93.02 135.56 34.08 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 118.834 -1.146 . . . . 0.0 110.446 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . 0.436 ' HA ' ' H ' ' A' ' 961' ' ' ALA . 77.0 p -147.2 -177.27 5.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -174.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -103.29 -178.05 3.55 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 170.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.59 -26.08 12.44 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 176.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -87.52 -51.33 5.97 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 121.907 -0.496 . . . . 0.0 110.869 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 146.05 -7.63 1.43 Allowed Glycine 0 CA--C 1.493 -1.344 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.741 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.96 108.64 1.25 Allowed 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 175.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 961' ' ' ALA . 50.7 tttm -47.19 119.94 2.88 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.598 1.186 . . . . 0.0 110.526 178.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.479 ' O ' ' HG2' ' A' ' 960' ' ' LYS . . . -90.2 175.4 7.15 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . 0.529 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -72.44 -52.82 14.2 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.148 -1.021 . . . . 0.0 112.683 -175.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 57.1 p 138.48 156.53 0.0 OUTLIER Pre-proline 0 C--N 1.309 -1.191 0 C-N-CA 126.913 2.085 . . . . 0.0 109.919 -171.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.482 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 4.8 Cg_endo -58.92 -26.34 80.68 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 121.879 1.719 . . . . 0.0 112.291 172.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 50.7 m -74.19 -53.31 10.1 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 175.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . 0.529 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 33.3 mt-10 -75.42 5.26 6.0 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.437 ' HA ' HD13 ' A' ' 967' ' ' LEU . 0.4 OUTLIER -96.79 111.94 23.9 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 172.205 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 18.7 p -110.74 174.31 5.92 Favored 'General case' 0 C--N 1.296 -1.761 0 CA-C-O 121.221 0.534 . . . . 0.0 111.491 -174.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.421 ' HA ' ' NH2' ' A' 1027 ' ' ARG . 16.1 p -108.73 128.85 24.77 Favored Pre-proline 0 N--CA 1.436 -1.152 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 173.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.647 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 73.5 Cg_endo -73.49 166.02 30.93 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.995 2.464 . . . . 0.0 110.337 177.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -49.64 -30.75 22.91 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.111 2.54 . . . . 0.0 114.13 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.689 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -107.31 23.17 27.54 Favored Glycine 0 N--CA 1.437 -1.235 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.577 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.647 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 75.7 m95 -135.74 132.84 37.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 117.629 0.714 . . . . 0.0 110.335 172.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.617 ' HB3' ' O ' ' A' 1028 ' ' LYS . 3.9 tp10 -111.54 142.15 44.2 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.547 ' CE3' ' HG2' ' A' 1025 ' ' ARG . 75.7 m95 -76.3 138.56 40.6 Favored 'General case' 0 C--N 1.298 -1.663 0 C-N-CA 118.014 -1.474 . . . . 0.0 111.106 170.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . 0.46 ' CG ' ' HB3' ' A' 1026 ' ' LYS . 4.2 pt-20 -108.92 -34.66 6.57 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . 0.425 ' HB3' ' HG3' ' A' 1025 ' ' ARG . 5.5 t0 -87.16 159.39 18.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 175.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -89.58 -31.99 17.33 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.647 -172.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -157.14 170.28 22.86 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 -174.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.555 ' HA ' ' O ' ' A' 1024 ' ' VAL . 23.6 m95 -94.73 110.07 21.96 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 175.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 50.0 m -124.57 158.94 31.8 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -178.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . 0.459 ' HA ' ' O ' ' A' 1022 ' ' ARG . 6.6 p90 -74.65 144.82 43.65 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -167.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -95.53 120.95 36.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.217 -176.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.45 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.6 pp -105.62 9.4 9.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.907 -177.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -94.46 39.68 1.09 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.793 1.282 . . . . 0.0 107.921 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.419 HH21 ' CD ' ' A' ' 994' ' ' GLU . 57.6 mtp85 -145.47 176.88 9.26 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -175.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -77.86 85.5 4.12 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 174.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.45 HG21 ' HA ' ' A' ' 984' ' ' ILE . 20.5 m -127.08 -173.34 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.933 -178.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -96.7 -174.15 2.93 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -66.22 -34.01 77.06 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.42 0.628 . . . . 0.0 109.404 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -91.31 6.12 46.55 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.124 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . 0.445 ' HA2' ' HB ' ' A' ' 988' ' ' VAL . . . 67.35 80.34 0.2 Allowed Glycine 0 C--O 1.215 -1.089 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -179.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.511 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 98.2 m95 -151.98 145.25 24.69 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.474 ' HB2' ' HB3' ' A' 1008 ' ' TRP . 4.9 pt-20 -119.4 157.29 28.5 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 122.33 1.062 . . . . 0.0 113.83 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.754 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 6.8 t80 -74.21 101.84 4.11 Favored 'General case' 0 C--O 1.209 -1.067 0 C-N-CA 128.686 2.795 . . . . 0.0 112.689 -173.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . 0.413 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -119.82 111.7 2.07 Favored Glycine 0 N--CA 1.434 -1.479 0 C-N-CA 119.63 -1.271 . . . . 0.0 111.299 173.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.608 HG22 ' HA ' ' A' 1016 ' ' HIS . 10.3 pt -121.54 145.12 28.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 175.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 13.6 t -139.04 140.39 38.09 Favored 'General case' 0 N--CA 1.425 -1.711 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 176.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.474 ' O ' HD12 ' A' ' 999' ' ' ILE . 2.3 pp -107.38 130.23 23.14 Favored Pre-proline 0 C--N 1.306 -1.306 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.087 -179.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 55.9 Cg_endo -71.69 139.98 34.88 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.345 2.03 . . . . 0.0 112.815 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 5.7 Cg_endo -92.85 156.63 19.99 Favored 'Cis proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.747 -1.772 . . . . 0.0 112.028 -3.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 12.3 t70 -168.77 -93.98 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.001 175.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 167.83 -75.64 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.5 0 C-N-CA 125.057 1.343 . . . . 0.0 109.335 -177.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -129.14 141.06 40.48 Favored Pre-proline 0 C--N 1.317 -0.823 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -171.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.442 ' HG2' ' HB2' ' A' 1018 ' ' HIS . 80.4 Cg_exo -54.45 143.66 65.72 Favored 'Trans proline' 0 CA--C 1.511 -0.628 0 C-N-CA 123.326 2.684 . . . . 0.0 110.3 167.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 43.9 mmtt -106.16 -45.23 4.37 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 -176.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 14.4 m -97.35 144.69 26.86 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 112.624 -2.08 . . . . 0.0 111.359 -169.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.725 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 66.0 m95 -135.22 136.09 41.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.797 1.239 . . . . 0.0 107.862 -178.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.541 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 57.4 t -146.77 173.39 2.64 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.745 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -172.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . 0.448 ' N ' HG12 ' A' 1009 ' ' VAL . . . -78.91 -18.79 53.26 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -177.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -92.9 107.68 19.41 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -169.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.434 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 18.2 tp10 -72.19 121.59 19.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.914 0.864 . . . . 0.0 109.78 171.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.455 ' H ' ' CE1' ' A' 1016 ' ' HIS . 28.6 mtpp -124.09 152.85 42.24 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.811 -174.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 51.6 ttp -57.34 -37.99 73.41 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 124.212 0.945 . . . . 0.0 112.4 178.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -72.55 19.76 0.08 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.754 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.9 OUTLIER -69.77 175.07 4.52 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-O 122.174 0.987 . . . . 0.0 112.473 174.914 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . 0.662 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.7 OUTLIER -158.52 -35.44 0.07 Allowed 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 113.307 -1.77 . . . . 0.0 109.102 -172.924 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . 0.442 ' HB2' ' HG2' ' A' 1005 ' ' PRO . 0.2 OUTLIER -138.58 147.48 43.05 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.72 -178.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 937' ' ' ASN . 40.3 ttp180 -145.91 143.7 29.72 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 177.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.73 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.6 ptp180 -150.88 165.92 32.14 Favored 'General case' 0 C--O 1.2 -1.502 0 O-C-N 123.881 0.738 . . . . 0.0 109.362 176.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.7 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.1 ptt180 -144.59 148.55 34.51 Favored 'General case' 0 C--N 1.295 -1.788 0 O-C-N 123.613 0.57 . . . . 0.0 110.693 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.541 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 37.2 ttm180 -84.48 119.48 25.2 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 123.924 0.765 . . . . 0.0 110.254 178.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.415 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 69.4 mt -97.99 126.64 43.49 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 168.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.555 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 11.1 m -104.75 143.55 16.02 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.656 0 CA-C-O 121.01 0.433 . . . . 0.0 111.716 -174.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.547 ' HG2' ' CE3' ' A' ' 975' ' ' TRP . 0.5 OUTLIER -148.09 113.66 5.66 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.133 167.797 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.639 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.5 tmtp? -77.56 154.09 32.71 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 177.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 11.4 ptm180 -142.37 153.21 43.6 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 -176.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.617 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 36.3 ttmt -142.08 136.64 30.34 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 -172.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.689 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.0 ttmt -90.23 -24.65 20.9 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 123.057 1.408 . . . . 0.0 107.586 -177.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . 0.466 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 16.2 t0 54.7 12.33 0.55 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 112.23 -2.259 . . . . 0.0 111.043 -170.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 19.0 tp 66.71 -42.18 0.4 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.339 2.256 . . . . 0.0 112.229 -176.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 14.9 p -97.61 30.49 2.91 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -175.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.555 ' CD ' ' HB2' ' A' ' 974' ' ' GLU . 4.3 mm100 . . . . . 0 N--CA 1.472 0.638 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.304 173.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . 0.442 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 16.8 m-70 . . . . . 0 CA--C 1.506 -0.718 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.64 120.75 5.27 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 101.71 -3.441 . . . . 0.0 101.71 165.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.531 ' HG3' ' HE2' ' A' 1026 ' ' LYS . 0.5 OUTLIER -145.27 150.26 36.34 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 176.18 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.571 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.1 t80 -143.21 140.13 30.58 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 175.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 27.8 m -77.91 127.78 32.91 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.789 -0.764 . . . . 0.0 109.886 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -96.55 149.34 21.87 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 104.627 -2.361 . . . . 0.0 104.627 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -150.03 151.49 33.36 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 118.694 0.679 . . . . 0.0 110.721 -172.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.583 HG22 ' H ' ' A' ' 935' ' ' TYR . 9.8 p -147.8 -178.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 N-CA-C 105.026 -2.213 . . . . 0.0 105.026 176.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.583 ' H ' HG22 ' A' ' 934' ' ' VAL . 77.0 m-85 -141.13 151.12 43.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.678 ' O ' ' HA ' ' A' 1020 ' ' ARG . 32.6 tt0 -119.74 113.47 20.68 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 -174.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -105.0 147.13 28.13 Favored 'General case' 0 C--N 1.313 -1.012 0 O-C-N 123.679 0.612 . . . . 0.0 110.684 -176.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.639 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 41.7 mt-10 -142.88 159.43 42.24 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 170.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . 0.675 ' HB3' ' CD2' ' A' 1018 ' ' HIS . 12.8 p -141.7 145.81 35.32 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' 1017 ' ' THR . 22.9 ptt180 -148.36 161.44 41.56 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 124.59 1.156 . . . . 0.0 107.949 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -67.28 158.21 82.61 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 172.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.96 88.95 0.07 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 121.656 1.571 . . . . 0.0 111.16 174.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 103.07 71.06 0.86 Allowed Glycine 0 N--CA 1.43 -1.712 0 N-CA-C 108.153 -1.979 . . . . 0.0 108.153 -175.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.04 -146.75 4.81 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.731 -174.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -129.79 132.23 46.46 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 124.475 1.11 . . . . 0.0 110.311 -176.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.639 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 40.9 m95 -76.13 151.91 36.86 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 121.792 0.806 . . . . 0.0 112.052 -173.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -143.79 153.13 57.36 Favored Pre-proline 0 C--N 1.307 -1.271 0 N-CA-C 103.807 -2.664 . . . . 0.0 103.807 176.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -49.2 126.26 15.14 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.667 2.244 . . . . 0.0 112.626 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -75.61 23.87 0.12 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -171.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 79.3 -61.03 0.34 Allowed 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.738 1.615 . . . . 0.0 109.196 177.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -100.88 73.74 1.58 Allowed 'General case' 0 N--CA 1.415 -2.199 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 25.4 m -63.1 -60.42 3.46 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.414 -173.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . 0.564 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 68.4 m-85 -93.49 123.28 36.69 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 119.661 -0.816 . . . . 0.0 111.265 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 15.6 p -142.66 173.88 11.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 113.962 -1.472 . . . . 0.0 110.702 -170.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . 0.475 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 13.0 t70 -92.42 170.07 10.06 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 104.854 -2.276 . . . . 0.0 104.854 170.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.99 -30.89 27.03 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 118.591 0.632 . . . . 0.0 111.526 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -91.44 8.44 36.32 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 89.35 -7.49 81.9 Favored Glycine 0 CA--C 1.503 -0.718 0 C-N-CA 120.14 -1.029 . . . . 0.0 114.033 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . 0.475 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 20.3 t70 -52.89 101.76 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 172.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -54.9 125.86 22.01 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.885 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -125.76 175.86 7.33 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.741 -177.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . 0.595 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -70.38 160.23 32.7 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . 0.41 ' HB3' ' HD2' ' A' ' 964' ' ' PRO . 7.2 m -89.23 159.93 43.79 Favored Pre-proline 0 N--CA 1.427 -1.624 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.62 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.4 Cg_exo -47.66 -28.94 10.02 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.184 3.256 . . . . 0.0 116.771 -174.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 25.0 m -76.32 -43.17 42.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 119.041 0.837 . . . . 0.0 109.79 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . 0.595 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 35.5 mt-10 -64.9 -30.08 71.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.056 176.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.443 HD13 ' CH2' ' A' ' 980' ' ' TRP . 77.5 mt -72.34 114.42 10.44 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.909 176.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 41.6 p -121.34 170.33 9.72 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.622 -175.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 5.1 p -87.16 141.52 32.99 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 121.076 0.465 . . . . 0.0 111.356 178.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.595 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 27.8 Cg_endo -87.49 166.4 7.73 Favored 'Trans proline' 0 C--O 1.242 0.713 0 C-N-CA 122.437 2.092 . . . . 0.0 111.256 176.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.23 108.56 0.99 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 121.617 1.545 . . . . 0.0 110.292 173.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.688 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 115.53 5.67 18.45 Favored Glycine 0 N--CA 1.44 -1.057 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.874 -176.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.595 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 93.7 m95 -138.98 136.56 35.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 117.784 0.792 . . . . 0.0 111.937 178.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.511 ' HB3' ' O ' ' A' 1028 ' ' LYS . 4.8 tp10 -116.19 134.05 55.35 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 125.635 1.574 . . . . 0.0 107.706 -174.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.676 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 81.0 m95 -79.66 104.74 10.46 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 118.885 -1.126 . . . . 0.0 109.528 173.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -75.84 -42.61 49.16 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.83 143.0 55.98 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.74 -38.21 73.51 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -175.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.03 152.19 7.47 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 120.593 0.235 . . . . 0.0 110.392 -173.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.622 ' HA ' ' O ' ' A' 1024 ' ' VAL . 40.4 m95 -65.5 113.83 4.44 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 1.5 p -122.65 159.78 27.17 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -171.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 17.1 p90 -74.38 141.18 45.14 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 119.515 1.052 . . . . 0.0 111.205 -174.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.438 ' HB3' ' HB3' ' A' 1022 ' ' ARG . 7.8 t70 -81.56 120.8 25.51 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.701 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 12.6 pt -126.37 42.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -110.59 6.35 21.78 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 113.882 -1.508 . . . . 0.0 107.665 -172.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.513 ' HD3' ' NH1' ' A' 1022 ' ' ARG . 52.2 mtm180 -136.06 -176.25 4.25 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.534 -171.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.27 80.5 3.04 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.996 174.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.491 HG11 ' NH2' ' A' ' 986' ' ' ARG . 22.1 m -135.7 162.04 37.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.016 -174.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -56.13 173.48 0.16 Allowed 'General case' 0 N--CA 1.468 0.466 0 O-C-N 124.526 1.142 . . . . 0.0 111.207 172.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -53.28 -35.57 60.22 Favored 'General case' 0 CA--C 1.493 -1.246 0 C-N-CA 123.689 0.796 . . . . 0.0 111.671 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . 0.466 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 75.6 mmtt -106.46 12.91 29.13 Favored 'General case' 0 N--CA 1.417 -2.101 0 C-N-CA 118.878 -1.129 . . . . 0.0 111.805 -175.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 92.84 -11.46 72.05 Favored Glycine 0 CA--C 1.504 -0.648 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 174.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.509 ' CD2' ' HD2' ' A' 1019 ' ' ARG . 83.1 m95 -54.37 133.29 45.28 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 122.272 1.034 . . . . 0.0 111.848 177.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.706 ' HG2' ' O ' ' A' 1020 ' ' ARG . 5.5 pt-20 -117.82 152.04 36.14 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.579 -1.192 . . . . 0.0 109.864 -178.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.726 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 43.2 t80 -69.4 90.99 0.54 Allowed 'General case' 0 C--O 1.201 -1.451 0 CA-C-N 112.43 -2.168 . . . . 0.0 110.862 -175.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . 0.614 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -114.18 79.91 0.28 Allowed Glycine 0 N--CA 1.436 -1.361 0 C-N-CA 118.952 -1.594 . . . . 0.0 111.874 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -92.88 149.56 4.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 C-N-CA 117.123 -1.831 . . . . 0.0 108.355 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 36.9 m -124.71 98.02 5.54 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.758 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 22.2 pt -74.55 130.32 82.05 Favored Pre-proline 0 C--N 1.319 -0.728 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.479 176.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 55.3 Cg_endo -70.51 141.56 42.5 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.914 2.409 . . . . 0.0 113.071 -179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . 0.427 ' O ' ' HB2' ' A' 1002 ' ' ASP . 7.4 Cg_endo -91.29 149.84 18.27 Favored 'Cis proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.406 -1.497 . . . . 0.0 111.534 -2.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' 1001 ' ' PRO . 2.6 t70 163.69 160.55 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.987 0 O-C-N 124.972 1.42 . . . . 0.0 107.509 -177.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -134.61 33.88 3.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.314 0.578 . . . . 0.0 109.7 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 88.3 mttt -158.82 123.54 2.22 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.807 -174.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.465 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 33.4 Cg_exo -71.51 133.11 21.75 Favored 'Trans proline' 0 C--O 1.239 0.543 0 C-N-CA 122.278 1.985 . . . . 0.0 110.476 168.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 54.2 mmtt -94.27 -49.61 5.64 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 10.3 t -92.08 148.94 21.79 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.243 -177.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.669 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 58.0 m95 -138.37 137.54 37.41 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 176.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.672 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 33.0 t -144.42 169.78 8.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -172.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . 0.419 ' N ' HG12 ' A' 1009 ' ' VAL . . . -79.65 -12.96 59.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -179.217 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -91.81 109.42 20.74 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -174.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.547 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 1.0 OUTLIER -81.85 105.11 12.71 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 172.88 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.508 ' H ' ' CE1' ' A' 1016 ' ' HIS . 61.3 mtpt -107.83 161.92 14.47 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.246 -1.343 . . . . 0.0 112.123 -176.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 57.0 ttp -55.15 -44.53 75.21 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.245 -0.889 . . . . 0.0 113.158 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -72.73 18.09 0.1 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.726 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.8 OUTLIER -67.24 114.48 6.0 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.668 172.258 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . 0.447 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.0 OUTLIER -93.11 -25.27 17.96 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 122.8 1.286 . . . . 0.0 108.173 176.239 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . 0.675 ' CD2' ' HB3' ' A' ' 939' ' ' SER . 46.2 m80 -141.75 150.5 41.85 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.879 -1.509 . . . . 0.0 109.937 178.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.509 ' HD2' ' CD2' ' A' ' 993' ' ' TRP . 31.2 ptt180 -141.94 148.84 39.31 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 171.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.706 ' O ' ' HG2' ' A' ' 994' ' ' GLU . 37.7 ttp180 -152.61 165.51 34.97 Favored 'General case' 0 C--N 1.283 -2.283 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 29.0 ptt180 -155.35 159.26 39.8 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 178.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.513 ' NH1' ' HD3' ' A' ' 986' ' ' ARG . 38.6 ttm180 -86.46 132.81 33.84 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 45.6 mt -102.35 129.34 48.77 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 104.663 -2.347 . . . . 0.0 104.663 166.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.622 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 20.1 m -109.64 141.92 23.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.495 -171.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.502 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.9 tpt180 -141.12 98.52 3.39 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 114.048 -1.433 . . . . 0.0 107.945 172.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.531 ' HE2' ' HG3' ' A' ' 929' ' ' GLU . 0.3 OUTLIER -71.62 134.76 46.59 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 -177.55 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.676 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.3 ptm180 -128.68 143.15 50.87 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -172.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.511 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.0 ttmt -137.89 139.28 39.76 Favored 'General case' 0 C--N 1.283 -2.307 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -172.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.688 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 32.4 ttmt -91.49 -17.52 25.57 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 123.737 1.732 . . . . 0.0 107.561 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . 0.442 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 21.5 t70 53.02 8.99 0.11 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 111.37 -2.65 . . . . 0.0 112.48 -169.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 22.9 tp 69.4 -33.46 0.25 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.207 1.803 . . . . 0.0 111.75 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . 0.414 ' H ' ' C ' ' A' 1030 ' ' ASP . 12.6 t -79.03 -3.48 45.36 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -175.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 . . . . . 0 C--N 1.326 -0.428 0 C-N-CA 119.84 -0.744 . . . . 0.0 111.012 177.675 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . 0.458 ' HA ' ' O ' ' A' 1030 ' ' ASP . 13.6 m-70 . . . . . 0 CA--C 1.5 -0.978 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.15 108.99 1.94 Allowed 'General case' 0 N--CA 1.412 -2.35 0 N-CA-C 101.428 -3.545 . . . . 0.0 101.428 169.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.3 OUTLIER -137.39 144.57 42.52 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 178.233 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.497 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.8 t80 -137.39 138.06 39.48 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 105.888 -1.893 . . . . 0.0 105.888 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.632 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 26.9 m -74.08 129.98 38.9 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 176.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . 0.535 ' HB2' ' HD2' ' A' 1027 ' ' ARG . 4.6 t70 -102.34 156.26 17.7 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.528 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.0 pt-20 -150.53 153.64 36.16 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.155 0.502 . . . . 0.0 111.324 -172.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.524 ' O ' ' HA ' ' A' 1022 ' ' ARG . 9.4 p -146.53 179.01 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 N-CA-C 106.182 -1.784 . . . . 0.0 106.182 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.52 ' HA ' ' O ' ' A' 1021 ' ' ARG . 28.3 m-85 -144.07 113.95 7.25 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 119.653 1.115 . . . . 0.0 111.297 -174.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -81.36 132.78 35.35 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 123.57 0.544 . . . . 0.0 110.211 172.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . 0.481 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 27.6 m-80 -121.55 155.85 34.13 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 124.385 1.074 . . . . 0.0 113.116 -176.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.678 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 42.4 mt-10 -142.29 152.82 43.36 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 105.252 -2.129 . . . . 0.0 105.252 169.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 34.5 m -128.59 144.83 51.23 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 123.488 0.492 . . . . 0.0 111.018 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.493 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 20.7 ptt180 -149.92 161.75 41.68 Favored 'General case' 0 N--CA 1.433 -1.299 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -176.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -66.18 163.15 40.97 Favored Pre-proline 0 C--N 1.312 -1.023 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 172.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -66.64 90.41 0.28 Allowed 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 121.32 1.347 . . . . 0.0 111.271 177.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 97.15 72.19 1.09 Allowed Glycine 0 N--CA 1.434 -1.444 0 N-CA-C 107.88 -2.088 . . . . 0.0 107.88 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.67 -152.57 6.94 Favored Glycine 0 N--CA 1.44 -1.061 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.769 -174.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -108.38 136.29 48.27 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.377 -0.912 . . . . 0.0 109.54 -177.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.678 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 44.8 m95 -85.29 145.81 27.35 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-O 121.782 0.801 . . . . 0.0 109.486 -178.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -127.53 169.11 13.08 Favored Pre-proline 0 C--N 1.298 -1.665 0 N-CA-C 104.232 -2.507 . . . . 0.0 104.232 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -57.68 124.24 15.59 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 121.497 1.464 . . . . 0.0 109.599 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.04 10.7 0.05 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -174.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 79.4 -51.39 0.42 Allowed 'General case' 0 CA--C 1.481 -1.691 0 C-N-CA 124.533 1.133 . . . . 0.0 109.577 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -113.22 94.57 4.94 Favored 'General case' 0 N--CA 1.402 -2.84 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.1 m -72.89 -56.94 4.47 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.216 -173.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -94.92 122.4 37.53 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-O 122.164 0.983 . . . . 0.0 111.694 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 77.4 p -137.77 173.09 12.01 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.503 -173.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -95.85 172.63 7.9 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 171.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.96 -32.37 45.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 119.286 0.948 . . . . 0.0 110.843 174.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -80.39 -2.33 45.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.606 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 89.52 -9.12 78.23 Favored Glycine 0 CA--C 1.496 -1.108 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.843 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -51.8 103.44 0.06 Allowed 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 124.532 0.784 . . . . 0.0 110.733 175.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -51.86 121.91 7.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.444 -1.253 . . . . 0.0 108.472 177.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -123.32 -172.95 2.62 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.177 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -82.97 162.15 21.56 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . 0.462 ' HB3' ' HD2' ' A' ' 964' ' ' PRO . 3.8 m -88.61 157.63 49.33 Favored Pre-proline 0 N--CA 1.43 -1.429 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.662 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 6.9 Cg_exo -43.03 -32.46 2.8 Favored 'Trans proline' 0 CA--C 1.542 0.884 1 C-N-CA 125.607 4.204 . . . . 0.0 117.901 -174.81 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 19.9 m -86.64 -35.25 19.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 122.194 0.997 . . . . 0.0 108.951 -176.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -72.96 -12.14 60.83 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.31 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 28.2 mt -89.35 110.36 21.17 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 21.1 p -114.25 -172.01 2.02 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.921 -174.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.588 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 15.4 p -114.96 129.49 25.01 Favored Pre-proline 0 C--N 1.317 -0.825 0 O-C-N 121.96 -0.463 . . . . 0.0 111.172 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.612 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 72.8 Cg_endo -70.69 169.82 19.19 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 123.213 2.609 . . . . 0.0 110.826 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -48.09 -33.56 21.28 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.887 2.391 . . . . 0.0 113.659 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.642 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -110.61 34.01 5.61 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-O 119.233 -0.76 . . . . 0.0 113.76 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.612 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 61.0 m95 -146.24 141.13 27.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.922 0.861 . . . . 0.0 110.878 169.192 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.6 ' HB3' ' O ' ' A' 1028 ' ' LYS . 7.5 tp10 -125.56 147.83 49.13 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 -176.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.467 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 63.6 m95 -75.91 143.54 41.62 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 122.237 1.018 . . . . 0.0 112.875 175.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . 0.623 ' HG2' ' HB3' ' A' 1028 ' ' LYS . 2.4 mm-40 -109.41 -44.38 3.91 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.564 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -91.51 159.13 16.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.137 -170.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.22 -52.81 60.73 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.067 0.947 . . . . 0.0 112.889 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -162.92 160.27 24.68 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 -173.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.662 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 23.8 m95 -75.38 116.8 16.48 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 20.8 m -125.15 159.91 30.37 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 -175.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -74.98 134.86 41.39 Favored 'General case' 0 C--N 1.298 -1.634 0 C-N-CA 119.34 -0.944 . . . . 0.0 110.629 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.513 ' HB2' HG13 ' A' 1024 ' ' VAL . 39.7 t0 -82.01 124.78 30.09 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.36 -176.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.0 pp -121.89 11.97 5.87 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 121.71 0.767 . . . . 0.0 110.516 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -87.54 23.26 1.97 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.396 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 986' ' ' ARG . 37.8 mtp-105 -146.47 -176.82 5.33 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.151 -174.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.38 83.72 7.39 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.49 HG12 ' HG2' ' A' ' 994' ' ' GLU . 27.6 m -135.37 160.49 40.22 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.745 -178.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -55.3 169.11 0.29 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.102 0.561 . . . . 0.0 110.006 169.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -59.62 -33.03 70.97 Favored 'General case' 0 CA--C 1.503 -0.842 0 O-C-N 122.012 -0.43 . . . . 0.0 111.64 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -95.36 4.15 53.68 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 119.851 -0.74 . . . . 0.0 111.046 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.07 -21.79 40.42 Favored Glycine 0 C--O 1.223 -0.571 0 CA-C-N 116.575 -0.284 . . . . 0.0 112.827 175.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.519 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 81.8 m95 -50.92 121.88 6.65 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.49 ' HG2' HG12 ' A' ' 988' ' ' VAL . 19.2 mt-10 -98.96 149.45 22.96 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.556 0.694 . . . . 0.0 110.185 177.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.688 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 55.5 t80 -76.5 87.06 3.22 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 126.304 1.842 . . . . 0.0 109.963 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . 0.614 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -112.86 91.44 0.59 Allowed Glycine 0 CA--C 1.485 -1.81 0 C-N-CA 119.966 -1.111 . . . . 0.0 110.359 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.557 HG22 ' HA ' ' A' 1016 ' ' HIS . 9.5 pt -104.48 151.14 7.07 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.521 -175.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.6 t -137.42 135.85 37.29 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 172.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 62.7 mt -117.44 106.21 47.05 Favored Pre-proline 0 C--N 1.313 -0.995 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 20.5 Cg_endo -61.94 137.74 69.29 Favored 'Trans proline' 0 C--O 1.241 0.634 0 C-N-CA 122.618 2.212 . . . . 0.0 112.873 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 5.4 Cg_endo -82.9 141.85 44.76 Favored 'Cis proline' 0 N--CA 1.45 -1.06 0 C-N-CA 122.756 -1.768 . . . . 0.0 113.336 0.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 28.8 t70 -158.36 -98.62 0.03 OUTLIER 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 112.634 -2.076 . . . . 0.0 108.626 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . 0.505 ' HD2' ' HB2' ' A' 1004 ' ' LYS . 2.5 p-80 164.08 -45.78 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.719 1.262 . . . . 0.0 113.189 175.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . 0.505 ' HB2' ' HD2' ' A' 1003 ' ' HIS . 52.9 mttp -164.86 141.58 4.91 Favored Pre-proline 0 CA--C 1.51 -0.579 0 N-CA-C 106.033 -1.839 . . . . 0.0 106.033 -169.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.42 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 68.1 Cg_exo -50.16 122.33 9.09 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 121.246 1.297 . . . . 0.0 111.409 173.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . 0.407 ' H ' ' HG2' ' A' 1006 ' ' LYS . 37.6 pttt -107.2 5.5 27.78 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.784 -175.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . 0.458 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 44.7 t -141.63 138.47 32.57 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -176.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.637 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 49.1 m95 -135.39 135.55 40.73 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.569 ' HB ' ' HB3' ' A' ' 995' ' ' TYR . 81.6 t -143.27 166.37 14.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -172.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -88.63 10.05 21.97 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -122.18 130.97 53.7 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 119.091 0.859 . . . . 0.0 112.927 -175.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.582 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 19.1 tp10 -79.09 112.67 16.52 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 122.064 0.935 . . . . 0.0 108.876 175.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.484 ' H ' ' CE1' ' A' 1016 ' ' HIS . 45.0 mttp -125.11 158.91 32.7 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.929 -1.487 . . . . 0.0 110.7 -175.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 45.0 ttp -53.95 -43.74 70.1 Favored 'General case' 0 C--N 1.311 -1.094 0 O-C-N 124.241 0.963 . . . . 0.0 112.952 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -49.7 -11.19 0.05 Allowed 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 175.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.688 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 16.8 m80 -58.93 154.4 15.38 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.86 1.314 . . . . 0.0 112.007 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -160.31 -34.45 0.05 Allowed 'General case' 0 C--N 1.286 -2.161 0 CA-C-N 111.141 -2.754 . . . . 0.0 105.765 -168.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.97 153.0 46.76 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 113.097 -1.865 . . . . 0.0 108.311 174.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.519 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 40.9 ptt180 -160.1 152.57 20.94 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 173.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.551 ' HG2' ' CZ3' ' A' 1008 ' ' TRP . 4.0 ptp180 -152.29 148.64 27.78 Favored 'General case' 0 CA--C 1.486 -1.492 0 C-N-CA 118.352 -1.339 . . . . 0.0 110.309 177.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.9 ptt180 -124.65 140.63 52.76 Favored 'General case' 0 C--N 1.293 -1.873 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.927 -177.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.528 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 38.7 ttm180 -81.07 123.12 28.12 Favored 'General case' 0 N--CA 1.422 -1.853 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.725 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 77.2 mt -95.8 127.01 41.46 Favored 'General case' 0 N--CA 1.422 -1.827 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 168.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.513 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.1 m -106.55 139.6 27.44 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.386 -174.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.531 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.7 tpt180 -143.19 101.4 3.8 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.186 -1.37 . . . . 0.0 107.845 171.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.632 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -71.44 147.46 47.84 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.214 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.535 ' HD2' ' HB2' ' A' ' 932' ' ' ASP . 12.1 ptm180 -140.91 151.46 44.27 Favored 'General case' 0 C--O 1.206 -1.213 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -172.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.827 ' HG2' ' H ' ' A' 1030 ' ' ASP . 30.4 ttmt -138.24 140.26 39.59 Favored 'General case' 0 C--O 1.197 -1.705 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 -174.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 29.3 ttmt -88.92 -4.47 58.45 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.844 0.831 . . . . 0.0 109.557 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . 0.827 ' H ' ' HG2' ' A' 1028 ' ' LYS . 2.1 t70 83.15 -68.6 0.06 Allowed 'General case' 0 CA--C 1.498 -1.055 0 CA-C-N 113.041 -1.891 . . . . 0.0 106.25 -173.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . 0.438 ' HB2' ' HA ' ' A' ' 927' ' ' HIS . 34.0 tp 149.9 -29.2 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.706 0 O-C-N 127.171 2.795 . . . . 0.0 108.584 173.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 25.6 p -114.67 14.08 17.5 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.675 0.75 . . . . 0.0 111.218 -170.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.528 ' HB2' ' O ' ' A' 1029 ' ' LYS . 29.5 tt0 . . . . . 0 N--CA 1.445 -0.703 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.278 -177.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.487 -1.475 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.4 116.42 32.6 Favored 'General case' 0 N--CA 1.409 -2.495 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 163.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.717 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.5 OUTLIER -126.55 132.24 51.38 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 179.874 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.48 ' O ' ' HG2' ' A' 1027 ' ' ARG . 87.4 t80 -124.52 139.17 54.13 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 20.5 m -74.19 123.39 24.4 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -97.82 150.31 21.41 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 105.048 -2.205 . . . . 0.0 105.048 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.553 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 9.1 pt-20 -143.66 146.89 33.57 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 118.622 0.647 . . . . 0.0 110.899 -175.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.524 HG22 ' H ' ' A' ' 935' ' ' TYR . 11.2 p -135.45 174.72 12.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.58 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 59.5 m-85 -135.54 146.38 47.98 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 118.674 0.67 . . . . 0.0 110.54 -175.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.587 ' O ' ' HA ' ' A' 1020 ' ' ARG . 53.2 mt-30 -112.87 116.57 30.23 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 124.567 1.167 . . . . 0.0 108.072 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -101.95 137.64 39.96 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 121.957 0.884 . . . . 0.0 112.312 -177.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 948' ' ' PRO . 29.3 mt-10 -138.43 150.48 46.54 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 113.261 -1.791 . . . . 0.0 106.619 170.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 47.1 t -144.4 154.91 43.47 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.132 -169.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.516 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 36.6 ptt180 -141.83 157.38 45.08 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -75.91 172.94 8.03 Favored Pre-proline 0 C--N 1.305 -1.353 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -66.73 48.74 0.29 Allowed 'Trans proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.99 2.46 . . . . 0.0 112.259 171.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . 0.586 ' HA2' ' SD ' ' A' 1014 ' ' MET . . . 155.98 37.15 0.02 OUTLIER Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.537 -176.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . 0.516 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -132.62 -173.39 13.29 Favored Glycine 0 CA--C 1.499 -0.949 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -120.14 165.92 14.12 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 174.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.526 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 34.3 m95 -72.56 124.52 25.4 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-O 121.15 0.5 . . . . 0.0 110.306 -173.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -124.97 159.7 57.75 Favored Pre-proline 0 C--N 1.304 -1.388 0 N-CA-C 104.411 -2.44 . . . . 0.0 104.411 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.558 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 88.4 Cg_exo -49.08 138.85 27.42 Favored 'Trans proline' 0 CA--C 1.527 0.152 0 C-N-CA 122.226 1.951 . . . . 0.0 112.493 -178.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -76.78 -161.78 0.22 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.585 -178.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -95.84 -38.24 10.38 Favored 'General case' 0 CA--C 1.481 -1.679 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . 0.714 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 27.8 m-20 -116.45 100.71 8.06 Favored 'General case' 0 N--CA 1.404 -2.726 0 N-CA-C 104.588 -2.375 . . . . 0.0 104.588 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 7.4 m -60.03 -56.78 17.49 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 123.689 0.618 . . . . 0.0 111.421 -172.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . 0.58 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 92.8 m-85 -103.86 135.3 45.65 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-O 121.455 0.645 . . . . 0.0 111.56 -179.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 76.7 p -148.98 -176.05 5.19 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -174.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -106.19 -174.22 2.48 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 173.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.6 -31.05 34.46 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 175.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -77.72 -50.24 12.8 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.959 -0.463 . . . . 0.0 111.215 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 133.65 -3.02 4.6 Favored Glycine 0 CA--C 1.494 -1.28 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -177.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -58.35 107.3 0.47 Allowed 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.174 -1.013 . . . . 0.0 109.678 175.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . 0.714 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 26.2 tptp -47.16 112.69 0.56 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 113.709 -1.587 . . . . 0.0 110.12 175.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -112.68 178.7 4.2 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.279 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . 0.497 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -71.48 155.84 40.13 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . 0.402 ' HB2' ' HD2' ' A' ' 964' ' ' PRO . 5.9 p -77.81 162.43 67.82 Favored Pre-proline 0 N--CA 1.434 -1.256 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.415 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 10.3 Cg_endo -58.61 -25.6 75.52 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.779 2.319 . . . . 0.0 112.559 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 1.2 m -68.35 -49.93 56.74 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . 0.497 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 47.4 mt-10 -64.66 -33.92 77.08 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.26 -1.336 . . . . 0.0 112.68 177.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.487 HD13 ' CH2' ' A' ' 980' ' ' TRP . 69.4 mt -67.29 112.16 4.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.811 0.815 . . . . 0.0 111.929 -178.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 21.7 p -117.4 171.19 8.15 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.286 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 19.2 p -87.1 138.54 32.57 Favored Pre-proline 0 C--N 1.319 -0.755 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.637 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.6 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 68.9 Cg_endo -82.88 163.61 15.87 Favored 'Trans proline' 0 C--O 1.243 0.734 0 C-N-CA 122.365 2.043 . . . . 0.0 111.083 178.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -61.82 102.98 0.26 Allowed 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 121.928 1.752 . . . . 0.0 110.15 173.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.483 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 127.21 -7.64 7.14 Favored Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.468 -0.873 . . . . 0.0 111.159 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.6 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.6 m95 -136.49 139.8 42.57 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.611 0.72 . . . . 0.0 111.105 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.617 ' HB2' HE21 ' A' 1033 ' ' GLN . 9.2 tp10 -123.66 136.9 54.75 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 126.26 1.824 . . . . 0.0 108.539 -173.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.632 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 91.3 m95 -84.6 158.73 20.79 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 119.436 1.016 . . . . 0.0 110.724 175.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -139.99 -36.78 0.49 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.09 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . 0.555 ' HB3' ' HD2' ' A' 1025 ' ' ARG . 9.9 t70 -67.43 150.52 48.8 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -68.32 -43.72 76.97 Favored 'General case' 0 C--N 1.314 -0.941 0 O-C-N 123.161 0.288 . . . . 0.0 111.577 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.07 159.27 12.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.749 0.309 . . . . 0.0 110.494 -172.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.541 ' HA ' ' O ' ' A' 1024 ' ' VAL . 17.1 m95 -76.43 91.45 3.31 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -177.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 18.5 t -103.45 162.11 13.3 Favored 'General case' 0 C--O 1.205 -1.254 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . 0.424 ' HA ' ' O ' ' A' 1022 ' ' ARG . 8.2 p90 -73.55 139.27 45.52 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 121.646 0.736 . . . . 0.0 111.801 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.466 ' HB2' HG13 ' A' 1024 ' ' VAL . 26.2 t70 -99.89 130.88 46.12 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.406 -175.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.466 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.4 pp -114.85 18.79 7.4 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.884 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.99 34.3 1.39 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -175.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.424 ' HB2' HG13 ' A' ' 988' ' ' VAL . 63.1 mtp180 -145.47 179.91 7.1 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -177.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -81.8 82.09 7.6 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 172.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.466 HG21 ' HA ' ' A' ' 984' ' ' ILE . 18.6 m -128.96 -170.79 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.794 -173.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -96.39 -172.23 2.48 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 105.265 -2.124 . . . . 0.0 105.265 -178.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -58.28 -33.42 69.41 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 122.94 0.496 . . . . 0.0 111.155 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -112.12 23.79 13.33 Favored 'General case' 0 N--CA 1.427 -1.601 0 C-N-CA 118.761 -1.176 . . . . 0.0 112.927 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 90.78 -11.91 70.38 Favored Glycine 0 C--O 1.229 -0.212 0 C-N-CA 120.112 -1.042 . . . . 0.0 112.899 173.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.59 ' HA ' ' HB3' ' A' 1021 ' ' ARG . 94.8 m95 -52.18 143.85 13.61 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 175.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.583 ' O ' ' HG3' ' A' 1019 ' ' ARG . 9.6 pt-20 -130.3 143.28 50.68 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 174.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.556 ' CD2' ' HA ' ' A' 1011 ' ' ALA . 1.4 t80 -104.54 115.96 31.25 Favored 'General case' 0 C--N 1.285 -2.226 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.894 -165.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . 0.447 ' HA2' ' O ' ' A' 1007 ' ' SER . . . -132.63 144.76 16.68 Favored Glycine 0 N--CA 1.435 -1.383 0 CA-C-O 122.016 0.787 . . . . 0.0 112.354 -177.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.684 ' HA ' ' HA ' ' A' 1016 ' ' HIS . 0.1 OUTLIER -93.24 173.66 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.502 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . 0.405 ' HG1' ' HG3' ' A' 1005 ' ' PRO . 39.6 m -169.17 98.63 0.36 Allowed 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 104.995 -2.224 . . . . 0.0 104.995 178.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.448 ' O ' ' HB2' ' A' 1002 ' ' ASP . 68.0 mt -116.11 108.71 45.66 Favored Pre-proline 0 C--N 1.314 -0.969 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 -175.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.03 140.4 78.63 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 123.38 2.72 . . . . 0.0 113.609 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -76.17 150.28 93.33 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.029 -1.655 . . . . 0.0 111.295 -1.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.5 t70 -172.15 -153.69 0.08 Allowed 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.14 -0.936 . . . . 0.0 108.899 -172.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.3 m170 -151.87 -82.48 0.09 Allowed 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.44 0.696 . . . . 0.0 110.351 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 80.6 mttt -128.84 154.4 80.05 Favored Pre-proline 0 C--N 1.309 -1.188 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 177.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.405 ' HG3' ' HG1' ' A' ' 998' ' ' THR . 52.4 Cg_exo -55.52 125.34 18.81 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 121.888 1.725 . . . . 0.0 111.305 174.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 20.4 pttp -100.06 4.51 44.72 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.313 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . 0.447 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 48.5 t -142.89 122.99 13.65 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.217 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.488 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 66.8 m95 -122.89 133.15 54.42 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.36 1.464 . . . . 0.0 107.055 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.416 HG23 ' HB3' ' A' ' 995' ' ' TYR . 15.8 m -143.98 -164.98 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -178.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -91.64 -35.31 14.28 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 120.246 1.385 . . . . 0.0 110.045 174.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . 0.556 ' HA ' ' CD2' ' A' ' 995' ' ' TYR . . . 171.72 172.66 0.09 Allowed 'General case' 0 CA--C 1.508 -0.64 0 O-C-N 123.81 0.694 . . . . 0.0 111.962 -172.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' 1013 ' ' LYS . 10.9 pt-20 160.22 -61.93 0.0 OUTLIER 'General case' 0 C--N 1.345 0.4 0 O-C-N 126.691 2.494 . . . . 0.0 112.626 174.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.431 ' N ' ' HG3' ' A' 1012 ' ' GLU . 59.1 mttp -131.14 149.56 52.54 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -165.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . 0.586 ' SD ' ' HA2' ' A' ' 943' ' ' GLY . 59.4 ttp -65.02 -23.96 67.36 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.738 -1.574 . . . . 0.0 112.63 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . 0.42 ' O ' HG22 ' A' ' 997' ' ' ILE . 60.2 m-85 -61.06 -6.94 2.18 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 175.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.684 ' HA ' ' HA ' ' A' ' 997' ' ' ILE . 16.1 m80 -90.71 106.08 18.26 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.656 -2.35 . . . . 0.0 104.656 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 17.9 p -100.24 -6.45 26.0 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -169.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 13.6 m170 -129.45 142.5 50.77 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 122.062 -0.399 . . . . 0.0 110.826 -174.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 994' ' ' GLU . 10.4 ttm180 -150.94 146.99 26.63 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 177.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.587 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 3.5 ptp180 -148.55 166.51 28.02 Favored 'General case' 0 C--O 1.199 -1.566 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 177.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.59 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 23.7 ptt180 -146.35 150.85 36.49 Favored 'General case' 0 C--N 1.287 -2.128 0 O-C-N 123.389 0.431 . . . . 0.0 110.005 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.553 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.4 ttm180 -88.91 129.57 35.59 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 123.487 0.492 . . . . 0.0 111.422 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.559 HD21 ' OE1' ' A' ' 936' ' ' GLN . 70.8 mt -104.98 137.71 42.32 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 105.217 -2.142 . . . . 0.0 105.217 165.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.541 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 12.8 m -113.16 141.24 29.52 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 CA-C-O 122.027 0.918 . . . . 0.0 111.958 -176.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.555 ' HD2' ' HB3' ' A' ' 977' ' ' ASP . 11.8 tpt180 -138.7 100.69 4.14 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 113.579 -1.646 . . . . 0.0 106.682 172.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -74.14 146.22 43.67 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -178.186 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.632 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 10.3 ptm180 -142.62 166.65 24.08 Favored 'General case' 0 CA--C 1.493 -1.234 0 N-CA-C 105.842 -1.91 . . . . 0.0 105.842 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.717 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 13.3 ptpt -156.13 155.8 33.16 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-O 121.033 0.445 . . . . 0.0 110.348 -178.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 29.3 ttmt -83.73 -21.65 32.21 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 22.0 t70 44.36 23.51 0.07 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 111.298 -2.683 . . . . 0.0 112.024 -171.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 23.0 tp 66.12 -39.42 0.32 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.097 2.159 . . . . 0.0 113.455 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 9.8 t -69.95 -22.58 63.16 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 123.132 0.573 . . . . 0.0 112.092 -176.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.617 HE21 ' HB2' ' A' ' 974' ' ' GLU . 21.1 mt-30 . . . . . 0 CA--C 1.509 -0.627 0 C-N-CA 119.018 -1.073 . . . . 0.0 112.489 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 49.4 m-70 . . . . . 0 CA--C 1.488 -1.433 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . 0.426 ' HB ' ' HE3' ' A' 1029 ' ' LYS . 1.5 m 63.34 87.58 0.11 Allowed 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 124.601 1.188 . . . . 0.0 107.843 -165.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.861 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.4 OUTLIER -102.75 168.19 9.4 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 179.652 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.632 ' O ' ' HG2' ' A' 1027 ' ' ARG . 89.5 t80 -153.98 120.86 5.62 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 10.2 m -79.23 121.64 25.31 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 174.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -103.51 146.12 29.01 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 104.944 -2.243 . . . . 0.0 104.944 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.456 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -145.42 147.91 32.74 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 118.331 0.514 . . . . 0.0 110.965 -173.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 4.6 p -151.88 134.02 5.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 120.981 0.42 . . . . 0.0 110.085 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' 1021 ' ' ARG . 94.9 m-85 -93.4 152.1 19.33 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -175.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.59 ' HG2' ' CE1' ' A' ' 953' ' ' TYR . 21.5 mt-30 -112.09 113.69 26.1 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 105.434 -2.062 . . . . 0.0 105.434 174.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . 0.469 ' HB3' ' HB2' ' A' ' 949' ' ' ALA . 12.2 m-80 -106.34 139.42 40.86 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -176.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.61 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 85.3 mt-10 -135.07 152.67 51.89 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 176.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 50.5 m -145.34 137.47 25.67 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.163 0.506 . . . . 0.0 111.596 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.549 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 18.3 ptt180 -139.82 161.63 37.11 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 124.446 1.098 . . . . 0.0 108.084 -174.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -65.29 161.56 48.61 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 170.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -66.21 86.73 0.25 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 121.458 1.439 . . . . 0.0 111.912 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 99.85 70.04 0.92 Allowed Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 107.728 -2.149 . . . . 0.0 107.728 -175.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -166.08 -148.04 5.41 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.57 -173.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -110.77 128.4 55.73 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 122.737 0.415 . . . . 0.0 110.984 -176.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.61 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 56.1 m95 -73.53 152.73 40.55 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-O 121.835 0.826 . . . . 0.0 109.695 176.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -133.57 169.18 14.62 Favored Pre-proline 0 C--N 1.3 -1.549 0 N-CA-C 103.452 -2.795 . . . . 0.0 103.452 171.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.2 124.4 16.16 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 N-CA-C 107.959 -1.593 . . . . 0.0 107.959 170.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . 0.469 ' HB2' ' HB3' ' A' ' 937' ' ' ASN . . . -37.68 -58.25 0.91 Allowed 'General case' 0 N--CA 1.483 1.215 0 O-C-N 124.877 1.361 . . . . 0.0 113.894 -171.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -168.29 -39.81 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 104.633 -2.358 . . . . 0.0 104.633 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -131.31 160.17 35.75 Favored 'General case' 0 N--CA 1.434 -1.259 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 168.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.0 m -93.65 -57.8 2.46 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 118.205 0.457 . . . . 0.0 110.391 -175.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . 0.59 ' CE1' ' HG2' ' A' ' 936' ' ' GLN . 58.3 m-85 -97.46 127.4 43.39 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 122.008 0.909 . . . . 0.0 110.729 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . 0.495 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 1.1 p -144.0 167.14 23.08 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.31 -170.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -97.63 -173.68 2.7 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . 0.494 ' HA ' ' CE1' ' A' ' 935' ' ' TYR . . . -51.25 -27.18 8.54 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . 0.563 HD21 ' HB2' ' A' ' 959' ' ' ASP . 23.1 p-10 -92.78 -37.74 12.17 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.293 0.568 . . . . 0.0 111.518 178.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . 0.495 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 110.38 52.15 0.6 Allowed Glycine 0 CA--C 1.484 -1.864 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 -173.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . 0.563 ' HB2' HD21 ' A' ' 957' ' ' ASN . 17.7 t70 -121.07 106.38 11.51 Favored 'General case' 0 N--CA 1.419 -2.004 0 N-CA-C 100.977 -3.712 . . . . 0.0 100.977 176.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -44.21 123.89 3.67 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 124.926 1.391 . . . . 0.0 112.251 -176.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -121.93 -174.93 2.99 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 113.318 -1.764 . . . . 0.0 108.933 -175.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . 0.525 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -71.8 147.88 46.8 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 3.7 m -75.29 158.72 83.5 Favored Pre-proline 0 C--N 1.313 -1.018 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.6 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 29.2 Cg_exo -54.75 -21.49 25.66 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.916 2.411 . . . . 0.0 114.428 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 5.7 p -74.27 -49.44 23.15 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.78 0.8 . . . . 0.0 109.31 175.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . 0.525 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 32.6 mt-10 -65.36 -30.01 70.79 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.295 -1.32 . . . . 0.0 110.666 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' A' ' 964' ' ' PRO . 71.4 mt -67.49 111.74 4.29 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.284 0.634 . . . . 0.0 109.557 176.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.2 p -116.55 168.51 10.11 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -171.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.538 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 5.8 p -96.86 121.9 58.17 Favored Pre-proline 0 N--CA 1.44 -0.973 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.369 175.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.658 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 28.9 Cg_endo -82.8 175.56 8.56 Favored 'Trans proline' 0 C--O 1.242 0.686 0 C-N-CA 123.92 3.08 . . . . 0.0 111.198 178.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.86 111.05 0.85 Allowed 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 122.15 1.9 . . . . 0.0 111.645 176.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.544 ' O ' ' HA ' ' A' 1029 ' ' LYS . . . 108.69 -3.54 32.32 Favored Glycine 0 N--CA 1.431 -1.653 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.852 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.658 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 97.3 m95 -120.4 122.62 41.15 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 122.405 1.098 . . . . 0.0 112.688 -178.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.566 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 7.5 tp10 -108.18 123.18 48.34 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 126.953 2.101 . . . . 0.0 111.599 -172.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 24.0 m95 -78.95 105.84 10.55 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.699 172.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . 0.46 ' CD ' ' HE3' ' A' 1028 ' ' LYS . 38.9 mt-10 -73.4 -43.94 59.46 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 121.581 0.705 . . . . 0.0 109.663 175.083 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.02 146.18 54.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.466 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -76.62 -32.11 57.84 Favored 'General case' 0 C--N 1.318 -0.785 0 O-C-N 123.462 0.476 . . . . 0.0 110.84 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -163.43 157.23 19.62 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.655 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 27.1 m95 -72.93 113.22 9.72 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 177.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 18.8 m -120.45 150.36 40.93 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 -172.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' A' 1022 ' ' ARG . 0.3 OUTLIER -74.2 126.57 30.9 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.688 0.756 . . . . 0.0 110.727 -175.675 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -83.03 143.19 30.78 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-N 113.516 -1.675 . . . . 0.0 111.041 -167.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 15.6 pt -133.66 23.45 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.942 0.877 . . . . 0.0 109.38 176.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . 0.417 ' O ' ' HD3' ' A' ' 986' ' ' ARG . 3.4 t-20 -96.12 13.94 25.55 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 178.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.417 ' HD3' ' O ' ' A' ' 985' ' ' ASN . 1.0 OUTLIER -134.02 177.46 7.72 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 114.243 -1.344 . . . . 0.0 107.414 -175.071 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -88.27 82.17 7.14 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.926 0.869 . . . . 0.0 109.471 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.504 HG12 ' HG2' ' A' ' 994' ' ' GLU . 15.4 m -138.49 164.64 26.29 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 114.147 -1.388 . . . . 0.0 109.373 -177.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -55.44 169.98 0.26 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.923 0.489 . . . . 0.0 110.494 171.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -58.61 -30.92 67.6 Favored 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 121.911 -0.493 . . . . 0.0 111.664 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . 0.507 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 48.1 mttm -98.67 9.86 42.37 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 119.414 -0.915 . . . . 0.0 110.868 178.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.69 -13.98 65.28 Favored Glycine 0 C--O 1.226 -0.357 0 CA-C-N 116.724 -0.217 . . . . 0.0 112.646 174.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.507 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 85.1 m95 -51.54 130.97 29.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.844 0.83 . . . . 0.0 112.718 178.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.504 ' HG2' HG12 ' A' ' 988' ' ' VAL . 29.5 mt-10 -107.96 155.79 19.93 Favored 'General case' 0 C--O 1.251 1.148 0 C-N-CA 124.042 0.937 . . . . 0.0 109.413 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.66 ' HB3' ' H ' ' A' 1009 ' ' VAL . 26.2 t80 -81.08 96.72 7.25 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 112.456 -2.156 . . . . 0.0 110.216 -177.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . 0.402 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -121.86 106.06 1.05 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 118.863 -1.637 . . . . 0.0 111.86 174.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.517 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -111.0 151.1 13.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 O-C-N 120.931 -1.335 . . . . 0.0 108.484 178.539 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 5.2 m -127.69 103.3 7.23 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 176.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 62.9 mt -80.64 123.42 82.61 Favored Pre-proline 0 C--N 1.318 -0.803 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.43 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 25.1 Cg_endo -61.84 142.16 92.52 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.462 2.108 . . . . 0.0 112.938 -178.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . 0.43 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 11.1 Cg_endo -96.87 145.96 6.24 Favored 'Cis proline' 0 N--CA 1.452 -0.938 0 C-N-CA 123.366 -1.514 . . . . 0.0 113.636 -2.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 6.6 t70 168.28 -179.54 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 104.435 -2.431 . . . . 0.0 104.435 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -132.37 -33.86 1.25 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 118.861 0.755 . . . . 0.0 112.074 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 79.3 mttt -112.8 132.51 22.25 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -177.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.42 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 52.1 Cg_exo -59.61 134.31 57.04 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 123.179 2.586 . . . . 0.0 109.99 168.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . 0.402 ' HE2' ' HB3' ' A' 1006 ' ' LYS . 12.6 ptpt -116.94 15.86 15.16 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 122.434 1.112 . . . . 0.0 109.196 -177.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 41.9 t -148.01 137.81 22.51 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 113.948 -1.478 . . . . 0.0 108.235 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.617 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 56.5 m95 -136.17 137.34 40.82 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.66 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 47.0 t -143.21 178.65 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 N-CA-C 104.183 -2.525 . . . . 0.0 104.183 -173.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . 0.51 ' H ' HG12 ' A' 1009 ' ' VAL . . . -99.83 4.34 45.16 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 120.072 1.305 . . . . 0.0 112.657 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -86.59 -168.29 2.18 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 121.736 -0.602 . . . . 0.0 112.294 -178.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.542 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.4 OUTLIER -159.39 106.8 1.75 Allowed 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.735 0.778 . . . . 0.0 108.954 -174.739 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.44 ' H ' ' CE1' ' A' 1016 ' ' HIS . 98.2 mttt -113.55 148.32 36.34 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.761 -178.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 51.7 ttp -47.67 -39.14 16.49 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 124.146 0.904 . . . . 0.0 112.158 176.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -61.37 -0.35 0.37 Allowed 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.542 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 2.9 m80 -61.83 118.95 7.86 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 178.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . 0.536 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 25.4 p -104.79 -18.45 14.25 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.736 174.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 5.1 m80 -140.93 151.18 44.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.9 -177.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -156.94 151.88 26.0 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 170.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.453 ' HB3' ' OD1' ' A' ' 937' ' ' ASN . 6.1 ptp180 -151.26 163.84 37.96 Favored 'General case' 0 C--O 1.187 -2.199 0 C-N-CA 118.886 -1.126 . . . . 0.0 109.567 175.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.566 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 25.6 ptt180 -141.75 148.62 39.29 Favored 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.919 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.519 ' O ' ' HA ' ' A' ' 982' ' ' TYR . 41.3 ttm180 -90.42 122.11 32.99 Favored 'General case' 0 N--CA 1.44 -0.933 0 O-C-N 123.525 0.515 . . . . 0.0 111.684 -178.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.655 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 83.6 mt -91.58 129.59 37.53 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 106.009 -1.849 . . . . 0.0 106.009 166.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . . . . . . . . . 8.0 m -112.16 137.45 44.86 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 CA-C-O 122.219 1.009 . . . . 0.0 111.518 -177.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.464 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 6.3 tpt180 -137.06 101.32 4.52 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 113.1 -1.863 . . . . 0.0 108.278 171.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.493 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -82.1 148.9 28.3 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.632 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 11.5 ptm180 -144.07 179.24 7.33 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 104.915 -2.254 . . . . 0.0 104.915 -171.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.861 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 15.8 ptpt -162.17 160.71 27.45 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 175.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.544 ' HA ' ' O ' ' A' ' 972' ' ' GLY . 35.6 ttmt -87.81 -16.47 34.01 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-O 123.027 1.394 . . . . 0.0 107.758 -177.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 22.7 t70 55.46 16.56 1.85 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 112.019 -2.355 . . . . 0.0 110.661 -172.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 37.8 tp 62.51 -56.62 0.14 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.583 1.553 . . . . 0.0 112.26 -172.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 11.6 p -87.1 0.61 54.99 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 -172.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.566 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 47.6 mt-30 . . . . . 0 CA--C 1.519 -0.24 0 C-N-CA 118.16 -1.416 . . . . 0.0 110.302 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . 0.482 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 42.2 m-70 . . . . . 0 N--CA 1.445 -0.696 0 N-CA-C 106.155 -1.795 . . . . 0.0 106.155 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -168.58 116.98 0.7 Allowed 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 169.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -137.58 129.77 29.21 Favored 'General case' 0 C--N 1.288 -2.07 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 174.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -121.55 138.12 54.44 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.59 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 31.3 m -77.84 122.34 25.32 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 175.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -96.56 175.02 6.55 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.68 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.6 pt-20 -168.83 143.72 3.24 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.497 0.665 . . . . 0.0 110.958 -171.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.595 HG22 ' H ' ' A' ' 935' ' ' TYR . 13.0 p -135.47 -177.61 2.08 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 173.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.595 ' H ' HG22 ' A' ' 934' ' ' VAL . 87.3 m-85 -137.27 146.18 44.42 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 118.862 0.755 . . . . 0.0 109.09 -178.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' A' 1020 ' ' ARG . 30.9 tt0 -116.81 118.05 31.42 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 -179.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 -109.18 142.33 40.13 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-O 122.141 0.972 . . . . 0.0 111.536 -175.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.561 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 62.0 mt-10 -128.95 162.57 27.26 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 170.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 38.1 m -146.89 152.75 39.2 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.978 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.444 ' O ' ' HA ' ' A' 1017 ' ' THR . 25.9 ptt180 -149.45 159.84 43.95 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 114.947 -1.024 . . . . 0.0 108.876 177.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -75.82 161.71 74.82 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 170.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . 0.404 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 23.0 Cg_exo -66.42 92.91 0.29 Allowed 'Trans proline' 0 N--CA 1.458 -0.586 0 N-CA-C 109.169 -1.127 . . . . 0.0 109.169 171.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 119.68 11.03 7.38 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -172.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . 0.408 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -109.45 -174.07 21.01 Favored Glycine 0 CA--C 1.498 -0.988 0 N-CA-C 108.203 -1.959 . . . . 0.0 108.203 176.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -120.97 159.26 25.97 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 105.561 -2.014 . . . . 0.0 105.561 170.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.561 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 43.0 m95 -71.07 125.96 28.29 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-O 121.428 0.633 . . . . 0.0 111.374 -172.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -114.9 172.54 3.53 Favored Pre-proline 0 C--N 1.299 -1.607 0 N-CA-C 102.634 -3.099 . . . . 0.0 102.634 170.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -54.73 147.66 49.01 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 CA-C-N 121.649 1.624 . . . . 0.0 111.848 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -69.35 -170.06 0.25 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.777 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.47 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.0 OUTLIER -98.21 -29.01 13.45 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 -179.221 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -120.53 88.15 2.88 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 103.765 -2.68 . . . . 0.0 103.765 173.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 20.5 m -62.03 -51.97 65.87 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.004 -172.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . 0.47 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 79.8 m-85 -103.31 133.9 47.61 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 119.551 -0.86 . . . . 0.0 111.097 177.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 72.7 p -142.91 174.77 10.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.48 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -109.81 -173.48 2.27 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.84 -36.19 36.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 114.044 1.128 . . . . 0.0 114.044 -174.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -101.34 11.13 39.79 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 92.78 0.18 69.31 Favored Glycine 0 CA--C 1.497 -1.042 0 C-N-CA 119.53 -1.319 . . . . 0.0 111.578 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -56.82 104.11 0.14 Allowed 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 174.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . 0.473 ' HD3' ' C ' ' A' ' 960' ' ' LYS . 7.8 tmtm? -49.52 118.5 2.8 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 124.158 0.911 . . . . 0.0 108.887 176.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -121.71 176.0 5.95 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.13 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -66.32 149.9 49.68 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 123.638 0.586 . . . . 0.0 110.661 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 15.6 m -85.38 156.73 59.44 Favored Pre-proline 0 N--CA 1.437 -1.119 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.511 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.3 Cg_exo -48.16 -32.81 19.85 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.397 3.398 . . . . 0.0 116.636 -173.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.6 p -75.81 -45.33 36.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.461 1.124 . . . . 0.0 109.437 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -65.2 -27.26 68.56 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.037 -1.892 . . . . 0.0 110.585 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.476 HD13 ' CH2' ' A' ' 980' ' ' TRP . 33.1 mt -71.49 120.6 17.31 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.061 0.944 . . . . 0.0 110.371 175.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 26.1 p -125.07 170.94 10.68 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.979 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 6.6 p -82.87 148.53 57.52 Favored Pre-proline 0 C--N 1.315 -0.925 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.998 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.581 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 20.0 Cg_endo -91.6 165.75 3.42 Favored 'Trans proline' 0 C--O 1.239 0.568 0 C-N-CA 123.004 2.469 . . . . 0.0 111.267 174.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.11 108.33 1.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 121.709 1.606 . . . . 0.0 110.579 174.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.616 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 118.93 1.71 14.45 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 120.908 -0.663 . . . . 0.0 111.859 -177.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.581 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 90.1 m95 -137.43 137.54 38.87 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 122.2 1.0 . . . . 0.0 111.161 177.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.594 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 9.4 tp10 -118.23 143.23 46.71 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.155 -1.839 . . . . 0.0 106.115 -174.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.523 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 98.7 m95 -83.53 153.77 24.2 Favored 'General case' 0 C--N 1.296 -1.736 0 O-C-N 120.693 -1.255 . . . . 0.0 110.418 171.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -121.55 -42.2 2.45 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . 0.756 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 1.6 m-20 -77.05 155.83 32.22 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.432 178.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -75.81 -56.72 4.41 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -171.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -156.54 147.88 22.37 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -175.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.511 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 17.6 m95 -61.39 120.43 10.45 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 124.167 0.917 . . . . 0.0 109.295 -172.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . 0.648 ' O ' ' HA ' ' A' 1023 ' ' LEU . 42.4 m -111.63 -166.69 1.1 Allowed 'General case' 0 C--O 1.201 -1.45 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 17.6 p90 -109.82 154.34 23.13 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 119.825 1.193 . . . . 0.0 112.208 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' 1022 ' ' ARG . 9.0 t70 -99.89 131.57 45.78 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.672 -171.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 30.8 pt -119.87 28.32 3.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 122.209 1.004 . . . . 0.0 109.011 173.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -106.4 24.35 12.69 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 123.012 1.387 . . . . 0.0 108.963 -175.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.401 HH21 ' CD ' ' A' ' 994' ' ' GLU . 38.5 mtp85 -139.5 -177.61 5.02 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -83.93 80.76 9.05 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 172.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.904 HG12 ' HG2' ' A' ' 994' ' ' GLU . 29.2 m -135.97 156.14 36.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.352 -170.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.37 170.14 0.16 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.956 170.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -52.62 -34.18 49.93 Favored 'General case' 0 CA--C 1.498 -1.02 0 C-N-CA 123.479 0.711 . . . . 0.0 111.239 176.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . 0.445 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 84.5 mttt -98.35 2.97 48.54 Favored 'General case' 0 N--CA 1.422 -1.842 0 CA-C-N 114.924 -1.035 . . . . 0.0 111.947 -176.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 100.67 -16.08 57.94 Favored Glycine 0 C--O 1.223 -0.576 0 C-N-CA 121.27 -0.49 . . . . 0.0 111.888 178.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.738 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 71.3 m95 -55.8 116.61 3.04 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.904 ' HG2' HG12 ' A' ' 988' ' ' VAL . 5.0 mt-10 -99.76 155.44 17.64 Favored 'General case' 0 C--O 1.257 1.451 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.432 176.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.521 ' HD2' ' HB3' ' A' 1011 ' ' ALA . 21.9 t80 -69.47 102.67 1.85 Allowed 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 129.015 2.926 . . . . 0.0 110.829 -178.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -124.13 122.41 4.8 Favored Glycine 0 CA--C 1.503 -0.659 0 C-N-CA 119.33 -1.414 . . . . 0.0 111.876 172.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.973 ' HB ' ' HD2' ' A' 1016 ' ' HIS . 1.3 tt -133.24 139.57 48.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 O-C-N 121.663 -0.904 . . . . 0.0 109.291 -179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 35.0 m -132.61 116.81 17.13 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.405 ' HA ' ' HD2' ' A' 1000 ' ' PRO . 12.2 pt -114.18 97.38 45.39 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-O 121.188 0.518 . . . . 0.0 111.891 -175.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 999' ' ' ILE . 18.7 Cg_endo -58.88 132.98 50.77 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.632 2.888 . . . . 0.0 114.415 -175.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -79.59 146.02 75.26 Favored 'Cis proline' 0 N--CA 1.454 -0.835 0 C-N-CA 122.743 -1.774 . . . . 0.0 112.015 -0.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 6.2 t70 -153.53 -159.91 1.05 Allowed 'General case' 0 C--N 1.293 -1.878 0 CA-C-N 113.873 -1.512 . . . . 0.0 107.91 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -138.0 -57.67 0.66 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.248 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 63.0 mttp -165.26 155.69 12.09 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 102.837 -3.023 . . . . 0.0 102.837 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -60.53 122.0 10.61 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 CA-C-N 121.758 1.664 . . . . 0.0 109.244 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 46.7 pttt -83.78 -7.51 59.45 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.566 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 9.6 t -144.01 135.22 25.62 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -174.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.597 ' HE3' ' HB2' ' A' ' 994' ' ' GLU . 42.6 m95 -134.24 135.39 42.91 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 125.436 1.71 . . . . 0.0 106.405 175.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.51 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 2.6 m -162.9 -174.01 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 -174.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -97.4 104.74 16.78 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . 0.521 ' HB3' ' HD2' ' A' ' 995' ' ' TYR . . . -178.25 -176.96 0.55 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -175.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.517 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.2 OUTLIER -174.63 118.03 0.2 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.805 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 46.9 mttp -132.37 153.4 50.81 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.421 -172.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 23.0 ttt -53.03 -44.03 67.03 Favored 'General case' 0 C--N 1.315 -0.918 0 O-C-N 124.607 1.192 . . . . 0.0 113.38 -177.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . 0.404 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 54.0 m-85 -68.47 9.63 0.33 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.973 ' HD2' ' HB ' ' A' ' 997' ' ' ILE . 22.0 m170 -69.72 175.65 4.1 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.908 0.861 . . . . 0.0 112.233 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . 0.444 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 1.1 m -155.75 -42.0 0.08 Allowed 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 -169.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 16.7 m170 -132.02 144.31 50.68 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.49 -174.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.738 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 42.7 ttp180 -151.92 146.09 25.36 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 5.5 ptp180 -156.15 165.48 36.28 Favored 'General case' 0 C--O 1.198 -1.627 0 C-N-CA 117.575 -1.65 . . . . 0.0 110.824 178.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.582 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 29.4 ptt180 -144.38 151.36 39.17 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.792 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.68 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 36.2 ttm180 -83.7 129.76 34.95 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.648 ' HA ' ' O ' ' A' ' 981' ' ' SER . 72.9 mt -98.95 128.22 45.05 Favored 'General case' 0 N--CA 1.414 -2.275 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 167.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.522 HG13 ' HB2' ' A' ' 983' ' ' ASP . 1.4 m -104.76 145.1 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.828 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.503 -171.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.756 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -156.22 114.08 3.29 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 124.999 1.437 . . . . 0.0 111.299 168.001 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.8 tmmm? -82.09 144.83 30.52 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 -176.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.523 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 6.3 ptm180 -135.79 137.89 42.04 Favored 'General case' 0 C--O 1.209 -1.036 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 -172.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.562 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 30.2 ttmt -123.08 137.85 54.82 Favored 'General case' 0 C--N 1.284 -2.258 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.012 -171.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.639 ' C ' ' H ' ' A' 1031 ' ' LEU . 36.8 ttmt -89.1 -21.14 23.53 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-O 123.228 1.49 . . . . 0.0 108.26 -177.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 21.5 t70 66.67 -22.91 0.1 Allowed 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 111.927 -2.397 . . . . 0.0 112.28 -169.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . 0.639 ' H ' ' C ' ' A' 1029 ' ' LYS . 27.6 tp 88.46 -25.34 0.08 Allowed 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 129.029 2.932 . . . . 0.0 110.899 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 34.4 p -74.77 -16.35 60.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.307 0.575 . . . . 0.0 111.363 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.594 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 98.0 mt-30 . . . . . 0 C--O 1.233 0.203 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.459 178.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 56.9 m-70 . . . . . 0 CA--C 1.502 -0.889 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.6 m -161.2 124.43 3.25 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 102.804 -3.035 . . . . 0.0 102.804 168.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.473 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.4 OUTLIER -153.25 145.96 24.29 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 178.639 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -141.14 143.7 34.42 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.637 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 25.7 m -74.15 125.71 28.97 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 177.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -101.36 156.78 17.25 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 105.085 -2.191 . . . . 0.0 105.085 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.475 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.0 pt-20 -147.77 152.48 37.79 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.448 -174.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.499 HG11 ' HG3' ' A' ' 964' ' ' PRO . 12.2 p -141.95 174.76 5.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.503 ' HA ' ' O ' ' A' 1021 ' ' ARG . 68.6 m-85 -135.61 150.39 49.65 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.524 ' O ' ' HA ' ' A' 1020 ' ' ARG . 36.8 tt0 -126.18 127.53 45.85 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -178.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . 0.96 ' HB3' ' HG2' ' A' 1020 ' ' ARG . 0.0 OUTLIER -137.92 152.23 48.78 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 -177.05 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.642 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 46.3 mt-10 -135.22 161.05 36.48 Favored 'General case' 0 C--O 1.245 0.834 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 178.065 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . 0.495 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 17.9 p -133.36 147.92 51.83 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.143 0.497 . . . . 0.0 111.336 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.474 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 21.6 ptt180 -149.02 161.44 41.91 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.81 158.38 69.69 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 171.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . 0.456 ' HG3' HG22 ' A' 1017 ' ' THR . 24.5 Cg_exo -62.78 92.32 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 121.345 1.363 . . . . 0.0 110.259 174.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 97.0 70.58 1.03 Allowed Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 108.974 -1.65 . . . . 0.0 108.974 -176.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -160.5 -131.24 1.2 Allowed Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.102 -175.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -137.42 131.07 31.45 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.547 -0.827 . . . . 0.0 111.047 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.642 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 36.1 m95 -78.92 149.98 32.22 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-O 121.512 0.672 . . . . 0.0 110.485 -177.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -137.84 166.06 29.07 Favored Pre-proline 0 C--N 1.305 -1.352 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 171.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -49.31 127.95 19.04 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 CA-C-N 121.262 1.486 . . . . 0.0 110.285 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . 0.495 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -47.78 -51.7 21.46 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 124.725 1.266 . . . . 0.0 111.613 -174.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 163.33 -35.37 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 178.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . 0.433 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 15.6 m-20 -132.13 102.27 5.73 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 174.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . 0.437 ' O ' ' HA ' ' A' ' 936' ' ' GLN . 24.1 m -68.96 -46.2 68.76 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -172.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . 0.419 ' CE1' ' HB2' ' A' ' 936' ' ' GLN . 59.7 m-85 -104.79 130.57 52.87 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.874 0.845 . . . . 0.0 110.591 175.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 5.0 p -145.02 173.09 12.19 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.264 -1.334 . . . . 0.0 111.017 -166.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . 0.509 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 11.3 t70 -97.72 170.74 8.79 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 175.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.49 -27.95 7.52 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 119.548 1.067 . . . . 0.0 113.67 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -95.39 2.19 54.5 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 98.07 -3.87 60.5 Favored Glycine 0 CA--C 1.497 -1.049 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.845 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . 0.509 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 38.6 t70 -51.74 108.41 0.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 O-C-N 124.388 0.699 . . . . 0.0 110.308 176.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . 0.433 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 51.8 tptt -47.14 111.1 0.36 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.537 1.148 . . . . 0.0 109.076 172.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -120.96 -179.91 4.17 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.604 -174.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -74.75 146.63 42.01 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 13.6 m -76.16 156.82 83.73 Favored Pre-proline 0 C--N 1.313 -1.011 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.567 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 53.1 Cg_exo -50.91 -25.13 15.14 Favored 'Trans proline' 0 N--CA 1.487 1.101 0 C-N-CA 123.537 2.825 . . . . 0.0 115.407 -177.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 9.3 p -71.3 -49.47 42.46 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.861 0.839 . . . . 0.0 108.993 176.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -66.2 -28.15 68.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.699 175.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.479 HD12 ' HA ' ' A' ' 964' ' ' PRO . 67.7 mt -66.46 110.72 3.24 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 10.6 p -126.27 -179.95 4.98 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.891 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.678 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 24.0 p -94.65 124.92 53.44 Favored Pre-proline 0 C--N 1.308 -1.239 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.689 178.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.626 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 80.3 Cg_endo -78.53 162.84 27.38 Favored 'Trans proline' 0 C--N 1.336 -0.118 0 C-N-CA 123.197 2.598 . . . . 0.0 110.461 178.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -59.45 100.91 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 121.66 1.574 . . . . 0.0 110.942 174.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.654 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 127.34 -3.57 7.2 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -176.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.678 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 94.7 m95 -141.21 145.98 36.33 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 122.68 0.392 . . . . 0.0 110.307 177.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.57 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 5.5 tp10 -131.69 157.57 43.41 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 126.004 1.722 . . . . 0.0 106.41 -175.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.644 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 98.4 m95 -90.34 148.05 23.09 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 120.468 -1.395 . . . . 0.0 112.691 170.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -113.2 -43.82 3.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 178.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . 0.474 ' HB3' ' NE ' ' A' 1025 ' ' ARG . 69.4 m-20 -78.22 161.19 27.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.788 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -84.18 -57.48 3.16 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 115.186 1.551 . . . . 0.0 115.186 -176.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -155.77 142.69 18.99 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 121.408 -0.808 . . . . 0.0 110.404 -170.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.567 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 15.4 m95 -66.84 130.49 43.33 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.118 0.485 . . . . 0.0 109.97 -173.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . 0.443 ' O ' ' HA ' ' A' 1023 ' ' LEU . 62.3 m -128.67 166.39 19.01 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 -179.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 20.4 p90 -74.41 142.55 44.98 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -178.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.526 ' HB2' HG13 ' A' 1024 ' ' VAL . 31.9 t0 -97.96 122.03 40.6 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.024 -177.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.2 pp -114.46 22.66 5.65 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.385 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -97.98 27.44 4.52 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.526 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 50.6 mtp180 -141.78 -177.16 5.06 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 -173.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.31 84.89 6.97 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 16.8 m -141.1 157.21 22.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.477 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -53.06 169.45 0.1 Allowed 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.773 172.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -55.33 -34.17 63.98 Favored 'General case' 0 CA--C 1.507 -0.675 0 C-N-CA 123.061 0.544 . . . . 0.0 112.439 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -98.68 11.85 37.26 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.418 0.628 . . . . 0.0 110.008 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 69.85 81.27 0.24 Allowed Glycine 0 N--CA 1.431 -1.654 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.243 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.509 ' CE3' ' HD2' ' A' 1019 ' ' ARG . 99.5 m95 -148.13 131.53 16.63 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.687 ' HG2' ' O ' ' A' 1020 ' ' ARG . 6.4 pt-20 -108.02 150.88 26.58 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-O 121.611 0.719 . . . . 0.0 112.493 -177.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.693 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -74.67 94.63 2.72 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 112.556 -2.111 . . . . 0.0 111.329 -173.339 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -110.88 101.37 1.34 Allowed Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 120.33 -0.938 . . . . 0.0 111.272 177.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.492 HD12 ' HB3' ' A' 1015 ' ' TYR . 0.7 OUTLIER -110.19 133.19 56.34 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.055 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.792 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 8.7 m -118.61 97.05 5.54 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 120.608 0.242 . . . . 0.0 110.357 -177.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.444 ' O ' HD12 ' A' ' 999' ' ' ILE . 2.4 pp -81.41 133.59 53.01 Favored Pre-proline 0 C--N 1.319 -0.724 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.764 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 51.5 Cg_endo -70.55 143.36 46.8 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.825 2.35 . . . . 0.0 113.736 -175.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 9.3 Cg_endo -93.7 143.86 9.01 Favored 'Cis proline' 0 N--CA 1.451 -1.009 0 C-N-CA 123.057 -1.643 . . . . 0.0 112.198 -3.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 2.7 t70 170.0 167.28 0.06 Allowed 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 113.342 -1.754 . . . . 0.0 107.718 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 13.9 p-80 -142.24 33.49 1.51 Allowed 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.845 0.355 . . . . 0.0 110.148 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -163.5 124.74 1.5 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.426 -175.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.562 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 51.5 Cg_exo -63.79 126.29 17.13 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 121.525 1.484 . . . . 0.0 109.445 166.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 55.2 pttt -107.21 7.71 29.58 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.949 0.88 . . . . 0.0 109.188 -178.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.0 t -144.28 138.03 27.65 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.421 -1.263 . . . . 0.0 108.651 -177.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.593 ' CE3' ' HG3' ' A' ' 994' ' ' GLU . 66.9 m95 -133.72 140.24 46.88 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 98.4 t -139.34 152.86 23.65 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -78.86 100.32 7.13 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 175.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . 0.563 ' HB3' ' HD2' ' A' ' 995' ' ' TYR . . . 177.19 -174.2 0.12 Allowed 'General case' 0 C--O 1.235 0.293 0 O-C-N 123.876 0.735 . . . . 0.0 110.588 -171.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.696 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.3 OUTLIER -172.34 104.52 0.17 Allowed 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 106.491 -1.67 . . . . 0.0 106.491 177.61 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.479 ' H ' ' CE1' ' A' 1016 ' ' HIS . 21.9 mttp -141.66 166.93 23.39 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 112.852 -1.976 . . . . 0.0 110.283 -170.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 55.6 ttp -49.95 -47.34 52.62 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -173.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . 0.492 ' HB3' HD12 ' A' ' 997' ' ' ILE . 33.2 m-85 -62.25 -0.89 0.61 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.696 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 15.3 m80 -59.28 111.05 1.22 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 118.55 0.613 . . . . 0.0 112.229 175.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . 0.456 HG22 ' HG3' ' A' ' 942' ' ' PRO . 42.1 p -96.32 -28.63 14.4 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 123.478 1.609 . . . . 0.0 107.525 174.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 7.2 m170 -139.3 156.26 47.16 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 112.658 -2.064 . . . . 0.0 109.348 -178.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.509 ' HD2' ' CE3' ' A' ' 993' ' ' TRP . 38.0 ptt180 -149.93 145.76 26.67 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 171.016 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.96 ' HG2' ' HB3' ' A' ' 937' ' ' ASN . 53.9 mtp180 -144.09 167.4 22.46 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.503 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.3 ptt180 -157.38 154.48 28.96 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.611 174.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.526 ' NH1' ' HD2' ' A' ' 986' ' ' ARG . 35.8 ttm180 -90.31 133.27 35.07 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 123.604 0.565 . . . . 0.0 109.775 178.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.531 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 71.9 mt -102.12 130.76 48.81 Favored 'General case' 0 N--CA 1.421 -1.909 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 165.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.526 HG13 ' HB2' ' A' ' 983' ' ' ASP . 1.8 m -106.35 145.09 14.56 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.354 -174.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.748 ' NE ' ' HA ' ' A' 1025 ' ' ARG . 0.6 OUTLIER -158.99 115.99 2.73 Favored 'General case' 0 C--N 1.31 -1.146 0 O-C-N 125.218 1.574 . . . . 0.0 113.017 168.233 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.8 tmmm? -76.29 142.38 41.34 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.204 0.526 . . . . 0.0 109.765 -177.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.644 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 11.2 ptm180 -130.69 144.52 51.49 Favored 'General case' 0 CA--C 1.497 -1.076 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -173.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 58.5 tttt -134.02 135.3 43.29 Favored 'General case' 0 C--N 1.286 -2.157 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.191 -167.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.654 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 34.6 ttmt -84.58 -20.26 31.77 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 123.473 1.606 . . . . 0.0 107.362 179.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . 0.453 ' H ' ' HG2' ' A' 1028 ' ' LYS . 24.6 t70 61.95 -17.71 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 111.246 -2.706 . . . . 0.0 113.555 -171.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . 0.611 ' H ' ' C ' ' A' 1029 ' ' LYS . 18.5 tp 81.25 -10.54 1.19 Allowed 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 128.43 2.692 . . . . 0.0 110.621 -178.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 17.6 p -87.69 -3.5 58.96 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.384 0.612 . . . . 0.0 111.394 -177.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.57 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 80.3 mt-30 . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.691 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . 0.518 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 6.1 m-70 . . . . . 0 CA--C 1.493 -1.215 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.87 127.26 48.77 Favored 'General case' 0 N--CA 1.42 -1.971 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 162.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.56 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 0.0 OUTLIER -138.48 149.66 45.64 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 104.853 -2.277 . . . . 0.0 104.853 171.715 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.414 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.1 t80 -154.48 138.65 16.53 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 -174.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 45.4 m -79.77 132.82 36.25 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -110.04 156.88 19.94 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.449 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.0 pt-20 -154.21 159.48 41.37 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 121.282 0.563 . . . . 0.0 111.118 -173.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.641 ' O ' ' HA ' ' A' 1022 ' ' ARG . 8.8 p -147.96 179.6 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 176.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.568 ' H ' HG22 ' A' ' 934' ' ' VAL . 77.9 m-85 -139.97 118.51 12.25 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 118.468 0.576 . . . . 0.0 110.418 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.473 ' O ' ' HA ' ' A' 1020 ' ' ARG . 47.3 mt-30 -78.46 122.47 25.87 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 170.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . 0.506 ' HB3' ' HB3' ' A' ' 949' ' ' ALA . 24.5 m-80 -117.5 143.24 46.26 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 123.338 0.655 . . . . 0.0 112.049 -176.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.67 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 52.4 mt-10 -136.18 150.76 49.16 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 174.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . 0.482 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 31.8 p -134.85 146.63 49.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 117.895 0.316 . . . . 0.0 111.72 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.536 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 25.0 ptt180 -153.3 161.33 42.48 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 124.156 0.982 . . . . 0.0 108.685 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -68.71 153.21 96.16 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 172.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . 0.485 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 70.2 Cg_exo -55.49 97.97 0.06 OUTLIER 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 121.893 1.729 . . . . 0.0 111.219 174.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 93.88 66.99 1.05 Allowed Glycine 0 N--CA 1.435 -1.374 0 N-CA-C 107.849 -2.101 . . . . 0.0 107.849 -175.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -159.01 -155.68 7.73 Favored Glycine 0 N--CA 1.434 -1.485 0 C-N-CA 120.138 -1.03 . . . . 0.0 113.145 -176.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -116.47 131.23 57.0 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 113.541 -1.329 . . . . 0.0 110.032 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.67 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 48.1 m95 -79.9 154.21 28.49 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.407 0.622 . . . . 0.0 110.609 -175.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -136.53 173.96 5.0 Favored Pre-proline 0 C--N 1.306 -1.284 0 N-CA-C 103.806 -2.665 . . . . 0.0 103.806 173.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.63 128.9 32.3 Favored 'Trans proline' 0 C--N 1.346 0.436 0 CA-C-N 121.522 1.579 . . . . 0.0 109.47 173.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . 0.506 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . . . -71.51 37.58 0.06 Allowed 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.849 1.426 . . . . 0.0 114.849 -175.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 85.18 -57.45 0.09 Allowed 'General case' 0 CA--C 1.474 -1.948 0 C-N-CA 125.274 1.43 . . . . 0.0 107.981 174.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -119.04 101.56 8.11 Favored 'General case' 0 N--CA 1.401 -2.903 0 N-CA-C 104.393 -2.447 . . . . 0.0 104.393 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.2 m -64.05 -57.76 8.7 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.085 0.241 . . . . 0.0 111.545 -172.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -98.35 126.3 43.82 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 37.5 p -149.66 -178.23 6.33 Favored 'General case' 0 C--O 1.246 0.896 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -172.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -105.33 -177.15 3.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 175.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.16 -31.63 32.29 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.27 -41.46 20.15 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 129.5 -2.07 6.09 Favored Glycine 0 CA--C 1.498 -0.974 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.887 177.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.43 104.36 0.62 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 114.626 -0.787 . . . . 0.0 109.181 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . 0.414 ' HD3' ' N ' ' A' ' 961' ' ' ALA . 9.3 tmtt? -48.87 120.14 3.66 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.414 ' N ' ' HD3' ' A' ' 960' ' ' LYS . . . -125.39 -172.45 2.59 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.653 -175.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . 0.458 ' CB ' ' HG ' ' A' ' 967' ' ' LEU . . . -62.16 140.89 58.41 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 121.902 0.858 . . . . 0.0 111.35 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . 0.491 ' O ' ' HB2' ' A' ' 967' ' ' LEU . 15.0 m -102.47 162.64 19.61 Favored Pre-proline 0 N--CA 1.43 -1.466 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -176.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.606 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.2 Cg_endo -51.23 -37.95 60.35 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.733 2.289 . . . . 0.0 114.249 -177.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 25.5 p -79.91 -47.46 15.02 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 121.906 -0.496 . . . . 0.0 111.03 175.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . 0.483 ' HB2' ' H ' ' A' ' 963' ' ' SER . 45.2 mt-10 -65.65 -8.23 19.39 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.491 ' HB2' ' O ' ' A' ' 963' ' ' SER . 1.0 OUTLIER -102.02 112.49 25.15 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 -175.322 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.91 155.5 18.88 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.089 -176.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 16.0 p -76.85 126.95 85.07 Favored Pre-proline 0 C--N 1.313 -1.005 0 C-N-CA 120.169 -0.613 . . . . 0.0 109.49 174.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.637 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 52.6 Cg_endo -80.27 166.14 20.64 Favored 'Trans proline' 0 C--O 1.238 0.479 0 C-N-CA 122.886 2.39 . . . . 0.0 111.363 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.82 102.8 0.21 Allowed 'Trans proline' 0 C--O 1.24 0.585 0 C-N-CA 121.84 1.694 . . . . 0.0 110.266 173.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.661 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 121.63 3.47 10.18 Favored Glycine 0 N--CA 1.429 -1.8 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.383 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.637 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 93.5 m95 -138.57 137.62 37.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.96 0.886 . . . . 0.0 112.177 177.094 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.632 ' HB3' ' O ' ' A' 1028 ' ' LYS . 3.5 tp10 -122.0 137.2 54.89 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.163 -1.38 . . . . 0.0 108.262 -175.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.618 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 80.9 m95 -81.07 100.41 9.0 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 120.996 -1.065 . . . . 0.0 110.48 175.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . 0.462 ' HB3' ' HB3' ' A' 1028 ' ' LYS . 8.4 pt-20 -75.9 -31.54 59.24 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 177.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -78.07 146.43 35.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.387 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.59 -46.38 66.45 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -166.75 156.41 11.22 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.437 0.637 . . . . 0.0 111.596 -173.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.71 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 37.7 m95 -70.75 119.63 15.18 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.422 -0.808 . . . . 0.0 108.822 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 19.6 m -125.35 148.51 48.72 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -175.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . 0.53 ' HA ' ' O ' ' A' 1022 ' ' ARG . 7.2 p90 -73.68 135.85 43.75 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 119.251 0.932 . . . . 0.0 110.284 -175.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.588 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 12.5 t70 -88.21 126.34 35.1 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 114.423 -1.262 . . . . 0.0 111.048 -172.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.467 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.3 pp -121.01 16.19 6.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.471 -179.092 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . 0.514 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 16.7 t-20 -90.36 16.89 7.94 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.848 -177.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.588 ' HD3' ' OD2' ' A' ' 983' ' ' ASP . 5.0 mpt_? -141.47 -175.86 4.52 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -175.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -73.85 84.21 1.68 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.286 0.565 . . . . 0.0 110.812 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.528 HG12 ' HG2' ' A' ' 994' ' ' GLU . 17.9 m -141.13 -171.89 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -104.0 -172.7 2.15 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -58.36 -35.44 71.95 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.734 0.778 . . . . 0.0 111.829 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . 0.413 ' HA ' ' CE2' ' A' ' 982' ' ' TYR . 80.4 mttt -106.75 9.1 31.19 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.363 -176.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.72 -121.55 7.2 Favored Glycine 0 C--O 1.205 -1.701 0 N-CA-C 105.691 -2.964 . . . . 0.0 105.691 -174.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.601 ' H ' ' HB3' ' A' 1021 ' ' ARG . 42.9 m95 52.72 99.4 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 173.075 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.528 ' HG2' HG12 ' A' ' 988' ' ' VAL . 26.2 mt-10 -98.6 148.95 23.28 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.69 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.62 ' HB3' ' H ' ' A' 1009 ' ' VAL . 19.9 t80 -65.79 96.65 0.3 Allowed 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 127.059 2.144 . . . . 0.0 111.098 177.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -118.93 102.89 0.96 Allowed Glycine 0 N--CA 1.444 -0.825 0 C-N-CA 119.255 -1.45 . . . . 0.0 111.975 174.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.443 HG22 ' HD2' ' A' 1016 ' ' HIS . 0.1 OUTLIER -108.71 143.24 19.37 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 O-C-N 119.951 -1.911 . . . . 0.0 107.563 178.447 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . 0.493 ' OG1' ' HG3' ' A' 1005 ' ' PRO . 7.9 m -138.92 127.97 23.84 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.7 mp -100.37 97.95 7.17 Favored Pre-proline 0 C--N 1.313 -0.99 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.26 140.85 38.02 Favored 'Trans proline' 0 C--O 1.238 0.478 0 C-N-CA 122.607 2.204 . . . . 0.0 114.071 -173.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -80.89 155.98 84.18 Favored 'Cis proline' 0 CA--C 1.512 -0.575 0 C-N-CA 123.177 -1.593 . . . . 0.0 110.857 -2.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' 1003 ' ' HIS . 21.1 t70 -159.18 -133.84 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.336 -174.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . 0.424 ' H ' ' CG ' ' A' 1002 ' ' ASP . 5.8 p-80 -158.37 -45.09 0.06 Allowed 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 122.999 0.52 . . . . 0.0 111.25 -174.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 61.1 tttt -167.26 145.67 4.18 Favored Pre-proline 0 N--CA 1.448 -0.543 0 C-N-CA 119.651 -0.819 . . . . 0.0 108.793 -173.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.493 ' HG3' ' OG1' ' A' ' 998' ' ' THR . 52.1 Cg_exo -64.55 124.61 13.53 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 121.058 1.172 . . . . 0.0 109.724 167.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 57.8 pttt -70.64 -59.42 2.84 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 34.3 t -97.38 150.59 20.83 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 120.594 0.235 . . . . 0.0 111.179 -177.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.518 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 53.0 m95 -137.37 145.55 43.43 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 125.113 1.508 . . . . 0.0 107.454 175.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.62 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 10.8 m -161.92 -155.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 -177.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -103.14 -36.34 8.16 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 119.553 1.07 . . . . 0.0 113.104 -174.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -61.22 108.88 0.98 Allowed 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -168.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.444 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 4.9 tp10 -66.58 118.04 9.61 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 172.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.447 ' HD3' ' CZ ' ' A' 1015 ' ' TYR . 83.1 mttt -122.18 155.92 34.8 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.747 -174.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 23.7 ttt -55.88 -47.66 76.97 Favored 'General case' 0 CA--C 1.503 -0.864 0 O-C-N 123.951 0.782 . . . . 0.0 111.593 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . 0.485 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 31.6 p90 -75.09 28.07 0.09 Allowed 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.083 -0.647 . . . . 0.0 112.66 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.579 ' CE1' ' HA ' ' A' ' 995' ' ' TYR . 9.0 m170 -82.54 116.81 22.13 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 121.731 -0.606 . . . . 0.0 110.61 173.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 4.4 m -93.2 -28.99 15.94 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 123.088 1.423 . . . . 0.0 107.561 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . 0.415 ' CD2' ' HB3' ' A' ' 939' ' ' SER . 31.2 m80 -139.19 156.83 46.83 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 113.383 -1.735 . . . . 0.0 110.68 -176.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -156.37 150.74 25.53 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 105.75 -1.945 . . . . 0.0 105.75 169.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.473 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.9 ptp180 -149.99 163.65 37.56 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 118.267 -1.373 . . . . 0.0 110.86 176.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.601 ' HB3' ' H ' ' A' ' 993' ' ' TRP . 21.9 ptt180 -143.36 142.3 31.23 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.911 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.641 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 33.0 ttm180 -82.3 129.19 34.8 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.112 -178.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.71 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 97.0 mt -102.16 133.65 46.68 Favored 'General case' 0 N--CA 1.427 -1.609 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 166.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.536 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 13.8 m -111.11 138.99 37.09 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.009 -176.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.49 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 13.8 tpt180 -138.56 110.28 7.12 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.543 170.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.56 ' HE2' ' HG2' ' A' ' 929' ' ' GLU . 2.2 tmtp? -69.63 147.02 51.21 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.618 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 9.8 ptm180 -140.71 129.49 23.04 Favored 'General case' 0 C--O 1.201 -1.496 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -177.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.632 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 36.0 ttmt -121.55 135.5 55.01 Favored 'General case' 0 C--N 1.275 -2.661 0 CA-C-N 115.373 -0.831 . . . . 0.0 108.849 -174.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 35.5 ttmt -84.59 -23.54 29.57 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 123.709 1.719 . . . . 0.0 107.058 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . 0.518 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 16.7 t70 61.77 -5.24 0.15 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 110.811 -2.904 . . . . 0.0 111.62 -169.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . 0.563 ' H ' ' C ' ' A' 1029 ' ' LYS . 36.7 tp 74.56 -34.33 0.27 Allowed 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 127.67 2.388 . . . . 0.0 111.892 -177.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 8.1 t -68.27 -15.46 63.58 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -175.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.483 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 93.4 mt-30 . . . . . 0 C--N 1.333 -0.148 0 C-N-CA 120.429 -0.509 . . . . 0.0 110.764 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . 0.456 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 46.1 m-70 . . . . . 0 N--CA 1.421 -1.913 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.09 115.73 0.97 Allowed 'General case' 0 N--CA 1.413 -2.314 0 N-CA-C 101.495 -3.52 . . . . 0.0 101.495 172.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -142.22 132.08 24.32 Favored 'General case' 0 C--N 1.274 -2.686 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 177.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -128.69 140.43 51.75 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -177.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.64 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 38.7 m -70.64 126.72 30.4 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -96.35 166.36 11.75 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -161.07 149.31 15.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-O 121.204 0.526 . . . . 0.0 110.719 -172.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.571 ' O ' ' HA ' ' A' 1022 ' ' ARG . 14.8 p -145.33 175.07 2.69 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 176.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.606 ' CD2' ' HD3' ' A' 1020 ' ' ARG . 75.8 m-85 -135.62 151.47 50.28 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.495 ' O ' ' HA ' ' A' 1020 ' ' ARG . 13.0 tt0 -123.2 118.09 26.84 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 178.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -106.82 141.11 38.58 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.831 0.824 . . . . 0.0 111.121 -174.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 67.5 mt-10 -136.65 157.66 46.25 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 175.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 40.7 t -144.69 141.63 29.45 Favored 'General case' 0 N--CA 1.426 -1.632 0 CA-C-O 121.073 0.463 . . . . 0.0 109.997 -178.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.612 HH21 ' HB2' ' A' 1016 ' ' HIS . 21.6 ptt180 -139.03 159.61 41.73 Favored 'General case' 0 N--CA 1.435 -1.203 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 177.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -71.89 161.42 78.84 Favored Pre-proline 0 C--N 1.303 -1.452 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 170.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . 0.554 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 31.4 Cg_exo -61.84 86.16 0.1 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 121.374 1.383 . . . . 0.0 111.031 175.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 103.15 70.18 0.83 Allowed Glycine 0 N--CA 1.434 -1.484 0 N-CA-C 107.716 -2.154 . . . . 0.0 107.716 -173.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.62 -140.57 2.9 Favored Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 120.35 -0.929 . . . . 0.0 113.647 -175.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -127.97 122.62 32.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.702 -0.749 . . . . 0.0 111.532 -173.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.613 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 74.6 m95 -70.47 135.59 48.77 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -142.88 178.78 1.36 Allowed Pre-proline 0 C--N 1.302 -1.482 0 N-CA-C 103.073 -2.936 . . . . 0.0 103.073 -179.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.05 124.29 15.91 Favored 'Trans proline' 0 C--O 1.238 0.501 0 CA-C-N 122.735 2.012 . . . . 0.0 111.423 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -49.23 -49.99 40.52 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.626 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 173.88 -38.7 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 960' ' ' LYS . 46.1 m-20 -122.5 116.07 23.3 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 174.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 6.6 m -63.64 -59.51 4.51 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -174.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . 0.472 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 91.7 m-85 -110.03 135.3 51.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.788 0.328 . . . . 0.0 110.425 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . 0.434 ' HA ' ' HA ' ' A' ' 960' ' ' LYS . 58.5 p -142.74 179.91 6.72 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.55 0.691 . . . . 0.0 110.183 -171.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -98.21 174.36 6.55 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 104.911 -2.255 . . . . 0.0 104.911 172.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.54 -34.96 52.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 118.587 0.631 . . . . 0.0 110.952 174.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -86.36 -0.54 56.13 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 96.6 -10.12 66.69 Favored Glycine 0 CA--C 1.501 -0.782 0 C-N-CA 119.739 -1.219 . . . . 0.0 113.308 177.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -51.64 99.2 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 954' ' ' THR . 0.2 OUTLIER -60.36 137.9 58.06 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -177.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -134.24 -178.98 5.29 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.397 -175.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . 0.537 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -70.72 153.06 43.15 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 172.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 3.7 m -76.32 158.51 81.53 Favored Pre-proline 0 C--N 1.313 -1.017 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -178.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.596 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 53.9 Cg_exo -44.94 -31.73 5.68 Favored 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 124.263 3.308 . . . . 0.0 116.317 -178.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.8 t -71.61 -45.54 61.83 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . 0.537 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 35.2 mt-10 -65.19 -25.88 67.9 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.373 175.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.522 HD12 ' HA ' ' A' ' 964' ' ' PRO . 57.4 mt -71.43 112.05 7.24 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.702 0.763 . . . . 0.0 110.208 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 20.6 p -118.77 169.99 9.38 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.881 -172.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 20.3 p -83.91 129.21 59.9 Favored Pre-proline 0 N--CA 1.443 -0.781 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.646 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.614 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 53.5 Cg_endo -82.59 163.28 16.64 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.931 2.421 . . . . 0.0 110.642 177.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -59.61 104.82 0.23 Allowed 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.02 1.813 . . . . 0.0 110.657 174.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.511 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 121.19 -1.67 11.57 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.066 -177.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.614 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.4 m95 -136.81 141.57 42.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 117.256 0.528 . . . . 0.0 111.167 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 1.044 ' HB3' HE22 ' A' 1033 ' ' GLN . 2.9 pt-20 -117.94 148.37 42.25 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -177.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.54 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 85.5 m95 -84.64 98.36 10.15 Favored 'General case' 0 C--N 1.296 -1.732 0 C-N-CA 119.169 -1.013 . . . . 0.0 110.327 167.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . 0.428 ' HG2' ' HE3' ' A' 1026 ' ' LYS . 8.9 tp10 -67.83 -41.19 83.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.06 -1.427 . . . . 0.0 108.21 176.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . 0.554 ' HB3' ' NE ' ' A' 1025 ' ' ARG . 64.9 m-20 -84.1 158.68 21.32 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.842 -177.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -75.53 -63.79 1.21 Allowed 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 -175.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -154.21 144.38 22.02 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -171.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.596 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 6.8 m95 -68.4 130.06 41.76 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -173.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . 0.532 ' O ' ' HA ' ' A' 1023 ' ' LEU . 22.9 t -136.18 -175.12 3.88 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . 0.58 ' CD2' ' HA ' ' A' ' 991' ' ' LYS . 0.1 OUTLIER -77.05 151.82 35.35 Favored 'General case' 0 C--N 1.295 -1.791 0 CA-C-N 118.986 0.812 . . . . 0.0 112.179 -175.394 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.554 ' HB2' HG13 ' A' 1024 ' ' VAL . 54.0 t0 -91.0 125.5 35.82 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 172.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.3 pp -119.06 6.76 6.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . 0.548 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 67.1 t30 -93.63 18.36 10.21 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.801 0.81 . . . . 0.0 110.767 -172.066 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.548 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 5.7 mpt_? -139.86 -176.35 4.55 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -177.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -75.29 75.55 2.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.991 0.9 . . . . 0.0 110.302 176.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.601 HG12 ' HG2' ' A' ' 994' ' ' GLU . 9.7 m -143.92 152.81 15.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.169 -1.378 . . . . 0.0 108.531 -177.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -55.8 170.52 0.28 Allowed 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 123.64 0.776 . . . . 0.0 111.966 177.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -57.5 -33.39 67.98 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 121.374 0.607 . . . . 0.0 111.074 174.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . 0.58 ' HA ' ' CD2' ' A' ' 982' ' ' TYR . 81.6 mttt -96.38 6.79 48.02 Favored 'General case' 0 N--CA 1.428 -1.546 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.931 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 93.62 -14.2 65.83 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.058 175.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.571 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 74.2 m95 -50.84 135.34 24.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.199 1.0 . . . . 0.0 113.262 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.601 ' HG2' HG12 ' A' ' 988' ' ' VAL . 41.7 mt-10 -114.61 148.75 37.64 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.407 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.768 ' O ' ' HA ' ' A' 1008 ' ' TRP . 3.9 t80 -81.37 100.9 9.49 Favored 'General case' 0 C--O 1.199 -1.561 0 CA-C-N 112.985 -1.916 . . . . 0.0 108.966 -177.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -123.29 101.64 0.71 Allowed Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 119.125 -1.512 . . . . 0.0 111.895 173.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.563 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.7 OUTLIER -102.57 151.04 6.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 O-C-N 120.864 -1.374 . . . . 0.0 107.741 179.65 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 15.8 m -127.91 102.77 6.91 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 15.8 pt -86.89 112.5 47.67 Favored Pre-proline 0 C--N 1.319 -0.721 0 C-N-CA 120.08 -0.648 . . . . 0.0 110.935 174.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -70.55 147.04 56.89 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.72 2.28 . . . . 0.0 112.975 -176.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -83.6 136.04 26.13 Favored 'Cis proline' 0 N--CA 1.451 -0.999 0 C-N-CA 122.931 -1.695 . . . . 0.0 112.993 -0.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 39.3 t0 167.23 154.98 0.03 OUTLIER 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 111.524 -2.58 . . . . 0.0 105.359 -176.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -119.11 -40.9 2.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 118.704 -1.199 . . . . 0.0 112.346 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 70.2 mttt -104.29 132.15 21.24 Favored Pre-proline 0 C--N 1.31 -1.143 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -176.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.443 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 74.5 Cg_exo -56.05 125.32 18.71 Favored 'Trans proline' 0 CA--C 1.515 -0.427 0 C-N-CA 123.117 2.545 . . . . 0.0 111.019 170.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -94.43 -48.07 6.29 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 35.4 t -85.15 134.72 34.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.44 -1.255 . . . . 0.0 111.093 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.768 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 54.4 m95 -131.54 136.41 47.83 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 124.457 1.098 . . . . 0.0 108.48 176.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.769 HG12 ' H ' ' A' 1010 ' ' ALA . 11.2 t -147.32 -164.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 103.664 -2.717 . . . . 0.0 103.664 -176.245 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . 0.769 ' H ' HG12 ' A' 1009 ' ' VAL . . . -114.98 12.16 16.69 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 120.381 1.446 . . . . 0.0 111.755 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -88.08 -166.36 1.57 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -177.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.44 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 8.5 tp10 -158.74 105.96 1.84 Allowed 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -175.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.545 ' O ' ' HB2' ' A' 1016 ' ' HIS . 56.5 mtpt -111.69 151.44 28.88 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 177.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . 0.405 ' C ' ' H ' ' A' 1016 ' ' HIS . 50.8 ttp -53.24 -37.54 62.17 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 123.881 0.738 . . . . 0.0 111.013 175.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . 0.554 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 97.8 m-85 -69.2 16.08 0.06 Allowed 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 177.009 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.612 ' HB2' HH21 ' A' ' 940' ' ' ARG . 0.2 OUTLIER -79.54 115.91 19.44 Favored 'General case' 0 CA--C 1.499 -1.019 0 O-C-N 121.906 -0.496 . . . . 0.0 110.981 176.309 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 10.9 p -95.95 -27.03 15.35 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.701 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -139.15 153.82 48.0 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.693 -1.139 . . . . 0.0 111.648 -175.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -156.73 151.26 25.55 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 170.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.606 ' HD3' ' CD2' ' A' ' 935' ' ' TYR . 2.7 ptp180 -149.4 165.21 32.76 Favored 'General case' 0 C--O 1.193 -1.871 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 175.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.594 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.3 ptt180 -145.06 148.03 33.23 Favored 'General case' 0 C--N 1.285 -2.229 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.699 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.571 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 41.2 ttm180 -89.4 122.52 32.69 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.532 ' HA ' ' O ' ' A' ' 981' ' ' SER . 78.0 mt -98.27 125.68 43.46 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 103.706 -2.701 . . . . 0.0 103.706 168.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.554 HG13 ' HB2' ' A' ' 983' ' ' ASP . 2.5 m -106.5 151.16 8.57 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.069 -173.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.772 ' NE ' ' HA ' ' A' 1025 ' ' ARG . 0.5 OUTLIER -159.09 110.08 2.05 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 125.427 1.705 . . . . 0.0 112.614 169.421 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.64 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 3.2 tmmm? -78.21 146.86 34.72 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.398 0.618 . . . . 0.0 109.409 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.54 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 6.0 ptm180 -135.75 146.96 48.21 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 -171.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.456 ' O ' ' HG2' ' A' ' 974' ' ' GLU . 34.3 ttmt -129.94 136.27 49.28 Favored 'General case' 0 C--O 1.193 -1.873 0 O-C-N 123.429 0.456 . . . . 0.0 110.573 -172.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 38.7 ttmt -85.82 -22.3 27.69 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 123.466 1.603 . . . . 0.0 107.668 -176.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 9.3 t70 56.98 12.17 1.15 Allowed 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 111.431 -2.622 . . . . 0.0 110.044 -171.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . 0.456 ' HB2' ' HA ' ' A' ' 927' ' ' HIS . 22.6 tp 69.24 -52.1 0.6 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.635 1.974 . . . . 0.0 111.659 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 10.3 t -69.44 -10.08 56.43 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -173.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 1.044 HE22 ' HB3' ' A' ' 974' ' ' GLU . 76.2 mt-30 . . . . . 0 C--N 1.329 -0.317 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.255 177.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 . . . . . 0 CA--C 1.491 -1.322 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . 0.483 ' HB ' ' HB3' ' A' 1029 ' ' LYS . 1.5 m 63.39 90.97 0.08 Allowed 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.799 -169.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -135.95 129.11 31.67 Favored 'General case' 0 N--CA 1.42 -1.94 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 173.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.452 ' O ' ' HG2' ' A' 1027 ' ' ARG . 70.8 t80 -122.62 139.86 53.46 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -178.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.564 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 9.0 m -76.01 121.14 22.31 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -99.54 157.38 16.49 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 -175.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.672 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 0.0 OUTLIER -159.06 156.29 28.97 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 119.433 1.015 . . . . 0.0 111.668 -175.489 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.476 HG11 HD11 ' A' ' 967' ' ' LEU . 20.3 m -145.99 142.71 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 174.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.486 ' CG ' ' HD3' ' A' 1020 ' ' ARG . 98.5 m-85 -101.15 113.67 26.92 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 120.861 -1.149 . . . . 0.0 111.516 178.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.561 ' HB3' ' CE2' ' A' ' 953' ' ' TYR . 3.8 pt20 -81.41 137.01 35.72 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 171.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . 0.884 ' HB3' ' HB3' ' A' 1020 ' ' ARG . 0.0 OUTLIER -140.56 163.23 33.41 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -175.2 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.657 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 43.2 mt-10 -136.67 161.35 36.17 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 113.334 -1.757 . . . . 0.0 107.422 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 19.6 m -138.46 147.61 43.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 120.7 0.286 . . . . 0.0 111.143 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.594 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 16.2 ptt180 -156.07 162.47 40.28 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 123.59 0.756 . . . . 0.0 109.756 -173.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -60.33 162.43 10.86 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 171.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -67.96 78.37 0.57 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.071 1.848 . . . . 0.0 112.32 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 105.28 74.31 0.94 Allowed Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 108.533 -1.827 . . . . 0.0 108.533 -175.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -165.41 -150.1 6.11 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.236 -176.109 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -101.28 130.02 47.35 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.991 -0.604 . . . . 0.0 110.07 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.657 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 45.6 m95 -82.79 139.67 33.42 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 177.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -117.52 163.79 22.28 Favored Pre-proline 0 C--N 1.292 -1.932 0 N-CA-C 101.279 -3.6 . . . . 0.0 101.279 171.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.22 149.02 47.07 Favored 'Trans proline' 0 C--O 1.238 0.49 0 CA-C-N 121.456 1.556 . . . . 0.0 110.353 175.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.14 -171.07 0.1 Allowed 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.161 0.505 . . . . 0.0 110.787 177.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.26 -38.61 30.58 Favored 'General case' 0 CA--C 1.476 -1.885 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -117.94 99.01 6.63 Favored 'General case' 0 N--CA 1.397 -3.085 0 N-CA-C 103.804 -2.665 . . . . 0.0 103.804 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 27.3 m -61.5 -50.35 73.09 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 123.342 0.401 . . . . 0.0 111.365 -172.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . 0.561 ' CE2' ' HB3' ' A' ' 936' ' ' GLN . 81.4 m-85 -101.83 132.44 47.59 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 18.4 p -142.73 177.22 8.47 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 123.393 0.677 . . . . 0.0 110.835 -171.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -104.97 171.17 7.46 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 171.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.88 -37.44 52.25 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 118.971 0.805 . . . . 0.0 110.159 174.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -73.23 -10.19 59.51 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 95.07 -7.79 69.78 Favored Glycine 0 CA--C 1.5 -0.872 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.15 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -58.7 105.76 0.34 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -47.01 124.0 5.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.54 178.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -115.76 168.54 9.95 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.903 -176.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -71.6 157.0 38.75 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.882 177.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.1 m -89.08 149.9 44.1 Favored Pre-proline 0 N--CA 1.435 -1.192 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.566 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 2.8 Cg_exo -43.57 -38.51 9.0 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 125.001 3.801 . . . . 0.0 116.925 -176.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 28.4 m -74.3 -41.8 60.59 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 122.143 0.973 . . . . 0.0 109.391 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -64.57 -28.77 69.86 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.041 -1.436 . . . . 0.0 110.565 173.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.482 HD13 ' CH2' ' A' ' 980' ' ' TRP . 39.6 mt -74.08 120.17 19.29 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 121.776 0.798 . . . . 0.0 110.616 178.22 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 22.0 p -124.38 169.09 12.17 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.042 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 16.9 p -90.44 138.96 26.66 Favored Pre-proline 0 C--N 1.312 -1.054 0 C-N-CA 120.459 -0.496 . . . . 0.0 109.906 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.616 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 92.8 Cg_endo -79.2 172.38 14.81 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.912 2.408 . . . . 0.0 111.066 173.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_exo -45.88 -43.52 19.45 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 123.211 2.607 . . . . 0.0 114.329 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.965 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . -102.76 22.79 35.95 Favored Glycine 0 N--CA 1.434 -1.438 0 C-N-CA 121.478 -0.391 . . . . 0.0 113.614 -175.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.616 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 78.1 m95 -135.42 138.11 42.93 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 117.946 0.873 . . . . 0.0 110.743 172.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.602 ' HB3' ' O ' ' A' 1028 ' ' LYS . 7.3 tp10 -118.85 131.02 56.06 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 125.671 1.588 . . . . 0.0 108.315 -175.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.443 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 82.5 m95 -77.07 98.75 5.11 Favored 'General case' 0 C--N 1.306 -1.288 0 O-C-N 120.92 -1.113 . . . . 0.0 110.129 173.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -69.72 -35.15 74.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 177.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . 0.768 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 1.5 m-20 -87.22 151.43 23.17 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.383 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.65 -65.08 0.75 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -170.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -153.81 146.39 24.13 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -171.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.589 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 19.7 m95 -60.62 125.64 24.47 Favored 'General case' 0 CA--C 1.502 -0.903 0 O-C-N 124.325 1.016 . . . . 0.0 109.834 -169.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' 1023 ' ' LEU . 18.0 m -111.95 -171.74 1.9 Allowed 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 -175.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -107.26 149.36 27.85 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 119.804 1.184 . . . . 0.0 109.224 175.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.532 ' O ' HG21 ' A' ' 988' ' ' VAL . 52.4 t0 -86.59 119.72 27.13 Favored 'General case' 0 C--N 1.317 -0.815 0 O-C-N 123.206 0.316 . . . . 0.0 110.216 -175.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 24.2 pt -120.11 13.33 6.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 122.227 1.013 . . . . 0.0 108.97 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.59 18.86 6.87 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.845 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -137.22 -176.24 4.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.401 -178.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.83 81.17 8.66 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 172.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.532 HG21 ' O ' ' A' ' 983' ' ' ASP . 16.5 m -134.66 162.67 38.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 114.429 -1.259 . . . . 0.0 109.555 -176.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -54.7 170.27 0.17 Allowed 'General case' 0 C--O 1.239 0.551 0 O-C-N 123.976 0.798 . . . . 0.0 110.026 170.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -53.04 -34.51 56.77 Favored 'General case' 0 CA--C 1.5 -0.973 0 CA-C-O 121.993 0.902 . . . . 0.0 110.538 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . 0.469 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 26.3 mttp -103.63 11.83 35.61 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.401 -1.272 . . . . 0.0 111.607 -174.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 90.73 -13.87 64.59 Favored Glycine 0 C--N 1.331 0.285 0 CA-C-N 116.739 -0.21 . . . . 0.0 113.483 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.634 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 97.7 m95 -51.9 146.78 7.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.566 0.698 . . . . 0.0 112.47 176.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -135.68 150.46 49.59 Favored 'General case' 0 C--O 1.252 1.198 0 CA-C-O 122.24 1.019 . . . . 0.0 112.216 -177.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.841 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 50.5 t80 -80.87 93.2 6.23 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 111.792 -2.458 . . . . 0.0 112.208 -172.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . 0.612 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -118.31 93.72 0.58 Allowed Glycine 0 CA--C 1.49 -1.478 0 C-N-CA 119.44 -1.362 . . . . 0.0 111.243 177.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.571 HG22 ' HA ' ' A' 1016 ' ' HIS . 12.0 pt -103.83 148.59 8.51 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.883 0 C-N-CA 118.204 -1.399 . . . . 0.0 108.556 -178.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 11.6 t -138.72 132.21 30.4 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.355 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.3 mp -114.45 114.47 45.12 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.03 136.34 64.74 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 123.068 2.512 . . . . 0.0 113.113 -178.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -85.23 138.42 25.69 Favored 'Cis proline' 0 N--CA 1.449 -1.11 0 C-N-CA 122.774 -1.761 . . . . 0.0 113.898 1.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 7.9 t0 162.02 126.52 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 111.271 -2.695 . . . . 0.0 104.624 -179.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -85.19 -43.04 14.16 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.739 -168.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 84.7 mttt -127.14 141.34 40.42 Favored Pre-proline 0 C--N 1.309 -1.157 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.347 -174.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -50.26 127.88 21.24 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.617 2.211 . . . . 0.0 110.614 169.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 21.2 pttm -110.62 15.52 21.98 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.012 -0.995 . . . . 0.0 108.484 -177.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 42.6 t -146.95 137.13 23.46 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.448 -175.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.673 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 59.7 m95 -137.62 135.89 36.99 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 125.367 1.667 . . . . 0.0 107.085 175.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.415 ' HB ' ' HB3' ' A' ' 995' ' ' TYR . 96.5 t -144.95 165.74 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 -171.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -82.99 -2.16 54.47 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -175.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -112.23 122.09 46.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 119.018 0.826 . . . . 0.0 112.538 -174.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.435 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 52.0 tp10 -72.13 120.58 17.93 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 174.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.538 ' H ' ' CE1' ' A' 1016 ' ' HIS . 94.5 mttt -124.66 155.79 38.6 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.004 -178.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 52.3 ttp -53.12 -40.08 63.92 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 123.863 0.727 . . . . 0.0 112.554 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -52.49 -7.98 0.08 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.568 1.321 . . . . 0.0 114.568 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.841 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 13.5 m80 -57.85 154.8 11.46 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 122.53 1.157 . . . . 0.0 112.993 179.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -161.55 -33.41 0.05 OUTLIER 'General case' 0 C--N 1.294 -1.827 0 CA-C-N 111.295 -2.684 . . . . 0.0 106.599 -167.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 14.2 m80 -135.21 141.49 45.83 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.697 -1.592 . . . . 0.0 108.601 174.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.634 ' HG2' ' CE3' ' A' ' 993' ' ' TRP . 43.3 ttt180 -152.47 142.49 22.22 Favored 'General case' 0 CA--C 1.483 -1.598 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.884 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . 2.5 ptp180 -150.57 167.89 25.89 Favored 'General case' 0 C--N 1.294 -1.822 0 O-C-N 124.074 0.859 . . . . 0.0 109.626 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.552 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 26.5 ptt180 -148.62 151.47 35.05 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.672 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 32.5 ttm180 -90.21 129.45 36.47 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.261 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' A' ' 981' ' ' SER . 84.8 mt -94.46 125.87 39.38 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 167.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.517 HG13 ' HB2' ' A' ' 983' ' ' ASP . 2.5 m -105.46 136.62 38.76 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.803 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.366 -174.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.768 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -144.24 109.75 5.2 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 124.641 1.213 . . . . 0.0 111.726 168.639 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.668 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -78.73 141.98 37.43 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -178.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.509 ' N ' ' HD2' ' A' 1026 ' ' LYS . 12.1 ptm180 -135.78 143.19 45.1 Favored 'General case' 0 C--O 1.201 -1.452 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -171.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.602 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.7 ttmt -125.9 138.53 53.79 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 123.606 0.566 . . . . 0.0 109.65 -175.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.666 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.7 ttmt -89.33 -22.3 22.7 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 123.285 1.517 . . . . 0.0 108.124 -178.132 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 21.6 t70 55.45 21.08 4.06 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 111.098 -2.774 . . . . 0.0 109.331 -169.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 42.8 tp 57.53 -41.54 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.849 2.059 . . . . 0.0 115.227 -174.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 9.4 t -69.15 -23.6 63.98 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 122.953 0.501 . . . . 0.0 112.32 -170.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.965 ' HB3' ' HA2' ' A' ' 972' ' ' GLY . 3.8 mt-30 . . . . . 0 C--N 1.322 -0.596 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -175.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 31.0 m-70 . . . . . 0 CA--C 1.493 -1.249 0 N-CA-C 105.37 -2.085 . . . . 0.0 105.37 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . 0.661 ' HB ' ' HB2' ' A' 1029 ' ' LYS . 1.0 OUTLIER -143.72 120.01 10.89 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 102.132 -3.285 . . . . 0.0 102.132 168.442 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.521 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.0 OUTLIER -142.16 168.36 19.92 Favored 'General case' 0 C--N 1.272 -2.783 0 C-N-CA 118.865 -1.134 . . . . 0.0 110.797 -178.375 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.642 ' O ' ' HG2' ' A' 1027 ' ' ARG . 54.7 t80 -157.19 124.7 5.31 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.638 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 17.8 m -75.42 126.85 31.84 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 118.897 0.771 . . . . 0.0 109.617 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -104.72 159.18 15.99 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 -177.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.491 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -153.42 145.01 23.31 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -174.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.469 HG22 ' H ' ' A' ' 935' ' ' TYR . 12.0 p -139.5 172.89 12.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 105.365 -2.087 . . . . 0.0 105.365 178.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.582 ' HA ' ' O ' ' A' 1021 ' ' ARG . 54.8 m-85 -132.52 138.88 47.67 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 118.7 0.682 . . . . 0.0 110.248 -174.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.616 ' O ' ' HA ' ' A' 1020 ' ' ARG . 24.3 tt0 -113.77 126.21 54.97 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -176.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . 0.498 ' HA ' ' O ' ' A' 1019 ' ' ARG . 0.0 OUTLIER -124.25 141.31 52.17 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 122.127 0.965 . . . . 0.0 113.432 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 35.8 mt-10 -115.31 158.5 22.3 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 104.972 -2.232 . . . . 0.0 104.972 171.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 36.8 m -139.62 152.58 46.9 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 119.007 0.821 . . . . 0.0 109.846 -172.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.682 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 24.6 ptt180 -156.99 160.95 39.53 Favored 'General case' 0 N--CA 1.44 -0.953 0 O-C-N 124.548 1.155 . . . . 0.0 109.499 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -78.55 161.26 70.29 Favored Pre-proline 0 C--N 1.312 -1.038 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 170.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -63.36 87.09 0.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 121.374 1.383 . . . . 0.0 111.273 172.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.22 1.93 5.17 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -176.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . 0.611 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -100.21 -178.68 30.19 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 109.88 -1.288 . . . . 0.0 109.88 177.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -108.38 163.1 13.5 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 171.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.682 ' CZ3' ' HG2' ' A' ' 940' ' ' ARG . 53.5 m95 -83.87 137.61 33.59 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 117.901 0.318 . . . . 0.0 110.756 -173.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -129.78 139.1 34.66 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 170.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.498 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 6.8 Cg_endo -50.28 123.4 11.05 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.691 2.261 . . . . 0.0 112.777 -176.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -52.04 151.2 3.83 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -57.3 -45.97 83.64 Favored 'General case' 0 CA--C 1.484 -1.561 0 CA-C-N 114.799 -1.091 . . . . 0.0 108.453 172.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . 0.45 ' HB3' ' HG2' ' A' ' 960' ' ' LYS . 52.8 m-20 -96.4 77.12 2.97 Favored 'General case' 0 N--CA 1.414 -2.267 0 N-CA-C 105.113 -2.18 . . . . 0.0 105.113 175.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 3.9 m -63.77 -41.73 97.91 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.439 -168.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . 0.436 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 66.9 m-85 -108.74 137.73 46.21 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 122.02 0.914 . . . . 0.0 112.18 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 4.6 p -144.87 174.47 10.97 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 125.485 1.514 . . . . 0.0 108.257 -170.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -106.07 178.69 4.49 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 173.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.47 -28.35 13.02 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -93.62 -13.16 27.96 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.934 -0.479 . . . . 0.0 111.455 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 107.33 -2.95 34.82 Favored Glycine 0 CA--C 1.491 -1.461 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.099 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -58.07 107.33 0.46 Allowed 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . 0.45 ' HG2' ' HB3' ' A' ' 951' ' ' ASP . 1.1 tmtp? -47.03 119.64 2.66 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 124.556 1.16 . . . . 0.0 110.169 178.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.45 179.59 4.07 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.047 -0.978 . . . . 0.0 110.306 -175.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . 0.47 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -78.4 156.37 29.5 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.813 178.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 13.0 p -76.21 161.23 75.87 Favored Pre-proline 0 N--CA 1.437 -1.096 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 178.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -61.12 -18.28 57.17 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 122.716 2.278 . . . . 0.0 112.454 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 4.2 m -74.27 -48.83 26.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 174.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . 0.47 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 42.4 mt-10 -65.26 -37.31 86.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.499 -1.228 . . . . 0.0 112.389 177.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.47 111.0 2.14 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.236 0.541 . . . . 0.0 110.396 -177.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 73.0 p -107.24 165.36 11.43 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.863 -176.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.605 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 9.1 p -97.81 128.6 33.57 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.705 172.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.62 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 61.3 Cg_endo -71.11 169.0 21.66 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.488 2.125 . . . . 0.0 110.34 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -46.91 -34.78 16.96 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.125 2.55 . . . . 0.0 114.685 -178.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.544 ' O ' ' HG2' ' A' 1029 ' ' LYS . . . -101.43 8.42 56.85 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 119.943 -1.122 . . . . 0.0 112.995 -177.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.62 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 76.1 m95 -124.2 133.47 53.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.829 0.823 . . . . 0.0 110.451 179.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.546 ' HB3' ' O ' ' A' 1028 ' ' LYS . 5.5 tp10 -126.01 119.45 27.71 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 126.563 1.945 . . . . 0.0 109.569 -173.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.67 ' CE3' ' HG2' ' A' 1025 ' ' ARG . 90.2 m95 -70.35 104.56 2.73 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 121.416 -0.802 . . . . 0.0 111.716 -178.033 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -70.49 -38.55 74.37 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.563 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . 0.545 ' HB2' ' HG3' ' A' 1025 ' ' ARG . 83.5 m-20 -78.46 152.67 31.98 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.269 0.557 . . . . 0.0 111.811 -176.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -88.69 107.57 19.01 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 174.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . 57.13 173.04 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 123.37 1.557 . . . . 0.0 114.405 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.459 ' HA ' ' O ' ' A' 1024 ' ' VAL . 24.5 m95 -91.2 124.09 35.15 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 112.851 -1.977 . . . . 0.0 108.08 177.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 15.1 m -124.31 155.62 38.37 Favored 'General case' 0 C--O 1.206 -1.211 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -175.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' 1022 ' ' ARG . 11.0 p90 -74.46 144.68 44.1 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 119.044 0.838 . . . . 0.0 111.206 -174.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.466 ' HB3' ' HD2' ' A' 1022 ' ' ARG . 18.0 t70 -102.67 126.16 49.66 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.633 -174.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.0 pp -114.86 26.5 3.69 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.111 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -109.25 27.27 9.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 123.489 1.614 . . . . 0.0 107.31 -178.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.607 ' HG2' ' H ' ' A' ' 987' ' ' ALA . 11.3 ttt180 -141.24 -178.58 5.66 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 -178.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.607 ' H ' ' HG2' ' A' ' 986' ' ' ARG . . . -89.0 82.0 6.75 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 119.451 1.023 . . . . 0.0 109.732 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 983' ' ' ASP . 28.3 m -128.41 -172.15 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 114.337 -1.301 . . . . 0.0 109.289 -178.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -92.9 -178.8 4.93 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 177.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -57.07 -33.45 67.27 Favored 'General case' 0 CA--C 1.494 -1.181 0 C-N-CA 123.987 0.915 . . . . 0.0 111.721 179.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -108.25 17.41 22.25 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.222 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 86.13 -23.06 10.08 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.12 -0.945 . . . . 0.0 113.588 177.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.879 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 79.0 m95 -56.25 111.68 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.695 0.759 . . . . 0.0 112.5 -177.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.707 ' HG3' ' CE3' ' A' 1008 ' ' TRP . 7.4 pt-20 -98.62 157.25 16.37 Favored 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 124.244 1.018 . . . . 0.0 109.944 -178.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.514 ' HB3' ' H ' ' A' 1009 ' ' VAL . 59.3 t80 -64.99 99.08 0.32 Allowed 'General case' 0 C--O 1.211 -0.953 0 CA-C-N 111.803 -2.453 . . . . 0.0 113.002 -174.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -120.9 114.93 2.75 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 119.462 -1.351 . . . . 0.0 112.573 172.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.413 ' HA ' ' H ' ' A' 1017 ' ' THR . 1.6 pt -118.57 151.84 20.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 106.131 -1.803 . . . . 0.0 106.131 174.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 76.7 m -133.37 97.32 3.93 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-O 122.168 0.985 . . . . 0.0 110.589 174.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.401 ' HA ' ' HD3' ' A' 1000 ' ' PRO . 77.0 mt -97.42 115.52 65.75 Favored Pre-proline 0 C--N 1.317 -0.845 0 CA-C-N 114.014 -1.448 . . . . 0.0 109.184 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 999' ' ' ILE . 27.0 Cg_exo -60.57 141.87 96.43 Favored 'Trans proline' 0 C--O 1.241 0.649 0 C-N-CA 122.82 2.347 . . . . 0.0 112.864 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . 0.442 ' O ' ' HB2' ' A' 1002 ' ' ASP . 9.7 Cg_endo -90.41 141.13 13.37 Favored 'Cis proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.862 -1.724 . . . . 0.0 114.365 0.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . 0.442 ' HB2' ' O ' ' A' 1001 ' ' PRO . 7.8 t0 160.17 166.59 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 111.867 -2.424 . . . . 0.0 106.521 176.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -117.04 -33.63 4.66 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 174.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 33.8 mttm -105.88 134.12 19.88 Favored Pre-proline 0 N--CA 1.429 -1.507 0 CA-C-N 114.806 -1.088 . . . . 0.0 113.463 -171.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.572 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 31.7 Cg_exo -66.26 126.28 15.43 Favored 'Trans proline' 0 C--N 1.329 -0.463 0 C-N-CA 122.775 2.317 . . . . 0.0 109.782 167.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -84.03 -57.39 3.21 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 122.217 1.008 . . . . 0.0 109.409 -177.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 3.7 m -87.5 136.01 33.11 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 112.742 -2.026 . . . . 0.0 111.608 -173.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.707 ' CE3' ' HG3' ' A' ' 994' ' ' GLU . 60.4 m95 -134.65 137.2 43.42 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.514 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 11.0 m -163.11 -173.31 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -175.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -97.3 97.6 9.28 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 175.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -165.27 167.37 18.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.426 -176.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.59 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.9 tp10 -148.2 101.24 3.25 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-O 122.066 0.936 . . . . 0.0 109.553 178.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 90.4 mttt -118.0 135.92 53.85 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 113.662 -1.608 . . . . 0.0 107.363 174.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 56.8 ttp -44.87 -22.77 0.1 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -177.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -68.01 -9.03 42.5 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 178.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.59 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 2.5 m80 -50.49 107.7 0.18 Allowed 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 123.754 0.821 . . . . 0.0 112.419 176.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . 0.413 ' H ' ' HA ' ' A' ' 997' ' ' ILE . 2.6 m -103.21 -21.38 13.87 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.78 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 3.5 m170 -145.54 123.3 11.9 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.576 -172.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.879 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 17.8 mmt180 -100.36 136.36 40.37 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 170.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.616 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 41.8 ttm180 -140.25 161.97 36.39 Favored 'General case' 0 C--O 1.197 -1.674 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 178.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.582 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.6 ptt180 -159.28 159.21 33.8 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 118.068 0.395 . . . . 0.0 110.257 174.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.491 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.5 ttm180 -90.6 120.99 32.13 Favored 'General case' 0 N--CA 1.424 -1.771 0 O-C-N 123.842 0.714 . . . . 0.0 109.934 177.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.405 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 65.7 mt -102.66 126.89 49.92 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 104.648 -2.352 . . . . 0.0 104.648 167.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 6.9 m -110.29 151.54 12.48 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.895 0 CA-C-O 122.032 0.92 . . . . 0.0 111.667 -175.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.67 ' HG2' ' CE3' ' A' ' 975' ' ' TRP . 0.6 OUTLIER -149.53 111.49 4.6 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 113.054 -1.884 . . . . 0.0 108.997 169.017 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.5 tmmm? -70.86 138.05 49.9 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.654 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 14.1 ptm180 -122.02 150.95 41.37 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 104.092 -2.559 . . . . 0.0 104.092 -173.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.546 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 71.3 tttt -144.8 132.07 20.63 Favored 'General case' 0 C--N 1.283 -2.31 0 O-C-N 123.265 0.353 . . . . 0.0 110.399 -167.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.661 ' HB2' ' HB ' ' A' ' 928' ' ' THR . 24.3 mtpp -88.58 -24.42 22.87 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 123.685 1.707 . . . . 0.0 108.049 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . 0.482 ' HB3' HG22 ' A' 1032 ' ' THR . 29.8 t0 50.21 10.25 0.05 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 110.895 -2.866 . . . . 0.0 112.742 -168.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . 0.411 ' H ' ' C ' ' A' 1029 ' ' LYS . 20.8 tp 60.15 13.68 4.01 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.053 1.741 . . . . 0.0 111.625 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . 0.482 HG22 ' HB3' ' A' 1030 ' ' ASP . 13.5 t -125.55 7.07 7.59 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -174.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.508 ' OE1' ' HB2' ' A' ' 974' ' ' GLU . 6.0 tt0 . . . . . 0 C--N 1.315 -0.921 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.914 -177.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 65.2 m-70 . . . . . 0 CA--C 1.499 -1.008 0 CA-C-O 119.311 -0.376 . . . . 0.0 111.735 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 2.9 m 60.84 85.38 0.11 Allowed 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.962 0.887 . . . . 0.0 108.784 -167.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.906 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.6 OUTLIER -104.76 165.92 10.74 Favored 'General case' 0 C--N 1.282 -2.33 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 178.225 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.574 ' O ' ' HG2' ' A' 1027 ' ' ARG . 79.2 t80 -148.45 123.56 10.13 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 -178.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 21.1 m -75.97 114.76 14.96 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 173.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -93.66 163.37 13.57 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.562 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 11.9 pt-20 -162.01 145.98 12.32 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 118.64 0.655 . . . . 0.0 110.368 -171.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 5.8 p -155.43 128.31 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.537 0.684 . . . . 0.0 111.381 172.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.653 ' HA ' ' O ' ' A' 1021 ' ' ARG . 70.1 m-85 -90.32 113.38 25.23 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.518 ' O ' ' HA ' ' A' 1020 ' ' ARG . 16.3 tt0 -79.52 128.62 33.59 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.792 171.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . 0.454 HD22 ' N ' ' A' ' 937' ' ' ASN . 0.5 OUTLIER -117.89 146.58 43.82 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 123.501 0.72 . . . . 0.0 109.907 -177.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.61 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 38.4 mt-10 -129.07 172.11 11.72 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 171.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 27.1 t -152.08 136.76 17.0 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 118.529 0.604 . . . . 0.0 110.622 -175.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.701 HH21 ' HB2' ' A' 1016 ' ' HIS . 22.4 ptt180 -136.85 159.63 41.3 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 176.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -81.21 166.92 35.56 Favored Pre-proline 0 C--N 1.308 -1.227 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 171.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . 0.453 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 15.6 Cg_exo -69.66 86.69 0.56 Allowed 'Trans proline' 0 N--CA 1.452 -0.948 0 N-CA-C 108.988 -1.197 . . . . 0.0 108.988 170.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.13 8.18 3.41 Favored Glycine 0 N--CA 1.436 -1.352 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 -173.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . 0.515 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -117.89 -179.26 17.32 Favored Glycine 0 CA--C 1.503 -0.713 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -112.02 158.28 19.74 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 119.822 1.811 . . . . 0.0 107.012 172.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.61 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 28.9 m95 -67.35 138.69 56.96 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-O 121.392 0.615 . . . . 0.0 110.798 -174.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -129.12 179.31 1.33 Allowed Pre-proline 0 C--N 1.302 -1.498 0 N-CA-C 101.412 -3.551 . . . . 0.0 101.412 174.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.9 144.48 99.57 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 CA-C-N 123.243 2.194 . . . . 0.0 111.406 177.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.94 -170.09 0.1 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.481 0.658 . . . . 0.0 110.818 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.518 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.0 OUTLIER -90.62 -35.74 14.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 -177.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -123.28 100.15 6.7 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 104.556 -2.387 . . . . 0.0 104.556 168.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 27.6 m -69.13 -59.45 3.02 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -173.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -96.0 128.25 42.73 Favored 'General case' 0 C--N 1.313 -0.99 0 O-C-N 121.277 -0.889 . . . . 0.0 109.719 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 18.1 p -148.89 -178.05 6.14 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.705 0.764 . . . . 0.0 111.352 -168.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -108.3 168.49 9.27 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 104.314 -2.476 . . . . 0.0 104.314 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.38 -30.88 31.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 119.153 0.888 . . . . 0.0 111.114 174.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -78.54 -8.34 58.47 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 95.07 -4.75 68.02 Favored Glycine 0 CA--C 1.501 -0.799 0 C-N-CA 120.263 -0.97 . . . . 0.0 112.224 178.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -62.08 102.25 0.27 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . 0.412 ' HD3' ' C ' ' A' ' 960' ' ' LYS . 12.5 tmtt? -50.68 122.78 7.74 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.571 1.17 . . . . 0.0 109.438 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.24 -173.2 2.41 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.317 -178.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . 0.619 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -78.9 152.94 30.89 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 177.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.3 m -79.05 157.7 75.68 Favored Pre-proline 0 C--N 1.315 -0.892 0 N-CA-C 107.435 -1.321 . . . . 0.0 107.435 178.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.582 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 7.5 Cg_exo -49.18 -24.89 8.66 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.586 2.857 . . . . 0.0 115.653 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.8 t -80.24 -43.34 21.58 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 177.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . 0.619 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 46.2 mm-40 -64.87 -32.2 73.79 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.768 175.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.484 HD13 ' CH2' ' A' ' 980' ' ' TRP . 83.6 mt -68.59 118.55 11.76 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 175.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 10.0 p -126.14 -175.39 3.35 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.126 -171.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.663 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 25.9 p -109.99 124.94 32.2 Favored Pre-proline 0 N--CA 1.435 -1.189 0 O-C-N 121.905 -0.497 . . . . 0.0 110.457 177.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.662 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 98.1 Cg_endo -77.04 173.24 14.77 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 122.908 2.405 . . . . 0.0 110.713 174.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -41.93 -48.64 6.02 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 124.271 3.314 . . . . 0.0 115.451 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.462 ' O ' ' HA ' ' A' 1029 ' ' LYS . . . -101.38 14.01 58.21 Favored Glycine 0 N--CA 1.439 -1.102 0 C-N-CA 120.141 -1.028 . . . . 0.0 113.584 -175.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.663 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 88.5 m95 -119.95 121.4 38.91 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 118.437 1.118 . . . . 0.0 111.71 179.342 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.464 ' HB2' ' OE1' ' A' 1033 ' ' GLN . 7.5 tp10 -110.08 127.69 55.01 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 126.602 1.961 . . . . 0.0 109.585 -172.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -70.77 106.89 3.73 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.722 0.772 . . . . 0.0 112.393 174.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . 0.449 ' H ' ' HA ' ' A' 1027 ' ' ARG . 5.5 tp10 -72.15 -47.11 53.41 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 172.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . 0.785 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 3.6 m-20 -87.41 160.6 18.26 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.704 -1.135 . . . . 0.0 112.229 -178.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -91.13 -53.32 4.41 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -168.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -148.32 132.67 17.53 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -173.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.582 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 17.1 m95 -61.11 123.1 16.69 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 123.989 0.805 . . . . 0.0 109.806 -172.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 49.8 p -122.8 156.02 35.38 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -177.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . 0.485 ' HB3' ' HD2' ' A' 1021 ' ' ARG . 0.0 OUTLIER -72.47 140.84 48.49 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.334 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.53 ' HB2' HG13 ' A' 1024 ' ' VAL . 52.6 t0 -91.16 130.5 37.04 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.832 -1.077 . . . . 0.0 111.117 -171.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.1 pp -115.59 14.25 7.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.501 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . 0.593 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 3.5 t-20 -97.37 16.45 20.07 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.009 0.909 . . . . 0.0 109.146 -176.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.593 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 7.6 mpt_? -139.87 179.75 6.42 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -175.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.85 86.2 3.43 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.691 0.758 . . . . 0.0 110.768 179.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 18.2 m -125.73 -179.23 2.37 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 114.933 -1.03 . . . . 0.0 109.39 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -73.67 177.82 5.17 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -64.82 -28.14 69.36 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 118.725 0.693 . . . . 0.0 111.768 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 57.3 mttt -85.87 -57.42 3.05 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 141.08 71.79 0.03 OUTLIER Glycine 0 CA--C 1.498 -1.013 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.667 177.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -145.6 140.79 27.63 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -99.93 160.08 14.59 Favored 'General case' 0 C--O 1.252 1.235 0 CA-C-N 118.944 0.793 . . . . 0.0 109.996 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.636 ' O ' ' HA ' ' A' 1008 ' ' TRP . 21.6 t80 -83.65 99.36 10.16 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 127.412 2.285 . . . . 0.0 109.547 -176.078 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . 0.521 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -120.97 120.95 4.65 Favored Glycine 0 N--CA 1.433 -1.505 0 C-N-CA 119.005 -1.569 . . . . 0.0 110.741 175.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.566 HG22 ' HA ' ' A' 1016 ' ' HIS . 13.8 pt -127.47 143.17 41.52 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 C-N-CA 118.579 -1.248 . . . . 0.0 109.148 177.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.7 t -146.1 155.63 42.89 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 20.5 pt -116.6 107.91 45.92 Favored Pre-proline 0 C--N 1.315 -0.927 0 C-N-CA 119.931 -0.708 . . . . 0.0 110.865 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -69.13 136.6 35.11 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.497 2.131 . . . . 0.0 112.556 -178.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -87.15 150.35 38.57 Favored 'Cis proline' 0 N--CA 1.45 -1.035 0 C-N-CA 122.938 -1.692 . . . . 0.0 112.816 -1.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 25.0 t70 -165.0 -86.68 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 113.336 -1.756 . . . . 0.0 107.707 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -178.5 -81.14 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 63.3 mttm -144.19 160.42 49.06 Favored Pre-proline 0 C--N 1.317 -0.811 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.614 ' HG2' ' HB2' ' A' 1018 ' ' HIS . 36.1 Cg_exo -58.5 144.34 97.04 Favored 'Trans proline' 0 C--O 1.241 0.675 0 C-N-CA 122.433 2.089 . . . . 0.0 110.882 169.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 39.8 mmtt -98.85 -48.18 5.01 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 -177.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 3.4 m -89.06 139.14 30.76 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 111.724 -2.489 . . . . 0.0 111.406 -173.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.636 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 61.8 m95 -135.11 132.64 38.34 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 175.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 37.1 t -142.11 170.04 12.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 -169.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -90.53 97.99 11.51 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 119.619 1.099 . . . . 0.0 108.274 172.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . 0.416 ' HB3' ' CD2' ' A' ' 995' ' ' TYR . . . -177.08 177.26 1.28 Allowed 'General case' 0 C--O 1.238 0.492 0 C-N-CA 122.81 0.444 . . . . 0.0 109.862 -176.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.526 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.1 OUTLIER -169.48 110.62 0.46 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.242 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 76.3 mttt -122.34 150.81 41.87 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.384 -1.28 . . . . 0.0 108.756 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 24.2 ttt -53.43 -36.26 61.35 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . 0.453 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 59.7 m-85 -72.85 14.21 0.3 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.03 0.532 . . . . 0.0 111.62 -179.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.701 ' HB2' HH21 ' A' ' 940' ' ' ARG . 0.3 OUTLIER -63.45 176.38 0.84 Allowed 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 121.863 0.84 . . . . 0.0 110.12 171.032 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . 0.644 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.7 OUTLIER -163.41 -31.04 0.04 OUTLIER 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.006 -1.452 . . . . 0.0 108.793 -168.236 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . 0.614 ' HB2' ' HG2' ' A' 1005 ' ' PRO . 59.7 m80 -145.56 155.87 43.33 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.416 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -154.66 152.52 30.06 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 105.863 -1.903 . . . . 0.0 105.863 176.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.518 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 3.8 ptp180 -151.65 165.58 33.9 Favored 'General case' 0 C--O 1.195 -1.805 0 C-N-CA 118.418 -1.313 . . . . 0.0 109.837 178.188 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.653 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.3 ptt180 -149.17 145.71 27.3 Favored 'General case' 0 C--N 1.289 -2.05 0 C-N-CA 119.471 -0.891 . . . . 0.0 109.64 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.562 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.7 ttm180 -85.91 114.99 23.26 Favored 'General case' 0 N--CA 1.424 -1.749 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.509 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 65.6 mt -84.67 123.31 30.22 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 103.603 -2.74 . . . . 0.0 103.603 167.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.53 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.3 m -102.3 149.41 6.89 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.92 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -176.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.785 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -152.34 110.0 3.62 Favored 'General case' 0 C--N 1.289 -2.048 0 O-C-N 125.138 1.524 . . . . 0.0 111.542 166.558 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.437 ' HD2' ' N ' ' A' 1027 ' ' ARG . 2.7 tmmm? -84.35 146.42 27.71 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -176.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 12.2 ptm180 -142.98 179.9 6.76 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 104.643 -2.355 . . . . 0.0 104.643 -170.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.906 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 14.1 ptpt -162.56 155.58 19.83 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 118.648 0.658 . . . . 0.0 109.767 178.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 972' ' ' GLY . 33.1 ttmt -91.24 -12.56 34.86 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.166 0.984 . . . . 0.0 109.953 -172.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 33.9 t70 60.03 19.44 8.58 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.208 -1.815 . . . . 0.0 108.734 -175.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 37.3 tp 62.33 -29.46 0.08 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.865 2.066 . . . . 0.0 115.196 -179.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 13.4 t -136.41 19.87 3.14 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 119.508 1.049 . . . . 0.0 110.106 -169.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.464 ' OE1' ' HB2' ' A' ' 974' ' ' GLU . 18.5 tt0 . . . . . 0 C--N 1.323 -0.58 0 CA-C-O 121.559 0.695 . . . . 0.0 110.561 -179.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.487 -1.478 0 CA-C-O 121.309 0.576 . . . . 0.0 110.483 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . 0.452 ' OG1' ' HB3' ' A' 1029 ' ' LYS . 0.5 OUTLIER -91.34 113.29 25.52 Favored 'General case' 0 N--CA 1.415 -2.213 0 N-CA-C 104.809 -2.293 . . . . 0.0 104.809 160.555 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.644 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.4 OUTLIER -129.28 129.62 45.14 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 176.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -121.64 135.14 54.99 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -179.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 26.0 m -71.16 123.06 21.3 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 177.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -98.54 156.53 16.74 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 104.651 -2.351 . . . . 0.0 104.651 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.799 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.1 pt-20 -154.93 159.21 40.26 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 118.209 0.459 . . . . 0.0 110.672 -170.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.443 HG12 ' CZ3' ' A' ' 980' ' ' TRP . 7.7 p -158.77 131.37 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 170.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.456 ' HA ' ' O ' ' A' 1021 ' ' ARG . 37.7 m-85 -82.3 150.19 27.38 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 122.284 1.04 . . . . 0.0 111.063 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.504 ' O ' ' HA ' ' A' 1020 ' ' ARG . 23.8 tt0 -126.12 125.42 42.49 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 -179.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . 0.984 ' HB3' ' HG2' ' A' 1020 ' ' ARG . 0.0 OUTLIER -124.1 145.68 49.11 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.787 0.804 . . . . 0.0 111.398 -178.392 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.594 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 18.8 mt-10 -139.13 153.3 47.96 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 -178.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 15.2 m -136.37 149.55 48.39 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 121.168 0.509 . . . . 0.0 111.544 -172.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.591 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 20.2 ptt180 -146.62 161.34 40.74 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 114.14 -1.391 . . . . 0.0 108.343 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -66.89 158.76 79.33 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 170.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . 0.58 ' HG3' HG23 ' A' 1017 ' ' THR . 36.9 Cg_exo -61.13 85.85 0.09 OUTLIER 'Trans proline' 0 C--O 1.237 0.458 0 CA-C-N 120.687 1.281 . . . . 0.0 110.39 172.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 110.03 73.52 0.75 Allowed Glycine 0 N--CA 1.434 -1.457 0 N-CA-C 106.74 -2.544 . . . . 0.0 106.74 -173.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -166.34 -144.89 4.25 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 119.721 -1.228 . . . . 0.0 113.65 -172.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -128.91 123.6 33.02 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.417 -0.892 . . . . 0.0 110.639 -172.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.594 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 64.3 m95 -73.84 136.44 43.48 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 -178.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -142.34 163.16 41.12 Favored Pre-proline 0 C--N 1.295 -1.763 0 N-CA-C 102.791 -3.04 . . . . 0.0 102.791 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -49.2 137.06 30.52 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.851 1.7 . . . . 0.0 113.575 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.38 -172.7 0.08 Allowed 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.349 175.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.54 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.1 OUTLIER -84.36 -35.91 22.86 Favored 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 -178.452 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . 0.503 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 53.4 m-20 -123.03 97.45 5.44 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 170.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 25.7 m -61.16 -49.67 76.3 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -170.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -102.73 126.17 49.74 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.026 0.917 . . . . 0.0 111.783 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 10.6 p -135.16 165.59 25.05 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.702 -174.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 24.6 t70 -91.19 170.05 10.33 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 172.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.93 -29.88 22.05 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.101 0.864 . . . . 0.0 112.635 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -96.02 13.05 28.33 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 70.67 49.39 30.32 Favored Glycine 0 CA--C 1.484 -1.898 0 C-N-CA 121.061 -0.59 . . . . 0.0 111.711 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 16.8 t70 -107.73 109.43 21.02 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 103.617 -2.734 . . . . 0.0 103.617 177.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . 0.503 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 20.9 tptm -45.16 113.54 0.59 Allowed 'General case' 0 C--N 1.312 -1.027 0 O-C-N 124.6 1.188 . . . . 0.0 111.276 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.11 176.02 5.41 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.002 -176.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . 0.512 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -80.5 159.88 25.41 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.2 m -86.87 159.02 52.67 Favored Pre-proline 0 N--CA 1.433 -1.304 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.624 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 15.4 Cg_exo -46.57 -26.77 4.58 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 124.225 3.283 . . . . 0.0 115.608 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.9 t -71.93 -49.22 39.46 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . 0.512 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 1.5 mp0 -64.56 -33.15 75.25 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.15 0.5 . . . . 0.0 110.181 176.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.448 ' HB2' ' HA ' ' A' ' 964' ' ' PRO . 73.5 mt -64.89 110.96 2.61 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.978 0.894 . . . . 0.0 109.591 178.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.09 179.21 5.88 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.141 -173.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.508 ' HB3' ' NE1' ' A' ' 975' ' ' TRP . 25.0 p -94.74 136.87 22.65 Favored Pre-proline 0 C--N 1.321 -0.632 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.974 -176.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.601 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 44.7 Cg_endo -84.78 167.66 11.24 Favored 'Trans proline' 0 C--O 1.241 0.641 0 C-N-CA 122.977 2.452 . . . . 0.0 110.731 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -67.01 103.96 0.79 Allowed 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 121.607 1.538 . . . . 0.0 110.289 175.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.514 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 124.59 -2.23 8.74 Favored Glycine 0 N--CA 1.438 -1.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.92 -177.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.601 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 94.5 m95 -133.98 130.75 38.08 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 122.035 0.921 . . . . 0.0 111.255 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -117.24 131.41 56.85 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 126.586 1.954 . . . . 0.0 109.602 -170.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.581 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 91.9 m95 -83.95 156.74 22.18 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.571 177.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -140.11 -36.36 0.49 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.183 -178.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -68.15 146.52 53.35 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.507 178.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.55 -43.63 80.22 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -177.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.73 168.51 12.43 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -176.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.624 ' CD1' ' HB3' ' A' ' 964' ' ' PRO . 45.2 m95 -70.07 118.37 12.81 Favored 'General case' 0 C--N 1.309 -1.159 0 O-C-N 124.435 1.085 . . . . 0.0 108.446 -179.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . 0.687 ' O ' ' HA ' ' A' 1023 ' ' LEU . 21.0 m -110.3 -161.0 0.73 Allowed 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 104.853 -2.277 . . . . 0.0 104.853 -173.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . 0.416 ' HB2' ' HA3' ' A' ' 992' ' ' GLY . 15.4 p90 -119.75 153.06 36.24 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 121.669 2.031 . . . . 0.0 109.697 177.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.523 ' HB2' ' HD2' ' A' 1022 ' ' ARG . 20.8 t70 -83.28 114.95 21.75 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.719 0.771 . . . . 0.0 111.063 -173.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.436 ' HA ' HG21 ' A' ' 988' ' ' VAL . 23.4 pt -107.1 -157.89 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.649 176.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 10.1 t30 49.79 44.01 24.85 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.923 1.344 . . . . 0.0 108.589 -172.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.45 ' HD3' ' CG1' ' A' ' 988' ' ' VAL . 52.4 ttt85 -153.43 -179.71 8.01 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 -172.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.409 ' H ' ' HG2' ' A' ' 986' ' ' ARG . . . -87.95 69.82 9.42 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.832 -1.174 . . . . 0.0 107.832 176.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.45 ' CG1' ' HD3' ' A' ' 986' ' ' ARG . 24.1 m -122.79 150.66 26.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.67 -1.15 . . . . 0.0 113.154 -173.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . 0.453 ' HB3' ' HB2' ' A' ' 993' ' ' TRP . 23.8 t70 -55.25 171.68 0.16 Allowed 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 113.271 -1.786 . . . . 0.0 110.751 168.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.53 -34.01 47.89 Favored 'General case' 0 CA--C 1.499 -0.991 0 C-N-CA 123.669 0.788 . . . . 0.0 111.304 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . 0.543 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 71.3 mmtt -106.46 16.92 24.07 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.347 -174.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . 0.416 ' HA3' ' HB2' ' A' ' 982' ' ' TYR . . . 93.69 -11.1 71.79 Favored Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.586 173.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.623 ' CG ' ' HD3' ' A' 1019 ' ' ARG . 97.1 m95 -59.93 153.31 21.45 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -137.49 152.38 49.47 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-N 115.238 -0.892 . . . . 0.0 112.252 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.693 ' HD2' ' HB ' ' A' 1009 ' ' VAL . 0.3 OUTLIER -62.32 99.85 0.15 Allowed 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 113.429 -1.714 . . . . 0.0 111.853 -178.267 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . 0.509 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -117.91 84.36 0.37 Allowed Glycine 0 CA--C 1.49 -1.497 0 C-N-CA 118.964 -1.589 . . . . 0.0 111.829 172.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.772 ' O ' ' HA ' ' A' 1005 ' ' PRO . 2.3 tt -92.4 131.79 38.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 O-C-N 121.581 -0.953 . . . . 0.0 109.806 -176.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 29.4 m -131.23 110.93 11.48 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 61.0 mt -117.81 119.46 33.87 Favored Pre-proline 0 C--N 1.314 -0.975 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.489 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 44.9 Cg_exo -58.53 144.62 96.88 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 122.816 2.344 . . . . 0.0 112.145 177.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 12.2 Cg_endo -90.86 127.22 6.48 Favored 'Cis proline' 0 N--CA 1.445 -1.341 0 C-N-CA 123.279 -1.55 . . . . 0.0 112.805 -1.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 49.3 t0 156.8 141.7 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 110.878 -2.874 . . . . 0.0 105.84 -176.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.0 p80 -125.43 41.95 3.4 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 122.997 1.38 . . . . 0.0 108.7 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 59.1 mttp -138.5 139.42 24.7 Favored Pre-proline 0 N--CA 1.434 -1.257 0 CA-C-N 112.915 -1.948 . . . . 0.0 107.441 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.772 ' HA ' ' O ' ' A' ' 997' ' ' ILE . 81.5 Cg_exo -57.23 170.38 1.66 Allowed 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.234 1.956 . . . . 0.0 113.081 167.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -110.16 -46.33 3.46 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.85 -173.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 13.4 t -160.81 147.23 15.09 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -174.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . . . . . . . . . 42.8 m95 -112.83 124.33 52.36 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.693 ' HB ' ' HD2' ' A' ' 995' ' ' TYR . 46.3 t -143.88 161.62 15.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 -169.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -93.34 -1.2 56.21 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.835 0.35 . . . . 0.0 111.483 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . 0.515 ' H ' HG12 ' A' 1009 ' ' VAL . . . -101.08 116.5 32.99 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.158 0.504 . . . . 0.0 111.045 -175.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.41 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 42.9 tp10 -71.36 114.99 10.0 Favored 'General case' 0 N--CA 1.439 -1.025 0 CA-C-O 122.226 1.012 . . . . 0.0 111.033 177.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.484 ' H ' ' CE1' ' A' 1016 ' ' HIS . 66.4 mttm -120.59 147.92 44.57 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 113.985 -1.461 . . . . 0.0 108.51 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 54.8 ttp -51.13 -37.43 46.08 Favored 'General case' 0 C--N 1.307 -1.28 0 O-C-N 124.091 0.869 . . . . 0.0 112.799 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -55.11 -12.14 0.84 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.665 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 26.5 m80 -58.19 109.76 0.82 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.071 0.463 . . . . 0.0 111.833 175.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . 0.58 HG23 ' HG3' ' A' ' 942' ' ' PRO . 0.0 OUTLIER -97.63 -31.34 12.34 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 123.268 1.508 . . . . 0.0 109.319 175.62 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . 0.509 ' HB2' ' O ' ' A' ' 996' ' ' GLY . 30.4 m170 -136.41 155.93 49.33 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 113.774 -1.557 . . . . 0.0 108.162 -176.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.623 ' HD3' ' CG ' ' A' ' 993' ' ' TRP . 11.3 ttm180 -153.08 139.37 18.47 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 177.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.984 ' HG2' ' HB3' ' A' ' 937' ' ' ASN . 95.9 mtt180 -134.05 166.02 23.7 Favored 'General case' 0 CA--C 1.481 -1.69 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -177.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.602 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 24.5 ptt180 -155.74 153.47 29.94 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 124.23 0.956 . . . . 0.0 108.616 168.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.799 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 34.4 ttm180 -86.52 120.75 28.18 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 176.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.687 ' HA ' ' O ' ' A' ' 981' ' ' SER . 77.6 mt -86.71 129.45 34.87 Favored 'General case' 0 N--CA 1.423 -1.791 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 169.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.456 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 14.1 m -108.3 135.26 47.61 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 CA-C-O 121.419 0.628 . . . . 0.0 112.397 -172.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.464 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.3 tpt180 -142.98 97.63 3.13 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 170.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.565 ' HD3' ' HB2' ' A' ' 929' ' ' GLU . 0.0 OUTLIER -74.65 152.79 39.15 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 -179.607 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.581 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 8.1 ptm180 -142.18 166.58 24.31 Favored 'General case' 0 CA--C 1.496 -1.098 0 N-CA-C 106.255 -1.757 . . . . 0.0 106.255 -171.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.644 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 13.6 ptpt -155.19 152.74 29.74 Favored 'General case' 0 C--O 1.196 -1.727 0 CA-C-O 121.042 0.449 . . . . 0.0 110.842 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.514 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 36.9 ttmt -91.39 -21.28 21.07 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 -178.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 14.3 t70 46.97 27.53 0.74 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 111.175 -2.738 . . . . 0.0 110.411 -169.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 34.8 tp 70.82 -47.52 0.65 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.332 1.853 . . . . 0.0 114.005 177.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 11.3 t -90.55 14.82 12.13 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -170.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 . . . . . 0 C--O 1.216 -0.692 0 O-C-N 121.237 -0.914 . . . . 0.0 110.833 175.467 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . . . . . . . . 0.259 0.6 OUTLIER . . . . . 0 CA--C 1.492 -1.277 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.66 122.91 35.55 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 163.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.438 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.1 OUTLIER -139.19 137.86 36.4 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 170.758 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.419 ' O ' ' HG2' ' A' 1027 ' ' ARG . 91.8 t80 -136.19 140.62 43.71 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.689 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 28.0 m -72.2 129.65 38.95 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 118.673 0.67 . . . . 0.0 112.108 178.257 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -100.19 160.56 14.23 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 105.989 -1.856 . . . . 0.0 105.989 177.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -158.94 145.24 16.84 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.323 0.582 . . . . 0.0 110.961 -171.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.552 HG11 ' HG3' ' A' ' 964' ' ' PRO . 14.6 p -141.02 171.47 12.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 177.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.426 ' H ' HG22 ' A' ' 934' ' ' VAL . 83.5 m-85 -127.89 143.13 51.11 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -176.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.615 ' O ' ' HA ' ' A' 1020 ' ' ARG . 16.9 tt0 -117.65 118.21 31.49 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.397 179.265 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -95.89 126.17 40.96 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 124.365 1.041 . . . . 0.0 111.288 -178.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.527 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 47.8 mt-10 -121.27 154.38 36.42 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 169.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 33.8 m -144.84 158.19 43.89 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.566 -0.853 . . . . 0.0 110.727 -173.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.498 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 28.7 ptt180 -151.64 159.58 43.98 Favored 'General case' 0 N--CA 1.427 -1.598 0 O-C-N 124.57 1.169 . . . . 0.0 108.612 178.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -76.51 166.85 41.68 Favored Pre-proline 0 C--N 1.309 -1.185 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.73 74.36 1.28 Allowed 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 121.359 1.373 . . . . 0.0 111.212 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 139.86 8.14 0.94 Allowed Glycine 0 CA--C 1.528 0.86 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 -176.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . 0.493 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -101.43 -166.33 27.54 Favored Glycine 0 C--N 1.336 0.538 0 N-CA-C 111.071 -0.811 . . . . 0.0 111.071 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -125.61 159.9 31.0 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.588 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 45.5 m95 -73.53 129.76 38.65 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 122.127 0.965 . . . . 0.0 110.304 -175.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . 0.409 ' HA ' ' HD3' ' A' ' 948' ' ' PRO . 17.8 pttp -146.39 138.45 13.55 Favored Pre-proline 0 C--N 1.287 -2.15 0 N-CA-C 103.627 -2.731 . . . . 0.0 103.627 172.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' A' ' 938' ' ' GLU . 80.2 Cg_exo -49.87 124.6 12.78 Favored 'Trans proline' 0 C--O 1.239 0.548 0 C-N-CA 123.148 2.565 . . . . 0.0 114.733 -169.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -52.44 -177.49 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.231 169.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -102.61 -0.08 32.49 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 115.883 -2.327 . . . . 0.0 109.215 -163.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . 0.511 ' HB3' ' HG3' ' A' ' 960' ' ' LYS . 20.3 m-20 -132.63 82.92 2.03 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 103.018 -2.956 . . . . 0.0 103.018 169.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.0 m -69.31 -37.04 77.57 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.342 -167.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -109.12 131.01 55.48 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.531 0.681 . . . . 0.0 112.204 -176.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 42.5 p -145.54 178.81 7.85 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.842 -169.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -99.19 171.5 7.97 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 176.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.01 -31.88 31.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 118.335 0.516 . . . . 0.0 111.231 174.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -81.21 -15.23 56.28 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.065 0.46 . . . . 0.0 112.037 177.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 101.64 -4.32 53.76 Favored Glycine 0 CA--C 1.497 -1.064 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.458 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.87 102.5 0.08 Allowed 'General case' 0 CA--C 1.503 -0.829 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . 0.511 ' HG3' ' HB3' ' A' ' 951' ' ' ASP . 5.3 tmmm? -51.65 130.69 28.86 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 124.432 1.082 . . . . 0.0 109.571 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -130.54 175.73 8.75 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.014 -0.993 . . . . 0.0 109.484 -173.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . 0.425 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -64.18 144.44 57.12 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 176.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.0 m -68.91 159.42 82.72 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -178.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.584 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 51.8 Cg_exo -52.65 -21.66 15.21 Favored 'Trans proline' 0 N--CA 1.48 0.733 0 C-N-CA 123.865 3.043 . . . . 0.0 114.705 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 5.2 p -70.94 -53.45 14.93 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . 0.425 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 3.0 mp0 -68.84 -24.8 64.4 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.297 176.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.572 ' HB2' ' HA ' ' A' ' 964' ' ' PRO . 37.3 mt -63.56 111.37 2.33 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.206 1.003 . . . . 0.0 108.68 175.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 2.7 p -130.08 169.52 15.2 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.85 -171.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 15.8 p -87.15 143.07 34.17 Favored Pre-proline 0 C--N 1.313 -0.985 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.981 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.573 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 96.8 Cg_endo -75.09 175.61 11.01 Favored 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 122.703 2.269 . . . . 0.0 110.017 174.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.61 -45.4 41.31 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.928 1.752 . . . . 0.0 114.272 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . . . . . . . . . . . -76.56 -45.4 13.72 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.073 -1.06 . . . . 0.0 112.779 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.573 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 97.5 m95 -76.82 145.15 38.63 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 -179.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.521 ' HB3' ' O ' ' A' 1028 ' ' LYS . 4.6 tp10 -125.59 149.78 48.08 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 -179.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.603 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 94.6 m95 -86.07 156.33 20.45 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 120.495 -1.378 . . . . 0.0 111.594 172.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -120.42 -44.98 2.45 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . 0.572 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.0 OUTLIER -78.75 157.14 28.56 Favored 'General case' 0 CA--C 1.499 -1.018 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.914 -176.629 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -88.62 110.05 20.61 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.863 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . 0.519 ' C ' ' HD3' ' A' 1025 ' ' ARG . . . 57.51 176.77 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 O-C-N 125.223 1.577 . . . . 0.0 113.71 174.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.584 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 36.9 m95 -89.53 120.66 31.02 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 113.905 -1.498 . . . . 0.0 107.291 176.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 36.7 m -125.64 145.28 50.22 Favored 'General case' 0 C--N 1.295 -1.77 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 -176.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -73.21 135.03 44.52 Favored 'General case' 0 C--N 1.301 -1.536 0 CA-C-O 121.691 0.757 . . . . 0.0 110.044 -174.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -85.72 133.36 34.01 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 114.195 -1.366 . . . . 0.0 111.608 -170.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.574 ' HA ' HG21 ' A' ' 988' ' ' VAL . 1.8 pp -114.22 21.85 6.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.024 177.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -104.39 30.5 5.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.856 0.836 . . . . 0.0 108.798 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.563 ' HB2' HG13 ' A' ' 988' ' ' VAL . 78.1 mtp180 -136.84 -179.52 5.75 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 -178.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -81.34 84.17 6.71 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 171.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.574 HG21 ' HA ' ' A' ' 984' ' ' ILE . 11.9 m -115.5 -178.78 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 122.485 1.136 . . . . 0.0 113.928 -173.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . 0.574 ' HB3' ' H ' ' A' ' 993' ' ' TRP . 3.7 t70 -74.15 179.12 4.62 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 112.727 -2.033 . . . . 0.0 108.67 178.094 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.49 -31.56 69.47 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 118.768 0.713 . . . . 0.0 111.967 178.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -102.06 -44.65 5.4 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.169 -174.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 139.19 75.37 0.05 OUTLIER Glycine 0 CA--C 1.489 -1.534 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.899 176.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.619 ' HA ' ' HB3' ' A' 1021 ' ' ARG . 72.2 m95 -139.45 179.68 6.41 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.537 ' HG3' ' CE3' ' A' 1008 ' ' TRP . 6.9 pt-20 -143.15 153.54 42.97 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 122.285 1.04 . . . . 0.0 110.917 -177.308 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.763 ' O ' ' HA ' ' A' 1008 ' ' TRP . 9.6 t80 -81.99 104.44 12.35 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 112.777 -2.011 . . . . 0.0 112.272 -173.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . 0.457 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -128.78 116.8 2.32 Favored Glycine 0 C--O 1.216 -0.995 0 C-N-CA 118.478 -1.82 . . . . 0.0 112.667 172.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.808 HD12 ' HE1' ' A' 1015 ' ' TYR . 0.5 OUTLIER -109.18 149.61 12.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 O-C-N 120.349 -1.677 . . . . 0.0 109.461 -179.157 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 33.1 m -138.27 115.86 11.33 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 174.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 2.6 mp -100.42 108.13 51.44 Favored Pre-proline 0 C--N 1.305 -1.326 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 177.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -68.32 150.3 76.1 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.519 2.146 . . . . 0.0 113.057 -175.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -89.33 148.33 23.77 Favored 'Cis proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.474 -1.886 . . . . 0.0 112.474 -2.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 13.4 t70 -164.05 -89.16 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.419 -1.718 . . . . 0.0 109.032 177.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 159.32 -76.85 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.0 1.32 . . . . 0.0 109.925 -177.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 90.8 mttt -126.42 150.59 70.82 Favored Pre-proline 0 N--CA 1.447 -0.589 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.049 -172.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -63.85 147.07 92.33 Favored 'Trans proline' 0 C--O 1.239 0.571 0 C-N-CA 123.555 2.837 . . . . 0.0 110.425 170.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -93.89 -50.73 5.2 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 20.7 m -102.06 152.15 21.31 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 112.774 -2.012 . . . . 0.0 112.543 -172.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.763 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 67.3 m95 -135.22 137.09 42.28 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.214 -1.357 . . . . 0.0 107.929 -178.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.68 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 20.9 t -136.63 -109.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.864 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 -175.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -167.44 -31.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 118.65 0.659 . . . . 0.0 110.939 -171.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -72.16 -169.44 0.5 Allowed 'General case' 0 C--O 1.237 0.433 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.457 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.2 tp10 -150.0 105.95 3.45 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.528 -172.336 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 87.4 mttt -115.0 139.15 50.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.761 -1.108 . . . . 0.0 109.456 176.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . 0.473 ' HA ' ' NH2' ' A' ' 940' ' ' ARG . 24.4 ttt -45.92 -32.56 2.76 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . 0.808 ' HE1' HD12 ' A' ' 997' ' ' ILE . 40.5 p90 -74.79 5.27 5.16 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 118.794 -1.162 . . . . 0.0 111.366 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.588 ' HB3' ' CH2' ' A' ' 946' ' ' TRP . 0.6 OUTLIER -60.02 118.35 6.18 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.535 171.282 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 21.1 p -110.5 -13.04 14.31 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.081 174.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 27.0 m80 -140.5 147.52 39.69 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 122.653 1.216 . . . . 0.0 113.265 -174.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -151.47 144.87 24.8 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 176.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.615 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 98.0 mtt180 -138.27 168.79 19.0 Favored 'General case' 0 CA--C 1.466 -2.252 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -179.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.619 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 30.3 ptt180 -154.16 153.64 32.15 Favored 'General case' 0 C--N 1.284 -2.281 0 O-C-N 124.677 1.235 . . . . 0.0 108.007 168.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.442 ' HG2' HG13 ' A' 1024 ' ' VAL . 41.8 ttm180 -91.51 115.65 28.22 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 123.558 0.536 . . . . 0.0 109.837 179.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.57 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 81.3 mt -90.12 125.19 35.35 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 169.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 17.6 m -112.83 153.45 14.42 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.866 0 CA-C-O 121.776 0.798 . . . . 0.0 111.33 -174.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.543 ' HG3' ' HB2' ' A' ' 977' ' ' ASP . 31.3 ttp180 -158.83 110.28 2.14 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-N 112.798 -2.001 . . . . 0.0 109.691 168.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.689 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.7 tmmm? -76.0 149.52 37.58 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -178.285 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.603 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 7.4 ptm180 -136.17 139.41 42.83 Favored 'General case' 0 C--O 1.204 -1.336 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -169.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 30.2 ttmt -125.74 135.83 52.5 Favored 'General case' 0 C--N 1.283 -2.283 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.078 -173.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.55 ' C ' ' H ' ' A' 1031 ' ' LEU . 35.3 ttmt -88.34 -21.02 24.59 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 123.571 1.653 . . . . 0.0 107.781 -177.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 3.2 t70 53.65 -2.92 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 111.135 -2.757 . . . . 0.0 114.127 -170.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . 0.55 ' H ' ' C ' ' A' 1029 ' ' LYS . 15.9 tp 61.68 16.31 7.66 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 125.905 1.682 . . . . 0.0 111.305 178.078 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 13.5 t -123.09 3.45 9.31 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -179.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 13.9 tt0 . . . . . 0 N--CA 1.438 -1.038 0 CA-C-N 113.852 -1.522 . . . . 0.0 107.141 -178.966 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . 0.441 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 20.1 m-70 . . . . . 0 CA--C 1.5 -0.975 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -161.92 116.79 1.94 Allowed 'General case' 0 N--CA 1.413 -2.312 0 N-CA-C 102.267 -3.234 . . . . 0.0 102.267 172.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -142.29 138.65 31.48 Favored 'General case' 0 C--N 1.282 -2.337 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 175.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . 0.433 ' O ' ' HG2' ' A' 1027 ' ' ARG . 84.4 t80 -131.13 139.55 49.83 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.557 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 33.3 m -78.75 123.0 26.73 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -99.79 159.72 14.85 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 -173.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -154.51 156.25 36.33 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 119.589 -0.845 . . . . 0.0 111.492 -171.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . 0.527 HG22 ' H ' ' A' ' 935' ' ' TYR . 14.2 p -150.37 177.4 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 N-CA-C 106.768 -1.568 . . . . 0.0 106.768 175.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.565 ' HA ' ' O ' ' A' 1021 ' ' ARG . 78.7 m-85 -138.28 151.22 47.4 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.4 ' O ' ' HA ' ' A' 1020 ' ' ARG . 28.0 tt0 -120.34 124.83 46.51 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 -177.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -117.79 149.71 40.34 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.528 0.68 . . . . 0.0 111.849 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.598 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 38.9 mt-10 -144.0 159.33 42.78 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 125.306 1.442 . . . . 0.0 107.44 175.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 46.1 m -142.3 142.63 32.56 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.452 0.644 . . . . 0.0 111.777 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.503 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 17.8 ptt180 -141.78 161.07 38.86 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -176.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -67.68 152.67 96.09 Favored Pre-proline 0 C--N 1.311 -1.103 0 N-CA-C 105.291 -2.114 . . . . 0.0 105.291 170.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . 0.551 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 40.8 Cg_exo -60.59 90.37 0.09 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.636 1.558 . . . . 0.0 112.131 176.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 101.44 68.58 0.83 Allowed Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -157.98 -123.15 0.72 Allowed Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.176 -1.012 . . . . 0.0 111.106 -175.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -145.98 131.03 18.28 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.77 -0.715 . . . . 0.0 109.928 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.598 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 51.2 m95 -72.35 141.3 48.79 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.942 0.877 . . . . 0.0 109.448 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -125.02 149.66 64.07 Favored Pre-proline 0 C--N 1.289 -2.032 0 N-CA-C 101.955 -3.35 . . . . 0.0 101.955 175.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.549 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 31.8 Cg_exo -56.39 152.01 41.85 Favored 'Trans proline' 0 C--N 1.323 -0.787 0 C-N-CA 121.394 1.396 . . . . 0.0 111.697 -177.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -70.07 -171.55 0.45 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.121 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -105.98 -18.92 13.89 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -119.18 85.82 2.44 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 103.635 -2.728 . . . . 0.0 103.635 169.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 9.6 m -56.62 -54.0 51.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.032 -173.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . 0.505 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 70.5 m-85 -105.73 134.22 49.2 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-O 121.666 0.746 . . . . 0.0 111.106 177.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 15.5 p -143.9 171.63 13.97 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.628 -171.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . 0.702 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 20.7 t0 -107.64 -176.23 3.01 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 106.187 -1.783 . . . . 0.0 106.187 178.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.05 -35.56 25.53 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -175.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -105.9 10.42 32.44 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 100.14 -1.9 56.41 Favored Glycine 0 CA--C 1.497 -1.091 0 C-N-CA 119.36 -1.4 . . . . 0.0 112.457 177.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . 0.702 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 23.9 t70 -51.48 101.95 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 O-C-N 124.791 0.936 . . . . 0.0 109.165 173.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -56.53 123.64 15.48 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.559 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -120.95 -179.88 4.16 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.817 -175.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -75.98 154.87 35.52 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 175.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 6.1 m -83.29 150.42 60.63 Favored Pre-proline 0 N--CA 1.431 -1.389 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.711 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 50.7 Cg_exo -42.71 -33.75 3.12 Favored 'Trans proline' 0 N--CA 1.48 0.686 0 C-N-CA 124.841 3.694 . . . . 0.0 117.324 -174.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 15.5 t -79.05 -43.62 23.85 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -66.8 -25.72 66.59 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.0 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.505 HD13 ' CH2' ' A' ' 980' ' ' TRP . 7.0 mt -66.3 110.43 3.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.398 0.618 . . . . 0.0 110.904 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.3 p -105.5 154.01 20.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.251 0.548 . . . . 0.0 112.211 -176.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.4 ' HB3' ' CE2' ' A' ' 975' ' ' TRP . 8.1 p -90.43 153.71 46.24 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.143 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.581 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 89.7 Cg_endo -77.58 168.89 21.89 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.05 1.833 . . . . 0.0 110.118 173.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -65.03 -9.75 22.84 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.111 1.874 . . . . 0.0 113.74 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.616 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -115.05 17.45 17.24 Favored Glycine 0 C--O 1.221 -0.665 0 C-N-CA 121.331 -0.462 . . . . 0.0 112.6 178.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.581 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 75.6 m95 -137.31 134.9 36.59 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-O 122.066 0.936 . . . . 0.0 110.133 175.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.658 ' HB3' ' O ' ' A' 1028 ' ' LYS . 8.7 tp10 -116.92 133.49 55.95 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-N 113.609 -1.632 . . . . 0.0 109.573 -169.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.665 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 65.9 m95 -82.39 100.26 9.9 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.422 -0.911 . . . . 0.0 109.911 174.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -74.44 -40.14 62.14 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.61 138.3 58.46 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 114.057 -1.428 . . . . 0.0 112.081 -177.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -52.39 -60.3 3.39 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 124.115 0.884 . . . . 0.0 111.953 176.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.5 154.72 8.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.99 -171.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.711 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 28.3 m95 -65.33 117.22 7.55 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -178.119 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 19.8 m -120.98 151.75 39.36 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 -173.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -73.52 133.17 43.54 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 119.055 0.843 . . . . 0.0 110.434 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.462 ' HB2' HG13 ' A' 1024 ' ' VAL . 45.0 t0 -82.35 122.45 28.0 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.123 -172.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 31.2 pt -114.03 8.36 7.77 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.314 -177.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -93.38 33.27 1.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.809 0.814 . . . . 0.0 109.064 -175.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . 0.631 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 53.6 mtp180 -143.58 -176.25 4.89 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -176.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -84.79 78.65 9.84 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 172.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.425 HG21 ' O ' ' A' ' 983' ' ' ASP . 17.3 m -138.71 161.42 30.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.624 -175.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . 0.401 ' HB3' ' HB2' ' A' ' 993' ' ' TRP . 11.7 t70 -55.58 169.34 0.32 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.293 1.037 . . . . 0.0 110.914 172.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -54.76 -33.6 61.49 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.479 0.657 . . . . 0.0 110.176 178.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . 0.514 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 86.4 mttt -98.38 9.07 43.94 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 115.092 -0.958 . . . . 0.0 112.106 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.68 -11.81 71.11 Favored Glycine 0 C--O 1.227 -0.314 0 N-CA-C 111.674 -0.57 . . . . 0.0 111.674 175.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . 0.671 ' HB3' ' CD ' ' A' 1019 ' ' ARG . 59.6 m95 -54.16 138.97 36.92 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.536 -0.832 . . . . 0.0 112.91 178.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.42 ' HG2' HG12 ' A' ' 988' ' ' VAL . 31.2 mt-10 -113.48 155.56 25.12 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.437 0.637 . . . . 0.0 111.462 -177.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.709 ' HB3' ' H ' ' A' 1009 ' ' VAL . 15.1 t80 -77.46 100.53 6.05 Favored 'General case' 0 C--O 1.209 -1.074 0 C-N-CA 127.08 2.152 . . . . 0.0 111.329 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -126.59 97.84 0.5 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 119.056 -1.545 . . . . 0.0 113.218 173.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.598 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -97.75 146.7 7.41 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 O-C-N 120.628 -1.513 . . . . 0.0 107.179 178.869 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 25.0 m -115.12 79.03 1.22 Allowed 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.719 0.771 . . . . 0.0 109.418 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.505 ' HA ' ' HD3' ' A' 1000 ' ' PRO . 2.0 pp -72.98 125.46 91.07 Favored Pre-proline 0 N--CA 1.447 -0.586 0 CA-C-N 114.592 -1.186 . . . . 0.0 111.846 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.505 ' HD3' ' HA ' ' A' ' 999' ' ' ILE . 2.7 Cg_exo -71.31 143.34 43.3 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.401 2.067 . . . . 0.0 114.183 -177.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . 0.447 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.9 Cg_endo -97.27 137.31 3.94 Favored 'Cis proline' 0 N--CA 1.444 -1.384 0 C-N-CA 122.973 -1.678 . . . . 0.0 112.873 -3.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 3.9 t70 -177.18 177.92 1.17 Allowed 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 112.312 -2.222 . . . . 0.0 106.507 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 10.7 m170 -119.61 -43.51 2.58 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 82.1 mttt -125.15 150.6 67.42 Favored Pre-proline 0 C--N 1.307 -1.249 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.128 -174.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . 0.531 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 77.0 Cg_exo -57.7 124.6 16.42 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.335 2.023 . . . . 0.0 110.305 171.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . 0.407 ' H ' ' HG2' ' A' 1006 ' ' LYS . 41.5 pttt -112.14 11.18 20.32 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 121.918 0.866 . . . . 0.0 109.726 -177.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . . . . . . . . . 46.8 t -148.85 140.98 23.94 Favored 'General case' 0 N--CA 1.431 -1.386 0 CA-C-N 114.611 -1.177 . . . . 0.0 107.933 -176.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.641 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 47.1 m95 -138.76 141.82 38.83 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.229 0.956 . . . . 0.0 108.836 -178.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.844 HG12 ' H ' ' A' 1010 ' ' ALA . 21.5 t -152.14 -165.08 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 102.933 -2.988 . . . . 0.0 102.933 -176.248 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . 0.844 ' H ' HG12 ' A' 1009 ' ' VAL . . . -101.67 -32.92 10.09 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 120.112 1.324 . . . . 0.0 112.554 -179.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -68.64 122.81 19.29 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -167.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.52 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 3.0 tp10 -70.98 117.91 13.08 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 171.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.454 ' HD3' ' HE2' ' A' ' 995' ' ' TYR . 56.5 mtpt -115.34 151.95 33.69 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 173.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 25.6 ttt -49.48 -44.6 46.04 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 124.442 1.089 . . . . 0.0 111.677 174.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . 0.551 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 88.4 m-85 -65.32 7.44 0.21 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.598 ' CD2' HG22 ' A' ' 997' ' ' ILE . 6.2 m170 -66.79 114.16 5.45 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 121.86 0.838 . . . . 0.0 112.366 176.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.31 -35.19 11.32 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-N 112.852 -1.976 . . . . 0.0 108.156 177.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 25.6 m170 -136.31 154.29 50.91 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.104 -174.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . 0.671 ' CD ' ' HB3' ' A' ' 993' ' ' TRP . 9.1 ttm180 -160.44 147.16 15.64 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 994' ' ' GLU . 2.2 ptm180 -151.06 154.73 37.56 Favored 'General case' 0 C--O 1.196 -1.743 0 C-N-CA 119.516 -0.874 . . . . 0.0 110.676 -177.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.565 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 23.2 ptt180 -135.25 149.29 49.82 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.563 -0.855 . . . . 0.0 111.428 -176.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.631 ' NH1' ' HD2' ' A' ' 986' ' ' ARG . 34.7 ttm180 -87.95 129.55 35.21 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 123.2 0.313 . . . . 0.0 110.512 178.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.509 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 61.6 mt -103.96 129.25 51.5 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 167.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.569 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 6.2 m -107.11 141.57 22.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.877 -174.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.549 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 9.9 tpt180 -137.46 106.11 5.87 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.164 170.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.0 tmmm? -72.5 135.85 45.77 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.665 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.2 ptm180 -131.56 134.43 46.07 Favored 'General case' 0 C--O 1.204 -1.333 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -172.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.658 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.1 ttmt -125.03 137.88 54.22 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 -173.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.616 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.9 ttmt -91.13 -17.74 25.65 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 124.053 1.882 . . . . 0.0 106.978 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . 0.417 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 15.6 t70 60.99 -0.41 0.32 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 111.347 -2.66 . . . . 0.0 111.624 -171.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . 0.516 ' H ' ' C ' ' A' 1029 ' ' LYS . 29.6 tp 72.58 -2.68 2.57 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 127.02 2.128 . . . . 0.0 112.56 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 10.3 t -119.62 -1.8 10.56 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -177.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.457 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 26.5 tt0 . . . . . 0 N--CA 1.431 -1.395 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.438 -178.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 927' ' ' HIS . . . . . 0.448 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 3.1 m-70 . . . . . 0 CA--C 1.482 -1.667 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.48 131.25 55.0 Favored 'General case' 0 N--CA 1.413 -2.291 0 N-CA-C 105.85 -1.908 . . . . 0.0 105.85 160.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 929' ' ' GLU . . . . . 0.563 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.9 OUTLIER -143.81 147.56 34.3 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.348 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -140.89 143.89 34.94 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 176.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 931' ' ' THR . . . . . 0.597 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 24.8 m -75.32 130.53 39.2 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 120.769 0.319 . . . . 0.0 111.068 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -106.08 158.08 17.07 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 933' ' ' GLU . . . . . 0.933 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 10.6 pt-20 -149.46 156.54 42.16 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 118.54 0.609 . . . . 0.0 110.385 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 7.2 p -153.2 130.4 2.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-O 121.255 0.55 . . . . 0.0 109.944 170.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 935' ' ' TYR . . . . . 0.633 ' HA ' ' O ' ' A' 1021 ' ' ARG . 62.0 m-85 -80.34 147.09 31.24 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -176.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 936' ' ' GLN . . . . . 0.655 ' O ' ' HA ' ' A' 1020 ' ' ARG . 32.9 tt0 -116.27 111.66 20.47 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -110.56 142.19 42.72 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.811 0.815 . . . . 0.0 112.328 -172.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 49.3 mt-10 -141.78 162.11 36.28 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 113.806 -1.543 . . . . 0.0 107.196 173.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 939' ' ' SER . . . . . 0.676 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 25.4 p -150.23 157.72 43.39 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 121.7 0.762 . . . . 0.0 111.995 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 940' ' ' ARG . . . . . 0.55 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 30.9 ptt180 -149.95 158.56 44.29 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 113.459 -1.7 . . . . 0.0 108.029 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -76.56 166.51 44.33 Favored Pre-proline 0 C--N 1.308 -1.212 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 168.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -65.75 90.74 0.24 Allowed 'Trans proline' 0 N--CA 1.449 -1.104 0 N-CA-C 108.576 -1.356 . . . . 0.0 108.576 168.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.39 -8.45 5.93 Favored Glycine 0 N--CA 1.435 -1.424 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -172.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 944' ' ' GLY . . . . . 0.55 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -103.44 -177.8 26.14 Favored Glycine 0 C--N 1.341 0.809 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 -178.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -118.89 163.21 17.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 120.795 2.297 . . . . 0.0 106.969 172.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 946' ' ' TRP . . . . . 0.602 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 42.3 m95 -64.45 135.65 56.29 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.955 0.883 . . . . 0.0 112.656 -172.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -138.84 171.82 7.56 Favored Pre-proline 0 C--N 1.309 -1.173 0 N-CA-C 103.394 -2.817 . . . . 0.0 103.394 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -52.21 124.07 14.06 Favored 'Trans proline' 0 C--O 1.234 0.322 0 CA-C-N 121.806 1.681 . . . . 0.0 110.76 176.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 949' ' ' ALA . . . . . 0.676 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -51.88 -68.43 0.17 Allowed 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -174.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.401 ' CG ' ' H ' ' A' ' 951' ' ' ASP . 7.2 pt-20 -168.18 -50.59 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 104.793 -2.299 . . . . 0.0 104.793 -172.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 951' ' ' ASP . . . . . 0.401 ' H ' ' CG ' ' A' ' 950' ' ' GLU . 23.2 m-20 -132.48 125.94 31.82 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 104.216 -2.513 . . . . 0.0 104.216 171.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 20.0 m -65.7 -58.64 5.23 Favored 'General case' 0 C--N 1.313 -1.002 0 O-C-N 123.329 0.393 . . . . 0.0 111.698 -174.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 953' ' ' TYR . . . . . 0.518 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 76.4 m-85 -102.25 132.21 48.33 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.381 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 954' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' ' 960' ' ' LYS . 69.9 p -142.23 177.78 8.01 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.817 0.817 . . . . 0.0 110.829 -172.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -100.68 171.47 7.68 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 105.291 -2.115 . . . . 0.0 105.291 174.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.12 -36.18 39.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.468 0.576 . . . . 0.0 111.5 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -75.81 -39.98 55.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.219 0.533 . . . . 0.0 110.66 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 133.51 -6.79 4.94 Favored Glycine 0 CA--C 1.493 -1.287 0 C-N-CA 120.499 -0.857 . . . . 0.0 112.053 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -58.37 105.28 0.27 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 176.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 960' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 953' ' ' TYR . 7.0 ttpm? -50.84 128.24 20.5 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.718 0.771 . . . . 0.0 111.525 176.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -115.39 -172.4 2.14 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.361 -1.29 . . . . 0.0 108.089 -177.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -82.0 159.05 23.61 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.62 152.24 72.35 Favored Pre-proline 0 N--CA 1.433 -1.286 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 177.262 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 964' ' ' PRO . . . . . 0.557 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 6.1 Cg_exo -45.5 -35.41 12.24 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 124.441 3.427 . . . . 0.0 114.917 -178.353 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 19.5 m -75.26 -46.87 30.9 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -69.0 -5.09 19.6 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.905 0.882 . . . . 0.0 112.414 174.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 967' ' ' LEU . . . . . 0.461 HD13 ' CH2' ' A' ' 980' ' ' TRP . 13.9 mt -90.85 114.7 27.18 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.947 0.403 . . . . 0.0 110.271 -178.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 34.5 p -117.26 172.95 6.96 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.21 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 969' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 6.2 p -95.6 141.43 23.18 Favored Pre-proline 0 C--N 1.319 -0.719 0 CA-C-O 120.938 0.399 . . . . 0.0 111.375 -178.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 970' ' ' PRO . . . . . 0.582 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 42.0 Cg_endo -84.55 170.34 10.4 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.368 2.712 . . . . 0.0 112.716 -178.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -64.36 102.7 0.4 Allowed 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 122.05 1.833 . . . . 0.0 110.415 174.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 972' ' ' GLY . . . . . 0.651 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 126.13 -7.12 7.67 Favored Glycine 0 N--CA 1.433 -1.507 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 973' ' ' TRP . . . . . 0.582 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.2 m95 -135.62 138.19 42.66 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 122.246 1.022 . . . . 0.0 111.395 -177.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 974' ' ' GLU . . . . . 0.515 ' HB2' HE21 ' A' 1033 ' ' GLN . 9.4 tp10 -129.53 145.6 51.44 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 126.55 1.94 . . . . 0.0 108.932 -171.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 975' ' ' TRP . . . . . 0.678 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 89.2 m95 -84.73 153.85 22.79 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.826 0.822 . . . . 0.0 112.03 174.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 976' ' ' GLU . . . . . 0.745 ' HB2' ' HD2' ' A' 1028 ' ' LYS . 40.3 tt0 -129.01 -37.27 1.71 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.215 177.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -74.54 151.99 39.4 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.022 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.24 -30.2 18.68 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -165.4 141.34 5.32 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.524 0.602 . . . . 0.0 111.749 -173.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 980' ' ' TRP . . . . . 0.6 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 36.2 m95 -63.21 123.88 19.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.055 -0.975 . . . . 0.0 108.537 -178.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 981' ' ' SER . . . . . 0.761 ' O ' ' HA ' ' A' 1023 ' ' LEU . 15.0 m -116.29 -165.51 1.06 Allowed 'General case' 0 C--O 1.203 -1.36 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 -175.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -119.69 148.22 43.65 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 120.604 1.547 . . . . 0.0 110.624 177.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 983' ' ' ASP . . . . . 0.401 ' CB ' ' HD2' ' A' 1022 ' ' ARG . 15.6 t0 -96.19 116.14 28.53 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.078 0.466 . . . . 0.0 109.83 -174.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.586 ' HA ' HG21 ' A' ' 988' ' ' VAL . 26.9 pt -106.26 15.83 6.98 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.452 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -96.7 38.41 1.22 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.259 1.028 . . . . 0.0 108.8 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 40.4 mtt180 -140.82 -176.74 4.78 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 -175.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.01 85.73 6.68 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 171.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 988' ' ' VAL . . . . . 0.586 HG21 ' HA ' ' A' ' 984' ' ' ILE . 23.0 m -135.83 150.79 28.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.967 -176.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 989' ' ' ASP . . . . . 0.449 ' HB2' ' HB3' ' A' 1011 ' ' ALA . 21.2 t70 -52.81 169.09 0.1 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.823 171.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -55.32 -34.08 63.89 Favored 'General case' 0 CA--C 1.507 -0.701 0 C-N-CA 123.369 0.668 . . . . 0.0 111.869 178.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -95.97 11.73 32.92 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.51 -177.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 992' ' ' GLY . . . . . 0.414 ' O ' ' HB3' ' A' 1021 ' ' ARG . . . 69.62 77.72 0.41 Allowed Glycine 0 N--CA 1.432 -1.581 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.687 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -147.0 129.11 15.58 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 994' ' ' GLU . . . . . 0.534 ' HB2' ' HB3' ' A' 1008 ' ' TRP . 3.7 pt-20 -103.24 154.02 19.78 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 177.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 995' ' ' TYR . . . . . 0.839 ' HB3' ' HA ' ' A' 1011 ' ' ALA . 0.5 OUTLIER -110.02 127.8 55.03 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.502 -172.47 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 996' ' ' GLY . . . . . 0.487 ' HA2' ' O ' ' A' 1007 ' ' SER . . . -127.29 141.21 12.45 Favored Glycine 0 N--CA 1.422 -2.297 0 CA-C-N 113.95 -1.477 . . . . 0.0 109.731 176.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 997' ' ' ILE . . . . . 0.716 HG22 ' HA ' ' A' 1016 ' ' HIS . 1.0 OUTLIER -121.41 138.7 50.91 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 C-N-CA 122.387 0.275 . . . . 0.0 110.507 -179.808 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.1 t -145.01 150.26 36.57 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.4 mp -108.11 100.64 37.66 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 176.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1000 ' ' PRO . . . . . 0.493 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 48.9 Cg_endo -70.5 134.27 26.05 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.343 2.028 . . . . 0.0 113.42 -175.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1001 ' ' PRO . . . . . 0.493 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.7 Cg_endo -94.81 150.04 10.41 Favored 'Cis proline' 0 N--CA 1.445 -1.339 0 C-N-CA 122.919 -1.701 . . . . 0.0 113.572 -1.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 27.9 t70 -149.43 -86.49 0.08 Allowed 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 112.964 -1.925 . . . . 0.0 107.164 176.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1003 ' ' HIS . . . . . 0.524 ' HB2' ' H ' ' A' 1004 ' ' LYS . 31.9 m-70 -158.87 -82.81 0.05 OUTLIER 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 170.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1004 ' ' LYS . . . . . 0.524 ' H ' ' HB2' ' A' 1003 ' ' HIS . 63.6 mttp -150.92 160.76 31.64 Favored Pre-proline 0 N--CA 1.439 -1.015 0 CA-C-N 113.937 -1.483 . . . . 0.0 109.073 177.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -56.28 143.61 85.02 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.801 2.334 . . . . 0.0 111.052 168.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -124.75 12.21 8.51 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 122.321 1.058 . . . . 0.0 108.174 -175.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1007 ' ' SER . . . . . 0.487 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 33.2 t -135.96 126.28 26.58 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 114.173 -1.376 . . . . 0.0 107.755 -173.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1008 ' ' TRP . . . . . 0.603 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 55.2 m95 -136.74 132.54 34.97 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 124.211 0.944 . . . . 0.0 108.489 -178.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.648 HG12 ' H ' ' A' 1010 ' ' ALA . 3.8 t -151.18 -178.08 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 -171.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1010 ' ' ALA . . . . . 0.648 ' H ' HG12 ' A' 1009 ' ' VAL . . . -65.53 109.71 2.45 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 119.016 0.825 . . . . 0.0 109.64 175.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1011 ' ' ALA . . . . . 0.839 ' HA ' ' HB3' ' A' ' 995' ' ' TYR . . . -52.73 108.53 0.32 Allowed 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 124.069 0.948 . . . . 0.0 112.234 -178.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1012 ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' 1013 ' ' LYS . 13.1 pt-20 -128.6 -48.29 1.27 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 178.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1013 ' ' LYS . . . . . 0.451 ' N ' ' HG3' ' A' 1012 ' ' GLU . 15.4 ptmt -78.06 147.56 34.68 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -168.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1014 ' ' MET . . . . . . . . . . . . . 24.7 ttt -62.49 -40.72 97.6 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 175.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -68.62 2.92 2.11 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -175.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1016 ' ' HIS . . . . . 0.716 ' HA ' HG22 ' A' ' 997' ' ' ILE 0.315 14.2 p-80 -82.84 128.13 34.12 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 116.0 -2.28 . . . . 0.0 111.202 174.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 1017 ' ' THR . . . . . . . . . . . . . 73.7 p -101.42 -11.51 19.31 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.245 -166.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -139.95 143.69 36.68 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -176.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -142.5 152.58 42.82 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 175.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1020 ' ' ARG . . . . . 0.655 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 2.2 ptp180 -155.32 167.51 30.13 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 175.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1021 ' ' ARG . . . . . 0.633 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 27.7 ptt180 -150.15 153.56 36.55 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.061 175.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1022 ' ' ARG . . . . . 0.933 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 26.7 ttm180 -86.65 115.19 23.95 Favored 'General case' 0 N--CA 1.427 -1.596 0 O-C-N 123.864 0.727 . . . . 0.0 109.479 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1023 ' ' LEU . . . . . 0.761 ' HA ' ' O ' ' A' ' 981' ' ' SER . 76.1 mt -85.94 127.32 34.59 Favored 'General case' 0 N--CA 1.421 -1.88 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 169.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1024 ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 10.2 m -104.08 133.36 48.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.491 -173.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1025 ' ' ARG . . . . . 0.549 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.9 tpt180 -141.04 102.52 4.27 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.247 171.296 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1026 ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.5 OUTLIER -76.23 145.54 39.67 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 -179.043 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 1027 ' ' ARG . . . . . 0.678 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 5.9 ptm180 -136.39 157.84 45.85 Favored 'General case' 0 C--O 1.208 -1.092 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 -171.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1028 ' ' LYS . . . . . 0.745 ' HD2' ' HB2' ' A' ' 976' ' ' GLU . 21.2 ptmt -141.91 151.34 42.55 Favored 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -174.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1029 ' ' LYS . . . . . 0.651 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.6 ttmt -89.49 -20.33 23.98 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-O 123.304 1.526 . . . . 0.0 106.955 177.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1030 ' ' ASP . . . . . 0.448 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 33.9 t70 54.93 -0.49 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 111.402 -2.635 . . . . 0.0 113.101 -172.29 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1031 ' ' LEU . . . . . 0.543 ' H ' ' C ' ' A' 1029 ' ' LYS . 12.2 tp 66.35 6.11 4.11 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 126.489 1.916 . . . . 0.0 110.582 -178.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1032 ' ' THR . . . . . . . . . . . . . 18.1 p -105.83 -8.19 17.87 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-O 121.947 0.879 . . . . 0.0 109.42 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1033 ' ' GLN . . . . . 0.515 HE21 ' HB2' ' A' ' 974' ' ' GLU . 0.8 OUTLIER . . . . . 0 C--N 1.323 -0.573 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.265 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 49.2 mm . . . . . 0 C--O 1.236 0.347 0 CA-C-O 121.474 0.654 . . . . 0.0 109.794 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -139.47 154.2 71.36 Favored Pre-proline 0 C--N 1.32 -0.686 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 172.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -86.13 20.88 1.16 Allowed 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.227 1.951 . . . . 0.0 113.859 -177.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -107.73 -38.78 5.77 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.207 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 13.2 t -113.15 156.6 22.93 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 173.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -90.0 96.91 10.89 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . 0.406 ' HA ' ' HE2' ' A' ' 927' ' ' HIS . 49.4 m-20 -73.53 86.83 1.59 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -173.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -146.69 -60.62 0.3 Allowed 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.477 -1.238 . . . . 0.0 107.781 173.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -65.23 92.96 0.15 Allowed Glycine 0 CA--C 1.499 -0.949 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 924' ' ' ASP 0.263 95.6 m-70 -179.19 -46.13 0.01 OUTLIER 'General case' 0 CA--C 1.479 -1.755 0 N-CA-C 104.918 -2.253 . . . . 0.0 104.918 -170.527 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . 0.526 HG22 ' HH2' ' A' ' 973' ' ' TRP . 1.5 m 62.76 89.41 0.09 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 125.301 1.625 . . . . 0.0 108.196 -171.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.564 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.5 OUTLIER -128.69 128.87 44.94 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 106.816 -1.549 . . . . 0.0 106.816 174.754 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.483 ' O ' ' HG2' ' A' 1027 ' ' ARG . 87.2 t80 -121.78 136.3 54.93 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 121.495 -0.753 . . . . 0.0 109.058 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.594 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 23.4 m -69.57 120.21 15.01 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 176.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -94.98 146.81 23.99 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.768 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.3 pt-20 -152.86 158.08 41.65 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 118.436 0.562 . . . . 0.0 111.229 -169.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 3.7 p -160.53 129.37 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.408 0.623 . . . . 0.0 111.137 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.639 ' HA ' ' O ' ' A' 1021 ' ' ARG . 50.5 m-85 -88.94 112.66 23.59 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.786 -176.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -85.81 142.8 28.67 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . 1.067 ' HB3' ' HB3' ' A' 1020 ' ' ARG . 0.0 OUTLIER -144.44 162.22 37.07 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -178.329 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.603 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 44.8 mt-10 -131.18 162.2 30.48 Favored 'General case' 0 C--O 1.246 0.91 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 16.6 t -135.16 146.25 48.57 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.203 176.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.59 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 18.1 ptt180 -152.58 162.42 41.25 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -176.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -67.49 152.58 96.08 Favored Pre-proline 0 C--N 1.31 -1.141 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 171.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -56.89 94.42 0.06 OUTLIER 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 122.1 1.866 . . . . 0.0 112.98 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 94.07 65.44 1.03 Allowed Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 108.071 -2.012 . . . . 0.0 108.071 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -159.33 -156.4 8.06 Favored Glycine 0 N--CA 1.435 -1.418 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.349 -173.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -105.27 125.17 50.69 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.321 -0.94 . . . . 0.0 110.04 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.603 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 56.5 m95 -80.14 147.89 31.18 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-O 121.619 0.724 . . . . 0.0 109.9 -177.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -128.66 171.33 8.81 Favored Pre-proline 0 C--N 1.298 -1.667 0 N-CA-C 103.475 -2.787 . . . . 0.0 103.475 174.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -59.17 135.97 69.56 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 CA-C-N 121.245 1.48 . . . . 0.0 109.801 175.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -58.9 174.06 0.38 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.976 0.893 . . . . 0.0 112.338 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -69.63 -38.47 77.2 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.189 -1.368 . . . . 0.0 107.494 -178.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -122.4 104.23 9.26 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 104.64 -2.356 . . . . 0.0 104.64 170.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 17.5 m -68.02 -52.84 30.9 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -172.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -97.58 125.2 42.17 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.175 173.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 13.0 p -140.9 173.28 11.64 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.681 -171.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -94.68 167.07 11.69 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 171.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.0 -28.84 18.4 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.765 0.711 . . . . 0.0 112.2 177.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -82.05 -39.76 23.01 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.22 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 139.86 -10.75 3.12 Favored Glycine 0 CA--C 1.498 -0.991 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.888 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -60.51 109.23 0.96 Allowed 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 121.193 0.52 . . . . 0.0 110.494 177.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' A' ' 961' ' ' ALA . 9.5 tmtt? -47.52 126.57 10.04 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.581 -1.645 . . . . 0.0 110.698 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.434 ' N ' ' HD3' ' A' ' 960' ' ' LYS . . . -122.74 173.57 7.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.731 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -69.08 160.87 30.21 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.874 0.369 . . . . 0.0 110.337 178.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.95 153.95 41.88 Favored Pre-proline 0 N--CA 1.435 -1.199 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -177.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.549 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.4 Cg_exo -47.18 -33.16 15.18 Favored 'Trans proline' 0 CA--C 1.534 0.519 0 C-N-CA 124.51 3.473 . . . . 0.0 115.866 -178.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.2 p -71.22 -45.0 64.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.879 0.847 . . . . 0.0 110.182 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -64.47 -27.43 68.98 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.42 -1.263 . . . . 0.0 110.285 175.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 81.2 mt -74.36 110.66 8.82 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 122.072 0.939 . . . . 0.0 110.11 176.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.3 p -129.01 165.11 21.79 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.99 -172.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 12.0 p -81.09 128.2 71.69 Favored Pre-proline 0 N--CA 1.441 -0.916 0 CA-C-O 121.239 0.542 . . . . 0.0 110.638 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.654 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 58.8 Cg_endo -82.27 165.73 16.57 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.562 2.174 . . . . 0.0 109.722 175.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -59.23 112.19 1.15 Allowed 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 121.551 1.501 . . . . 0.0 110.112 173.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.478 ' HA3' HG23 ' A' 1034 ' ' THR . . . 114.04 -4.18 23.97 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.83 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.654 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 92.9 m95 -126.18 132.9 51.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 122.225 1.012 . . . . 0.0 111.793 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.669 ' HB2' HE22 ' A' 1033 ' ' GLN . 8.1 tp10 -112.22 129.45 56.26 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 112.797 -2.001 . . . . 0.0 108.162 -175.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.52 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 94.1 m95 -70.85 138.81 50.58 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.644 -1.222 . . . . 0.0 111.129 172.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . 0.606 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 9.8 tp10 -100.88 -47.59 4.74 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.003 -0.999 . . . . 0.0 108.543 -177.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . 0.588 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.8 m-20 -85.88 161.09 19.23 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.155 -177.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -93.17 108.97 20.47 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.377 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . 0.509 ' C ' ' HD3' ' A' 1025 ' ' ARG . . . 55.49 178.05 0.03 OUTLIER 'General case' 0 C--O 1.234 0.254 0 CA-C-O 122.72 1.248 . . . . 0.0 113.491 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.626 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 51.9 m95 -88.09 118.45 27.67 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 113.606 -1.634 . . . . 0.0 108.066 177.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . 0.687 ' O ' ' HA ' ' A' 1023 ' ' LEU . 34.7 m -110.2 -165.05 0.97 Allowed 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 -177.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -112.89 145.41 40.75 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 121.242 1.837 . . . . 0.0 109.432 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.481 ' HB2' HG13 ' A' 1024 ' ' VAL . 55.3 t0 -86.56 120.15 27.57 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -175.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.3 pp -116.24 15.45 7.72 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.349 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -99.12 30.04 3.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 123.036 1.398 . . . . 0.0 108.257 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.507 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 70.3 mtp85 -138.68 174.05 10.94 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.584 -177.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -80.74 79.62 7.35 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 171.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.619 HG12 ' HG2' ' A' ' 994' ' ' GLU . 25.7 m -135.84 161.09 38.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.97 -175.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.34 168.65 0.34 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.633 0.583 . . . . 0.0 110.553 171.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -54.73 -34.66 62.77 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-O 120.903 0.383 . . . . 0.0 111.314 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -101.03 7.36 43.47 Favored 'General case' 0 N--CA 1.427 -1.618 0 C-N-CA 119.004 -1.079 . . . . 0.0 111.469 -178.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 100.87 -20.8 46.36 Favored Glycine 0 C--O 1.224 -0.494 0 CA-C-N 116.122 -0.49 . . . . 0.0 113.803 173.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 83.1 m95 -54.19 121.7 8.72 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.619 ' HG2' HG12 ' A' ' 988' ' ' VAL . 22.6 mt-10 -99.37 153.63 18.83 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.039 177.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.733 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 27.6 t80 -79.01 94.27 5.26 Favored 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 126.783 2.033 . . . . 0.0 111.918 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -110.17 96.53 0.94 Allowed Glycine 0 N--CA 1.435 -1.423 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 177.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.591 HD12 ' HB3' ' A' 1015 ' ' TYR . 1.1 tt -98.42 130.1 47.73 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.194 0 O-C-N 122.139 -0.624 . . . . 0.0 110.197 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 7.1 m -108.12 85.45 2.12 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.989 -178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 16.2 pt -78.68 121.28 83.37 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.21 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 38.8 Cg_endo -69.94 135.67 30.62 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.05 1.833 . . . . 0.0 111.373 178.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.0 Cg_endo -92.63 144.84 11.2 Favored 'Cis proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.23 -1.571 . . . . 0.0 114.331 -0.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 22.7 t0 163.33 155.64 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 112.176 -2.284 . . . . 0.0 105.994 177.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -99.55 -34.92 10.05 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.022 0.439 . . . . 0.0 110.339 -175.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . 0.548 ' H ' ' HD2' ' A' 1004 ' ' LYS . 0.0 OUTLIER -123.55 154.0 66.26 Favored Pre-proline 0 C--N 1.317 -0.829 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.172 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -58.49 127.75 25.83 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.25 2.634 . . . . 0.0 110.291 163.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 20.5 pttm -117.88 13.32 14.02 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.196 0.998 . . . . 0.0 109.608 178.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 29.9 t -143.54 136.1 27.24 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 113.908 -1.496 . . . . 0.0 107.766 -178.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.599 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 62.9 m95 -134.09 140.15 46.42 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 124.478 1.111 . . . . 0.0 108.966 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.522 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 92.8 t -140.51 157.77 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -177.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -83.03 8.76 11.88 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -121.23 134.78 55.2 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 121.278 -0.888 . . . . 0.0 111.603 -175.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.665 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.7 tp10 -69.56 105.1 2.54 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.526 ' H ' ' CE1' ' A' 1016 ' ' HIS . 95.0 mttt -109.26 147.15 33.08 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.743 -1.571 . . . . 0.0 108.47 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 26.5 ptt? -56.27 -36.09 68.19 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -178.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . 0.591 ' HB3' HD12 ' A' ' 997' ' ' ILE . 58.9 m-85 -60.93 -4.27 0.97 Allowed 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.733 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 2.6 m80 -54.67 108.03 0.35 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.63 -25.44 16.77 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 123.585 1.659 . . . . 0.0 106.912 173.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -141.71 150.73 42.22 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 111.865 -2.425 . . . . 0.0 109.466 -177.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.515 ' HB3' ' CD2' ' A' 1016 ' ' HIS . 35.2 ptt180 -151.87 141.77 22.03 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 171.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 1.067 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . 4.9 ptp180 -149.63 161.88 41.31 Favored 'General case' 0 CA--C 1.481 -1.687 0 C-N-CA 118.532 -1.267 . . . . 0.0 109.977 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.639 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.9 ptt180 -148.0 149.39 32.05 Favored 'General case' 0 C--N 1.298 -1.673 0 C-N-CA 119.431 -0.907 . . . . 0.0 110.969 -177.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.768 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 37.2 ttm180 -83.83 115.09 22.08 Favored 'General case' 0 N--CA 1.423 -1.806 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.455 -177.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.687 ' HA ' ' O ' ' A' ' 981' ' ' SER . 72.4 mt -80.44 129.66 34.66 Favored 'General case' 0 N--CA 1.425 -1.718 0 N-CA-C 105.179 -2.156 . . . . 0.0 105.179 166.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.481 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.6 m -111.83 133.63 56.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 CA-C-O 121.733 0.778 . . . . 0.0 112.721 -174.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.557 ' HG3' ' HB2' ' A' ' 977' ' ' ASP . 14.6 ttp180 -150.26 101.66 3.01 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 112.926 -1.943 . . . . 0.0 109.373 166.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.606 ' HE2' ' HG2' ' A' ' 976' ' ' GLU . 0.0 OUTLIER -79.43 154.21 29.11 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 -178.29 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.52 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 7.5 ptm180 -136.4 165.75 25.07 Favored 'General case' 0 CA--C 1.488 -1.432 0 N-CA-C 105.076 -2.194 . . . . 0.0 105.076 -170.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 30.4 ttmt -149.9 142.6 24.6 Favored 'General case' 0 C--N 1.281 -2.403 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 -172.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -91.37 -13.2 32.89 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 123.568 1.651 . . . . 0.0 107.581 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . 0.401 ' H ' ' HG2' ' A' 1028 ' ' LYS . 25.0 t0 52.69 23.35 2.64 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 111.454 -2.612 . . . . 0.0 110.225 -173.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 25.4 tp 66.38 -47.32 0.43 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.224 2.21 . . . . 0.0 113.284 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 14.6 t -79.02 -21.7 46.56 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -171.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.669 HE22 ' HB2' ' A' ' 974' ' ' GLU . 43.2 mt-30 -64.3 -59.36 4.48 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -175.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . 0.478 HG23 ' HA3' ' A' ' 972' ' ' GLY . 0.7 OUTLIER -110.19 80.53 1.32 Allowed 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.758 0.789 . . . . 0.0 110.281 169.395 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -104.59 -34.02 8.33 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.006 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 50.6 m -112.09 146.88 37.2 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.413 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 28.9 m -116.49 152.88 33.17 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.6 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 29.9 m -70.56 109.81 5.06 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -88.9 113.35 24.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.282 0.563 . . . . 0.0 111.116 -177.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 . . . . . 0 C--N 1.316 -0.859 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 177.656 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.531 0 CA-C-O 121.521 0.677 . . . . 0.0 109.825 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.42 139.41 89.39 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.833 -178.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . 0.47 ' HB3' ' HB3' ' A' ' 923' ' ' ALA . 45.6 Cg_exo -40.73 102.74 0.04 OUTLIER 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 124.809 3.673 . . . . 0.0 112.846 178.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -49.06 -60.99 2.31 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 111.72 -2.491 . . . . 0.0 112.576 -174.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 15.4 t -112.34 -24.18 9.93 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.309 -177.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . 0.47 ' HB3' ' HB3' ' A' ' 920' ' ' PRO . . . -69.6 132.86 46.87 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 178.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -87.96 93.05 9.35 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -109.27 -75.66 0.63 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.076 0.465 . . . . 0.0 111.697 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -123.79 47.8 1.0 Allowed Glycine 0 CA--C 1.49 -1.529 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.543 ' HB2' ' OE1' ' A' ' 929' ' ' GLU . 79.7 m-70 -94.02 -28.99 15.45 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.116 -0.542 . . . . 0.0 110.254 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . 0.471 ' HB ' ' HB3' ' A' 1029 ' ' LYS . 4.7 m 64.19 87.89 0.11 Allowed 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -167.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.709 ' HB3' ' HD3' ' A' 1028 ' ' LYS . 0.8 OUTLIER -121.67 168.02 12.26 Favored 'General case' 0 C--N 1.27 -2.863 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.544 ' O ' ' HG2' ' A' 1027 ' ' ARG . 81.6 t80 -149.51 124.74 10.14 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -176.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . . . . . . . . . 70.0 m -78.52 113.83 16.9 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 174.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -92.47 163.3 13.89 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 105.715 -1.958 . . . . 0.0 105.715 -174.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.602 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -164.28 142.31 7.01 Favored 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 120.265 -0.574 . . . . 0.0 109.791 -172.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.427 HG11 HD11 ' A' ' 967' ' ' LEU . 34.1 m -143.29 126.5 13.31 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 175.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.609 ' HA ' ' O ' ' A' 1021 ' ' ARG . 29.9 m-85 -84.18 149.47 26.13 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.67 -0.644 . . . . 0.0 110.164 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.526 ' O ' ' HA ' ' A' 1020 ' ' ARG . 13.3 tt0 -119.91 121.22 38.55 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -109.28 146.34 34.45 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 122.15 0.976 . . . . 0.0 112.666 -174.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.557 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 39.6 mt-10 -138.34 160.56 39.18 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 112.909 -1.95 . . . . 0.0 106.54 170.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 15.4 m -145.39 151.48 38.33 Favored 'General case' 0 C--N 1.311 -1.065 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -176.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.598 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 26.9 ptt180 -146.13 160.7 41.57 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.298 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -75.62 163.55 66.52 Favored Pre-proline 0 C--N 1.315 -0.928 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 169.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -68.5 89.22 0.41 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 CA-C-N 120.357 1.163 . . . . 0.0 109.993 172.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 129.41 -1.05 6.04 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 110.262 -1.135 . . . . 0.0 110.262 -174.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . 0.598 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -100.99 -171.93 28.77 Favored Glycine 0 CA--C 1.502 -0.749 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 177.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -122.5 154.84 37.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 119.204 1.502 . . . . 0.0 107.094 172.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.571 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 24.8 m95 -61.72 135.73 57.72 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.709 0.766 . . . . 0.0 112.302 -173.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 57.2 mttp -135.56 167.27 23.11 Favored Pre-proline 0 C--N 1.307 -1.256 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -49.16 128.42 19.71 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.496 2.13 . . . . 0.0 112.931 -179.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -74.32 -162.31 0.15 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.543 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -89.7 -52.92 4.75 Favored 'General case' 0 CA--C 1.483 -1.603 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -109.17 92.06 3.9 Favored 'General case' 0 N--CA 1.411 -2.382 0 N-CA-C 104.983 -2.229 . . . . 0.0 104.983 -176.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 10.4 m -57.97 -58.06 10.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.672 -172.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . 0.487 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 89.1 m-85 -104.97 136.68 43.98 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 120.062 -0.655 . . . . 0.0 111.37 178.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 3.0 p -149.66 -178.08 6.24 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.039 0.936 . . . . 0.0 112.333 -168.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . 0.494 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 6.5 t70 -108.95 164.94 11.96 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 173.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -54.4 -29.16 48.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 119.379 0.99 . . . . 0.0 111.494 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -82.41 -8.37 59.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 177.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 100.61 -3.7 56.31 Favored Glycine 0 CA--C 1.501 -0.833 0 C-N-CA 119.918 -1.134 . . . . 0.0 112.133 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . 0.494 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 30.6 t70 -59.41 99.15 0.05 Allowed 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 175.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -52.56 129.69 29.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.226 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.11 171.34 8.17 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.666 -176.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -74.53 160.62 30.67 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.1 m -85.67 151.83 56.12 Favored Pre-proline 0 N--CA 1.423 -1.792 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.471 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 2.8 Cg_endo -47.52 -29.89 11.09 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 125.119 3.879 . . . . 0.0 117.729 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 51.1 m -88.23 -35.61 17.21 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 118.98 0.809 . . . . 0.0 109.55 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -65.4 -25.94 67.77 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.009 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.486 HD13 ' CH2' ' A' ' 980' ' ' TRP . 32.9 mt -74.75 122.4 23.22 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.685 0.794 . . . . 0.0 110.351 176.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 24.0 p -124.77 169.53 11.91 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.368 -174.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.569 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 25.6 p -92.7 133.74 28.85 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.26 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.608 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 93.6 Cg_endo -75.79 170.52 20.01 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.328 2.018 . . . . 0.0 110.835 176.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -56.67 -19.93 32.54 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.201 2.601 . . . . 0.0 115.227 -176.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.685 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . -116.07 14.98 16.19 Favored Glycine 0 N--CA 1.439 -1.103 0 C-N-CA 120.474 -0.869 . . . . 0.0 112.708 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.608 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 96.4 m95 -129.13 127.78 42.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 118.014 0.907 . . . . 0.0 110.793 178.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.455 ' HB2' HE21 ' A' 1033 ' ' GLN . 8.9 tp10 -106.4 118.18 35.97 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.616 2.366 . . . . 0.0 108.528 -173.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.648 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 42.8 m95 -69.55 105.12 2.55 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.107 -1.037 . . . . 0.0 111.135 176.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -71.15 -51.09 26.93 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 174.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -74.43 144.84 44.11 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.774 -172.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.63 -36.53 68.04 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -178.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -166.8 150.27 6.84 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.96 0.41 . . . . 0.0 110.806 -174.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.607 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 35.1 m95 -64.68 120.24 12.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . 0.712 ' O ' ' HA ' ' A' 1023 ' ' LEU . 19.9 m -115.6 -172.28 2.12 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -174.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . 0.437 ' CD2' ' HA ' ' A' ' 991' ' ' LYS . 3.7 p90 -109.88 143.78 39.3 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 120.472 1.487 . . . . 0.0 109.695 -177.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.499 ' HB3' ' HD2' ' A' 1022 ' ' ARG . 17.2 t70 -106.16 131.54 53.29 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.365 -171.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.2 pp -109.33 29.63 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.631 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -106.4 30.51 5.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.952 1.358 . . . . 0.0 107.742 -174.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -138.95 -177.1 4.73 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -178.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -86.79 77.68 9.23 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 173.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.506 HG12 ' HB3' ' A' ' 994' ' ' GLU . 30.3 m -137.1 156.67 34.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.529 -172.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -55.02 165.94 0.59 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.792 -1.094 . . . . 0.0 110.995 170.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -52.88 -25.25 11.09 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 123.582 0.753 . . . . 0.0 112.871 176.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . 0.444 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 95.4 mttt -106.77 13.03 28.42 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.812 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.32 -13.23 66.97 Favored Glycine 0 C--O 1.224 -0.473 0 CA-C-N 115.967 -0.56 . . . . 0.0 113.383 175.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.477 ' HE3' ' HG2' ' A' 1019 ' ' ARG . 79.4 m95 -59.31 115.38 3.19 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.506 ' HB3' HG12 ' A' ' 988' ' ' VAL . 4.5 pt-20 -105.41 159.25 16.06 Favored 'General case' 0 C--O 1.257 1.451 0 CA-C-O 121.992 0.901 . . . . 0.0 112.543 176.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.788 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 57.1 t80 -83.08 103.0 12.18 Favored 'General case' 0 C--O 1.209 -1.068 0 C-N-CA 128.019 2.528 . . . . 0.0 113.714 -172.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -127.23 137.99 10.24 Favored Glycine 0 N--CA 1.439 -1.152 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 172.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.49 ' O ' ' HA ' ' A' 1005 ' ' PRO . 0.6 OUTLIER -133.44 149.65 31.41 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 177.13 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 28.8 m -127.82 103.77 7.46 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 121.203 0.525 . . . . 0.0 109.832 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 18.0 pt -95.51 114.18 63.37 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.37 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 33.0 Cg_endo -65.87 138.16 51.98 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 122.518 2.145 . . . . 0.0 112.931 -177.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . 0.41 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 6.6 Cg_endo -89.92 138.53 12.77 Favored 'Cis proline' 0 N--CA 1.45 -1.071 0 C-N-CA 123.143 -1.607 . . . . 0.0 113.883 -1.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 30.9 t0 165.16 151.19 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 111.604 -2.544 . . . . 0.0 104.664 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . 0.403 ' HB2' ' HD2' ' A' 1004 ' ' LYS . 3.5 m-70 -112.22 -35.91 5.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 120.631 1.559 . . . . 0.0 110.588 -175.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . 0.403 ' HD2' ' HB2' ' A' 1003 ' ' HIS . 2.0 mptp? -96.84 142.33 24.38 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-O 120.934 0.397 . . . . 0.0 111.772 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.49 ' HA ' ' O ' ' A' ' 997' ' ' ILE . 77.5 Cg_exo -62.66 123.21 11.94 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 N-CA-C 107.405 -1.806 . . . . 0.0 107.405 162.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 34.3 mttm -75.5 -12.61 60.27 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.199 0.523 . . . . 0.0 111.783 -175.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 39.3 t -150.07 151.74 33.69 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 -165.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.691 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 59.4 m95 -138.41 131.95 30.65 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 125.457 1.723 . . . . 0.0 107.254 174.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.407 HG12 ' N ' ' A' 1010 ' ' ALA . 21.3 t -150.18 170.56 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -171.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . 0.407 ' N ' HG12 ' A' 1009 ' ' VAL . . . -94.37 95.22 8.74 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 176.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -169.26 172.51 7.24 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.905 -175.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.644 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.2 OUTLIER -150.7 97.68 2.52 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 122.69 1.233 . . . . 0.0 109.238 176.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.586 ' HD3' ' CE1' ' A' ' 995' ' ' TYR . 57.7 mtpt -115.87 144.25 44.29 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 112.869 -1.969 . . . . 0.0 110.084 -176.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 55.5 ttp -46.27 -35.11 4.97 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 124.887 1.275 . . . . 0.0 113.875 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -62.34 -13.0 24.27 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.812 0.339 . . . . 0.0 111.178 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.788 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.4 OUTLIER -48.94 106.14 0.1 Allowed 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.0 177.253 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -18.57 13.91 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.15 175.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -139.73 147.17 40.5 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.169 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.477 ' HG2' ' HE3' ' A' ' 993' ' ' TRP . 50.3 ttp180 -147.58 147.63 30.27 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.589 ' HG2' ' CZ3' ' A' 1008 ' ' TRP . 3.6 ptp180 -155.44 167.78 29.26 Favored 'General case' 0 C--O 1.201 -1.471 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.935 176.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.609 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 28.1 ptt180 -149.93 156.31 41.51 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 123.713 0.633 . . . . 0.0 109.753 177.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.602 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 34.5 ttm180 -88.69 128.25 35.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 117.794 0.27 . . . . 0.0 110.612 177.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.712 ' HA ' ' O ' ' A' ' 981' ' ' SER . 87.2 mt -101.67 128.28 48.04 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 106.924 -1.509 . . . . 0.0 106.924 168.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 4.5 m -107.44 139.1 30.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.14 0 CA-C-O 121.543 0.687 . . . . 0.0 111.93 -174.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.514 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.1 tpt180 -135.61 104.41 5.79 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.1 171.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.722 ' HE2' ' HE3' ' A' 1028 ' ' LYS . 0.9 OUTLIER -72.4 136.76 46.15 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 -179.046 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.648 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.4 ptm180 -138.03 144.46 41.05 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -172.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.722 ' HE3' ' HE2' ' A' 1026 ' ' LYS . 30.4 mmtp -108.61 150.3 27.71 Favored 'General case' 0 CA--C 1.468 -2.2 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.822 -175.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 35.1 ttmt -99.26 -16.46 18.5 Favored 'General case' 0 C--N 1.275 -2.656 0 N-CA-C 103.996 -2.594 . . . . 0.0 103.996 161.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . 0.462 ' C ' ' H ' ' A' 1032 ' ' THR . 8.6 t70 49.27 16.1 0.14 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 111.217 -2.72 . . . . 0.0 111.376 -174.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 29.5 tp 55.74 -37.58 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 127.864 2.465 . . . . 0.0 113.247 -172.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . 0.462 ' H ' ' C ' ' A' 1030 ' ' ASP . 9.0 t -74.79 -14.08 60.66 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.405 1.082 . . . . 0.0 112.878 -178.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.685 ' HB3' ' HA2' ' A' ' 972' ' ' GLY . 11.5 mm-40 -59.45 -43.7 93.1 Favored 'General case' 0 N--CA 1.483 1.179 0 CA-C-N 118.999 0.818 . . . . 0.0 109.908 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 30.7 p -84.69 106.0 15.9 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.013 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -137.34 100.01 4.13 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 18.9 m -72.1 102.15 2.94 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.149 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 49.5 m -72.09 160.84 31.79 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.228 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 9.2 t -146.04 140.03 26.51 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -117.3 -50.25 2.56 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.136 0.493 . . . . 0.0 110.108 -178.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 . . . . . 0 N--CA 1.438 -1.074 0 CA-C-O 118.534 -0.746 . . . . 0.0 109.157 -176.915 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . 0.446 HD12 ' N ' ' A' ' 919' ' ' ASP . 2.8 pp . . . . . 0 N--CA 1.477 0.908 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . 0.467 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 28.9 t70 -80.96 127.5 74.42 Favored Pre-proline 0 C--O 1.238 0.477 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 19.0 Cg_exo -65.05 169.85 11.35 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.88 2.387 . . . . 0.0 113.211 -173.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -108.79 -169.54 1.51 Allowed 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.789 -176.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 75.0 m -55.6 120.22 6.89 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.285 0.564 . . . . 0.0 111.84 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -119.67 166.63 12.94 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -102.94 135.3 44.87 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.42 -0.912 . . . . 0.0 112.729 -174.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -132.52 28.37 4.32 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 174.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 100.92 63.35 0.78 Allowed Glycine 0 N--CA 1.439 -1.166 0 CA-C-N 115.064 -0.971 . . . . 0.0 112.23 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -132.31 152.73 51.26 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 174.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.16 124.01 47.01 Favored 'General case' 0 N--CA 1.415 -2.223 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 163.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.485 ' HB2' ' HE3' ' A' 1026 ' ' LYS . 0.1 OUTLIER -141.67 133.0 26.56 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 171.194 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.425 ' O ' ' HG2' ' A' 1027 ' ' ARG . 73.2 t80 -128.36 135.65 49.85 Favored 'General case' 0 C--N 1.295 -1.771 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 -176.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.594 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 34.0 m -77.5 124.45 27.92 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -105.06 159.4 15.86 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 105.153 -2.166 . . . . 0.0 105.153 -173.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.781 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 11.9 pt-20 -151.1 152.55 33.55 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.105 -175.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.619 ' O ' ' HA ' ' A' 1022 ' ' ARG . 8.6 p -137.03 178.63 4.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 N-CA-C 106.438 -1.689 . . . . 0.0 106.438 176.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.54 ' HA ' ' O ' ' A' 1021 ' ' ARG . 49.8 m-85 -142.79 113.11 7.23 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 118.755 0.707 . . . . 0.0 110.761 -174.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.567 ' O ' ' HA ' ' A' 1020 ' ' ARG . 31.3 tt0 -79.3 127.42 32.04 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.944 0.778 . . . . 0.0 110.046 173.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . 0.451 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 33.5 m-80 -118.53 152.41 36.02 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.632 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 43.5 mt-10 -140.86 162.11 36.21 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 171.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 24.7 p -137.62 142.37 41.23 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.54 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 15.0 ptt180 -151.63 160.05 43.8 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 123.779 0.832 . . . . 0.0 108.92 -178.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -66.29 161.23 59.33 Favored Pre-proline 0 C--N 1.311 -1.087 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 171.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.64 97.76 0.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 121.554 1.503 . . . . 0.0 111.396 175.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 89.27 62.56 1.34 Allowed Glycine 0 N--CA 1.441 -0.983 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 -178.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -156.25 -159.65 9.54 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 121.096 -0.573 . . . . 0.0 111.929 -175.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -103.24 133.08 48.92 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 123.989 0.464 . . . . 0.0 110.263 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.632 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 42.2 m95 -80.78 147.41 30.5 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-O 121.3 0.571 . . . . 0.0 109.876 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -127.56 151.29 74.91 Favored Pre-proline 0 C--N 1.296 -1.758 0 N-CA-C 103.018 -2.956 . . . . 0.0 103.018 170.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -49.35 140.15 27.3 Favored 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 122.426 2.084 . . . . 0.0 111.66 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.64 -178.17 0.38 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.435 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -89.73 -40.11 12.72 Favored 'General case' 0 CA--C 1.473 -1.995 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -120.18 88.15 2.88 Favored 'General case' 0 N--CA 1.399 -3.023 0 N-CA-C 105.444 -2.058 . . . . 0.0 105.444 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 31.8 m -64.64 -57.79 8.09 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.715 -1.13 . . . . 0.0 112.384 -170.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -92.77 129.27 38.74 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.725 0.774 . . . . 0.0 111.436 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . 0.572 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 12.9 p -149.61 178.44 8.84 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.133 -169.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -99.27 172.99 7.0 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 105.567 -2.012 . . . . 0.0 105.567 173.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -53.07 -31.55 42.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.931 0.787 . . . . 0.0 111.437 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . 0.416 HD21 ' HB2' ' A' ' 959' ' ' ASP . 5.3 p30 -84.16 -7.78 59.27 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.588 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . 0.572 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 74.76 56.52 4.9 Favored Glycine 0 CA--C 1.49 -1.525 0 C-N-CA 120.194 -1.003 . . . . 0.0 111.27 -174.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . 0.416 ' HB2' HD21 ' A' ' 957' ' ' ASN . 11.3 t70 -105.17 109.66 21.73 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.499 -3.149 . . . . 0.0 102.499 174.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -46.58 115.95 1.18 Allowed 'General case' 0 C--N 1.319 -0.748 0 O-C-N 124.481 1.113 . . . . 0.0 111.164 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -122.42 -177.26 3.57 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.858 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . 0.617 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -80.52 161.62 24.74 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 176.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.0 m -80.69 159.94 68.01 Favored Pre-proline 0 C--N 1.314 -0.95 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.699 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 41.7 Cg_exo -46.38 -33.8 13.16 Favored 'Trans proline' 0 N--CA 1.478 0.56 0 C-N-CA 123.674 2.916 . . . . 0.0 115.047 -178.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 2.5 p -72.57 -47.51 47.49 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.507 0.67 . . . . 0.0 110.086 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . 0.617 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 40.0 mt-10 -64.84 -32.86 74.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.112 -1.403 . . . . 0.0 110.488 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.509 HD13 ' CH2' ' A' ' 980' ' ' TRP . 14.5 mt -60.9 110.41 1.33 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.923 0.868 . . . . 0.0 111.175 178.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 18.7 p -104.64 164.35 11.82 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.282 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 14.2 p -97.98 136.04 21.22 Favored Pre-proline 0 N--CA 1.442 -0.835 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.421 175.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.604 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 77.8 Cg_endo -71.76 175.57 9.44 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 123.683 2.922 . . . . 0.0 110.492 177.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.53 -46.59 30.76 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.643 2.228 . . . . 0.0 114.011 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.613 ' HA2' ' HB ' ' A' 1034 ' ' THR . . . -72.11 -51.96 12.58 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.732 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.604 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 96.6 m95 -72.01 144.31 48.86 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -177.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.533 ' HB3' ' O ' ' A' 1028 ' ' LYS . 2.6 tp10 -133.47 156.51 47.6 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 113.297 -1.774 . . . . 0.0 106.455 -177.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.493 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 82.6 m95 -89.56 152.11 21.59 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.616 -0.678 . . . . 0.0 110.703 172.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -131.1 -33.78 1.5 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.54 0.686 . . . . 0.0 109.396 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . 0.454 ' HB3' ' HD2' ' A' 1025 ' ' ARG . 8.2 t0 -71.44 151.49 43.95 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.83 -47.49 74.84 Favored 'General case' 0 C--N 1.318 -0.788 0 O-C-N 123.527 0.517 . . . . 0.0 111.253 -176.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -164.72 171.97 13.64 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -174.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.699 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 31.6 m95 -84.86 87.13 7.31 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.884 0.849 . . . . 0.0 109.14 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 3.2 m -93.45 145.43 24.5 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.715 -1.129 . . . . 0.0 108.575 -176.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . 0.463 ' HA ' ' O ' ' A' 1022 ' ' ARG . 3.5 p90 -73.39 136.03 44.31 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 121.919 0.866 . . . . 0.0 110.722 -176.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.577 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 4.4 t70 -82.92 141.02 32.49 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 113.668 -1.606 . . . . 0.0 111.746 -172.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.5 pp -132.29 5.63 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.442 176.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . 0.571 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 17.1 m120 -92.31 18.91 7.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.042 0.449 . . . . 0.0 111.845 -175.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.577 ' HD3' ' OD2' ' A' ' 983' ' ' ASP . 8.2 mpt_? -143.87 -178.27 5.84 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 106.344 -1.725 . . . . 0.0 106.344 -178.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.15 83.73 2.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 118.71 0.687 . . . . 0.0 112.008 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.411 HG12 ' HG2' ' A' ' 994' ' ' GLU . 15.8 m -143.65 157.63 16.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 C-N-CA 124.666 1.186 . . . . 0.0 107.966 178.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -55.22 173.01 0.11 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.599 0.36 . . . . 0.0 110.765 175.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.59 -31.4 72.61 Favored 'General case' 0 CA--C 1.492 -1.265 0 O-C-N 121.282 -0.886 . . . . 0.0 110.422 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . 0.441 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 24.4 mtmm -92.6 0.3 57.41 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.038 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.7 -21.16 41.58 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 112.257 -0.337 . . . . 0.0 112.257 175.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.441 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 81.6 m95 -50.6 124.96 11.89 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.411 ' HG2' HG12 ' A' ' 988' ' ' VAL . 23.7 mt-10 -99.1 157.63 16.22 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.871 -1.059 . . . . 0.0 109.287 176.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.718 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 86.5 t80 -82.63 86.38 6.84 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 113.366 -1.743 . . . . 0.0 109.096 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . 0.472 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -109.66 84.04 0.35 Allowed Glycine 0 CA--C 1.49 -1.484 0 C-N-CA 120.137 -1.03 . . . . 0.0 111.369 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.47 HD11 HD11 ' A' ' 999' ' ' ILE . 0.4 OUTLIER -92.16 131.92 37.93 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 CA-C-O 121.696 0.76 . . . . 0.0 110.722 -176.37 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . 0.443 ' OG1' ' HG3' ' A' 1005 ' ' PRO . 4.0 m -132.07 121.88 24.54 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.47 HD11 HD11 ' A' ' 997' ' ' ILE . 59.3 mt -115.24 98.25 50.08 Favored Pre-proline 0 C--N 1.316 -0.859 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -175.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 26.3 Cg_endo -62.27 132.23 37.82 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.403 2.069 . . . . 0.0 113.405 -176.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . 0.46 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 1.2 Cg_endo -79.46 143.92 70.26 Favored 'Cis proline' 0 CA--C 1.51 -0.698 0 C-N-CA 123.117 -1.618 . . . . 0.0 112.293 -1.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 5.8 t0 -147.2 -174.8 4.61 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 113.764 -1.562 . . . . 0.0 107.883 -173.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -116.16 -61.77 1.68 Allowed 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -160.52 157.85 24.5 Favored Pre-proline 0 C--N 1.315 -0.901 0 N-CA-C 101.907 -3.368 . . . . 0.0 101.907 -177.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.443 ' HG3' ' OG1' ' A' ' 998' ' ' THR . 53.7 Cg_exo -59.12 121.11 9.39 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 CA-C-N 122.172 1.811 . . . . 0.0 109.864 174.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 60.6 mttt -66.04 -29.02 69.3 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -177.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.0 t -145.29 140.65 27.94 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 114.438 -1.256 . . . . 0.0 109.286 -165.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.546 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 63.8 m95 -126.12 138.66 53.7 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 125.213 1.57 . . . . 0.0 107.322 176.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.711 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 34.5 t -139.87 166.83 20.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 -176.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . 0.44 ' H ' HG12 ' A' 1009 ' ' VAL . . . -92.98 24.41 3.71 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -171.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -135.85 137.28 41.33 Favored 'General case' 0 C--N 1.315 -0.917 0 O-C-N 121.39 -0.819 . . . . 0.0 111.06 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.613 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.3 OUTLIER -92.57 132.41 36.87 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 175.851 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 96.2 mttt -152.53 176.83 11.28 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 -171.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.56 6.39 17.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.67 0.747 . . . . 0.0 111.008 -178.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -90.99 7.92 37.92 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 122.481 1.134 . . . . 0.0 108.243 175.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.718 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 20.7 m80 -88.12 172.29 9.62 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 114.168 -1.378 . . . . 0.0 111.812 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -158.0 -35.77 0.07 Allowed 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 112.3 -2.227 . . . . 0.0 106.266 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . 0.472 ' HB2' ' O ' ' A' ' 996' ' ' GLY . 35.1 m170 -132.08 151.65 51.65 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 170.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.409 ' HB3' ' HD2' ' A' 1016 ' ' HIS . 34.4 ptt180 -149.05 148.44 29.72 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 173.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.567 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.7 ptp180 -151.34 152.18 32.79 Favored 'General case' 0 CA--C 1.482 -1.657 0 C-N-CA 117.672 -1.611 . . . . 0.0 110.804 176.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.54 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 25.0 ptt180 -128.08 142.83 51.09 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.624 -177.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.781 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 32.8 ttm180 -78.43 123.32 26.9 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 114.243 -1.344 . . . . 0.0 110.27 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . . . . . . . . . 17.5 mt -103.88 129.85 51.42 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 103.978 -2.601 . . . . 0.0 103.978 168.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.445 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 17.0 m -105.87 133.68 49.56 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 O-C-N 123.63 0.582 . . . . 0.0 111.316 -172.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.454 ' HD2' ' HB3' ' A' ' 977' ' ' ASP . 13.4 tpt180 -135.52 103.98 5.66 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 172.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.6 OUTLIER -70.39 138.36 51.24 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.843 -1.54 . . . . 0.0 106.843 177.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.493 HH21 ' HD2' ' A' ' 970' ' ' PRO . 15.0 ptm180 -131.21 143.36 50.53 Favored 'General case' 0 CA--C 1.488 -1.439 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 -173.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.533 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 28.7 ttmt -132.77 134.35 44.6 Favored 'General case' 0 C--N 1.281 -2.371 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -175.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.583 ' C ' ' H ' ' A' 1031 ' ' LEU . 36.3 ttmt -84.17 -22.19 31.06 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 122.795 1.284 . . . . 0.0 107.815 -177.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 34.3 t70 65.6 -33.53 0.17 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 127.928 2.491 . . . . 0.0 112.566 -173.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' 1029 ' ' LYS . 21.9 tp 87.55 9.92 0.15 Allowed 'General case' 0 C--N 1.309 -1.16 0 C-N-CA 128.698 2.799 . . . . 0.0 109.718 174.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 4.4 m -112.69 -8.93 13.76 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -87.03 -37.12 17.77 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 113.534 -1.666 . . . . 0.0 109.654 -174.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . 0.613 ' HB ' ' HA2' ' A' ' 972' ' ' GLY . 13.7 t -96.41 131.26 43.16 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 175.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -88.23 104.19 16.49 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 22.9 p -78.89 -18.29 54.15 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.37 0.605 . . . . 0.0 110.631 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 70.9 m -98.45 97.84 9.12 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.838 175.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 25.6 p -100.9 127.89 47.18 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.087 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -130.01 -28.67 2.15 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.43 -175.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 . . . . . 0 N--CA 1.445 -0.693 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -177.565 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.471 0.605 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -112.94 149.93 42.06 Favored Pre-proline 0 C--N 1.314 -0.948 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -62.72 -28.63 76.57 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.738 2.959 . . . . 0.0 113.152 177.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -56.66 -41.37 77.12 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 123.641 0.776 . . . . 0.0 112.175 -175.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 7.5 t -107.02 153.51 22.48 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -92.62 85.24 5.21 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -111.65 -55.21 2.53 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.583 -173.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . 68.76 -70.82 0.13 Allowed 'General case' 0 C--N 1.327 -0.383 0 O-C-N 124.197 0.935 . . . . 0.0 111.803 -176.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -157.13 57.49 0.37 Allowed Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.47 -177.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.473 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 25.2 m-70 -138.24 174.34 10.66 Favored 'General case' 0 CA--C 1.503 -0.864 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 174.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.65 122.03 45.21 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 160.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.755 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.0 OUTLIER -108.66 175.45 5.46 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.197 175.1 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.742 ' O ' ' HG2' ' A' 1027 ' ' ARG . 85.3 t80 -159.82 119.49 2.91 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 176.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.43 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 27.9 m -73.14 123.26 23.26 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 171.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . 0.69 ' HB2' ' HD2' ' A' 1027 ' ' ARG . 8.5 t70 -100.33 155.86 17.56 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -155.51 147.96 23.91 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.507 -171.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.537 HG22 ' H ' ' A' ' 935' ' ' TYR . 8.1 p -144.48 -179.53 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 N-CA-C 105.589 -2.004 . . . . 0.0 105.589 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.551 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 67.8 m-85 -136.69 150.81 48.67 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -178.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.572 ' O ' ' HA ' ' A' 1020 ' ' ARG . 7.3 tt0 -122.93 122.36 38.39 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . 0.52 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 29.4 m-80 -113.11 142.57 45.6 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 122.32 1.057 . . . . 0.0 112.833 -173.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.618 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 35.7 mt-10 -135.63 161.93 34.15 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 112.672 -2.058 . . . . 0.0 105.664 171.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . 0.476 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 34.9 p -149.56 158.97 44.66 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 118.65 0.659 . . . . 0.0 112.404 -175.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' 1017 ' ' THR . 37.5 ptt180 -156.77 159.52 38.37 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.731 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -75.94 165.26 54.59 Favored Pre-proline 0 C--N 1.311 -1.095 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 168.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -62.68 84.61 0.11 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 121.424 1.416 . . . . 0.0 110.643 171.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 132.49 -2.2 4.93 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -175.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . 0.512 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -96.42 -172.33 35.11 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 108.048 -2.021 . . . . 0.0 108.048 177.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -127.57 161.58 28.48 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 120.112 1.956 . . . . 0.0 105.803 170.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.658 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 54.6 m95 -64.07 134.8 55.62 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 122.282 1.039 . . . . 0.0 113.463 -169.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -136.27 175.62 3.41 Favored Pre-proline 0 C--N 1.309 -1.171 0 N-CA-C 104.391 -2.448 . . . . 0.0 104.391 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.86 126.92 24.14 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.707 1.605 . . . . 0.0 111.814 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . 0.476 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -80.84 15.01 1.92 Allowed 'General case' 0 C--O 1.239 0.532 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -178.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 78.37 -62.19 0.35 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 125.293 1.437 . . . . 0.0 108.623 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.83 83.77 2.79 Favored 'General case' 0 N--CA 1.417 -2.098 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.3 m -72.26 -58.72 3.18 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.694 -171.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . 0.551 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 88.3 m-85 -97.88 123.93 42.07 Favored 'General case' 0 C--N 1.309 -1.196 0 C-N-CA 119.053 -1.059 . . . . 0.0 110.095 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . 0.435 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 76.5 p -136.35 171.41 14.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.359 -170.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -95.75 176.93 5.95 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 105.685 -1.969 . . . . 0.0 105.685 175.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.64 -24.42 5.54 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 178.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . 0.712 HD21 ' HB2' ' A' ' 959' ' ' ASP . 4.1 p-10 -96.66 -4.03 41.64 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.655 -0.653 . . . . 0.0 111.35 178.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . 0.435 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 93.53 -1.49 69.21 Favored Glycine 0 CA--C 1.499 -0.96 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.165 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . 0.712 ' HB2' HD21 ' A' ' 957' ' ' ASN . 7.0 t70 -57.55 104.73 0.19 Allowed 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -51.94 133.62 32.28 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.876 0.846 . . . . 0.0 110.908 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -128.63 -173.94 3.1 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.767 -1.106 . . . . 0.0 108.991 -176.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . 0.47 ' HB1' ' HB3' ' A' ' 966' ' ' GLU . . . -75.99 157.81 32.64 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 176.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.5 m -77.52 156.96 80.65 Favored Pre-proline 0 N--CA 1.441 -0.92 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.653 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 52.4 Cg_exo -51.31 -20.12 7.68 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.457 2.772 . . . . 0.0 114.614 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.3 p -70.81 -57.8 4.27 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . 0.47 ' HB3' ' HB1' ' A' ' 962' ' ' ALA . 35.2 tt0 -69.09 -27.83 65.96 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.229 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 964' ' ' PRO . 31.6 mt -59.81 110.75 1.23 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 24.3 p -116.34 177.54 4.65 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.688 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.534 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 9.0 p -101.64 143.19 26.1 Favored Pre-proline 0 C--N 1.307 -1.28 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.676 178.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.607 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 97.4 Cg_endo -74.56 -179.37 4.77 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.029 2.486 . . . . 0.0 109.418 172.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.35 -51.78 9.75 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.922 1.748 . . . . 0.0 114.457 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.535 ' HA2' ' HB ' ' A' 1034 ' ' THR . . . -74.31 -46.24 21.47 Favored Glycine 0 N--CA 1.442 -0.961 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.992 -177.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.607 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 99.2 m95 -69.23 130.43 42.62 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.955 ' HB2' HE21 ' A' 1033 ' ' GLN . 6.5 tp10 -118.66 143.42 46.84 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 126.499 1.92 . . . . 0.0 109.748 -173.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 75.9 m95 -88.55 152.64 21.72 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.551 0.691 . . . . 0.0 111.446 173.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -137.86 -36.61 0.61 Allowed 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.673 177.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . 0.684 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.4 m-20 -77.62 149.66 34.73 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -174.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -54.81 -51.58 65.37 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 124.782 1.301 . . . . 0.0 113.186 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -168.77 167.76 10.95 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-O 120.877 0.37 . . . . 0.0 110.321 -175.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.653 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 33.5 m95 -74.72 114.71 13.47 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 177.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 2.6 p -123.95 149.23 46.18 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -172.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . 0.596 ' HA ' ' O ' ' A' 1022 ' ' ARG . 1.0 OUTLIER -74.21 129.54 38.01 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.577 0.703 . . . . 0.0 111.28 -172.797 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -87.75 135.26 33.45 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.806 -170.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 26.3 pt -115.68 24.79 4.62 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.985 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . 0.622 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 25.3 t-20 -101.44 15.64 28.18 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.783 0.802 . . . . 0.0 110.369 -175.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.622 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 8.7 mpt_? -138.24 -176.74 4.55 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 -174.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -78.01 75.63 4.54 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.953 0.883 . . . . 0.0 109.443 176.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 27.6 m -141.53 152.21 19.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.111 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -55.32 169.37 0.28 Allowed 'General case' 0 C--N 1.323 -0.567 0 O-C-N 123.89 0.744 . . . . 0.0 111.113 173.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -52.58 -32.24 40.17 Favored 'General case' 0 CA--C 1.493 -1.25 0 CA-C-O 121.65 0.738 . . . . 0.0 111.751 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . 0.444 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 70.9 mmtt -104.2 15.17 28.95 Favored 'General case' 0 N--CA 1.417 -2.085 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.95 -176.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 89.48 -15.81 57.76 Favored Glycine 0 C--O 1.226 -0.399 0 CA-C-N 115.587 -0.733 . . . . 0.0 113.028 174.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.683 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 82.0 m95 -58.78 109.53 0.83 Allowed 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -177.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.91 160.27 14.51 Favored 'General case' 0 C--O 1.254 1.301 0 C-N-CA 123.756 0.823 . . . . 0.0 110.952 173.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.663 ' HE1' ' HB ' ' A' ' 997' ' ' ILE . 0.3 OUTLIER -75.7 102.77 5.51 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 125.435 1.494 . . . . 0.0 112.09 -172.454 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . 0.44 ' HA2' ' HB3' ' A' 1005 ' ' PRO . . . -107.72 88.8 0.55 Allowed Glycine 0 CA--C 1.492 -1.405 0 C-N-CA 119.051 -1.547 . . . . 0.0 112.261 173.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.663 ' HB ' ' HE1' ' A' ' 995' ' ' TYR . 2.5 tt -97.24 127.64 49.28 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.082 0 O-C-N 121.341 -1.093 . . . . 0.0 110.198 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 20.7 m -118.42 82.9 1.92 Allowed 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 23.3 pt -104.4 130.81 22.63 Favored Pre-proline 0 C--N 1.316 -0.88 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.291 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 36.5 Cg_endo -64.54 145.29 87.15 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.703 2.269 . . . . 0.0 112.754 -178.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . 0.434 ' O ' ' HB2' ' A' 1002 ' ' ASP . 7.9 Cg_endo -91.26 135.55 9.03 Favored 'Cis proline' 0 N--CA 1.446 -1.323 0 C-N-CA 123.024 -1.657 . . . . 0.0 112.844 -2.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' 1001 ' ' PRO . 3.7 t70 158.69 170.37 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 111.523 -2.581 . . . . 0.0 105.822 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -149.81 33.97 0.68 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 118.646 0.657 . . . . 0.0 109.943 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 90.1 mttt -159.92 127.96 2.85 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.671 -176.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.711 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 32.8 Cg_exo -68.56 124.26 11.39 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 121.521 1.481 . . . . 0.0 109.984 172.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 45.8 pttt -123.35 8.16 9.06 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -174.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.3 t -138.83 116.48 11.4 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.711 ' CZ2' ' HB2' ' A' 1005 ' ' PRO . 62.0 m95 -121.96 134.49 54.83 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.939 -171.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 15.4 m -156.29 178.08 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 -175.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -94.98 104.64 16.52 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 175.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -169.71 176.38 4.91 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.255 0.347 . . . . 0.0 110.34 -176.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.62 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 10.2 tp10 -163.13 104.4 0.99 Allowed 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 122.221 1.01 . . . . 0.0 108.608 176.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' A' 1016 ' ' HIS . 73.0 mttt -135.62 157.45 46.85 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 113.667 -1.606 . . . . 0.0 109.263 -176.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 49.0 ttp -48.26 -41.64 28.31 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 125.137 1.375 . . . . 0.0 114.339 -177.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -59.23 -16.16 19.39 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.658 ' HB3' ' CH2' ' A' ' 946' ' ' TRP . 7.6 m80 -53.53 100.01 0.03 OUTLIER 'General case' 0 CA--C 1.511 -0.542 0 O-C-N 123.635 0.585 . . . . 0.0 111.345 172.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . 0.528 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.0 OUTLIER -96.88 -22.72 16.72 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 122.845 1.307 . . . . 0.0 108.178 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 14.3 m170 -139.68 157.89 45.03 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 113.437 -1.711 . . . . 0.0 108.237 -178.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.683 ' HG2' ' CE3' ' A' ' 993' ' ' TRP . 44.8 ttp180 -157.82 148.44 20.85 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 5.4 ptp180 -152.1 166.34 31.96 Favored 'General case' 0 CA--C 1.487 -1.478 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.643 178.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.502 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 33.6 ptt180 -145.45 150.02 35.76 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.747 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.596 ' O ' ' HA ' ' A' ' 982' ' ' TYR . 41.4 ttm180 -87.22 120.91 28.99 Favored 'General case' 0 N--CA 1.437 -1.112 0 O-C-N 123.212 0.32 . . . . 0.0 110.758 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.568 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 86.1 mt -97.61 124.38 41.88 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 170.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.557 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 16.4 m -109.45 141.88 23.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 CA-C-O 121.823 0.82 . . . . 0.0 111.512 -175.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.543 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.4 tpt180 -134.45 104.78 6.25 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 113.662 -1.608 . . . . 0.0 107.936 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.684 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -75.19 146.62 41.09 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -178.35 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.742 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 13.1 ptm180 -147.35 171.37 15.55 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -170.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.755 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 15.5 ptpt -158.58 152.4 23.5 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 178.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.56 ' C ' ' H ' ' A' 1031 ' ' LEU . 38.1 ttmt -84.23 -10.72 57.45 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 122.812 1.291 . . . . 0.0 107.682 -176.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . 0.478 ' HB3' ' HB2' ' A' 1033 ' ' GLN . 32.0 t70 72.23 -20.47 0.25 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 112.011 -2.359 . . . . 0.0 112.717 178.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . 0.56 ' H ' ' C ' ' A' 1029 ' ' LYS . 19.7 tp 78.17 -12.86 1.02 Allowed 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 127.78 2.432 . . . . 0.0 112.202 177.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 6.7 t -135.36 9.58 3.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 122.167 0.984 . . . . 0.0 108.822 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.955 HE21 ' HB2' ' A' ' 974' ' ' GLU . 3.1 tp-100 -69.22 -61.97 1.57 Allowed 'General case' 0 N--CA 1.438 -1.067 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 174.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . 0.535 ' HB ' ' HA2' ' A' ' 972' ' ' GLY . 6.5 t -84.62 75.9 10.25 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-O 122.885 1.326 . . . . 0.0 108.071 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -83.04 -19.83 36.16 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.704 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 58.8 m -79.33 117.25 20.15 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 175.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 40.4 m -92.36 130.58 38.01 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 14.6 t -77.88 -17.28 57.51 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 121.063 0.458 . . . . 0.0 110.44 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -108.53 174.88 5.68 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 21.8 ttt180 . . . . . 0 C--N 1.318 -0.775 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -179.393 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 3.3 mp . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 69.63 131.74 0.04 OUTLIER Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 124.016 0.926 . . . . 0.0 111.396 -178.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -65.12 -22.09 62.06 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.149 1.899 . . . . 0.0 111.06 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -65.03 -32.54 74.31 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.192 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 32.6 m -89.32 78.95 7.14 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 176.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -85.26 -19.37 31.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.052 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . 0.471 ' HA ' ' CD2' ' A' ' 927' ' ' HIS . 28.7 t70 -115.99 118.52 33.16 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.434 -178.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -113.36 12.66 18.86 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.001 175.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 120.86 52.89 0.24 Allowed Glycine 0 N--CA 1.442 -0.932 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.256 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.471 ' CD2' ' HA ' ' A' ' 924' ' ' ASP . 9.6 m-70 -105.86 -152.31 0.47 Allowed 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 173.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.5 m -166.18 115.54 0.95 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 101.404 -3.554 . . . . 0.0 101.404 169.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.531 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 1.4 pm0 -142.92 136.04 28.2 Favored 'General case' 0 C--N 1.286 -2.193 0 CA-C-N 119.684 1.129 . . . . 0.0 109.005 177.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.459 ' O ' ' HG2' ' A' 1027 ' ' ARG . 79.2 t80 -137.64 137.75 38.76 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -177.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.639 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 17.1 m -76.3 133.65 39.97 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.345 0.117 . . . . 0.0 110.995 178.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -111.08 163.82 13.47 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.541 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 10.6 pt-20 -151.24 150.74 30.94 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -173.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' 1022 ' ' ARG . 7.1 p -138.82 175.39 8.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 N-CA-C 106.191 -1.781 . . . . 0.0 106.191 175.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.7 ' HA ' ' O ' ' A' 1021 ' ' ARG . 68.2 m-85 -139.43 146.47 40.14 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -175.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.73 ' O ' ' HA ' ' A' 1020 ' ' ARG . 30.0 tt0 -121.59 120.33 34.5 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -174.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . 0.525 ' HA ' ' O ' ' A' 1019 ' ' ARG . 26.2 m-80 -109.14 140.43 42.74 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.361 1.077 . . . . 0.0 112.891 -172.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.581 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 66.1 mt-10 -133.83 158.68 42.78 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 104.345 -2.465 . . . . 0.0 104.345 170.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 17.4 m -142.56 151.8 41.94 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 119.017 0.826 . . . . 0.0 111.48 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.662 ' O ' ' HA ' ' A' 1017 ' ' THR . 32.1 ptt180 -148.98 159.52 44.14 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.568 178.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -79.68 164.46 53.37 Favored Pre-proline 0 C--N 1.302 -1.499 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 171.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -64.04 91.44 0.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 121.123 1.215 . . . . 0.0 109.909 172.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 123.95 0.53 9.0 Favored Glycine 0 N--CA 1.44 -1.065 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 -175.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . 0.566 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -101.26 -175.08 28.82 Favored Glycine 0 CA--C 1.505 -0.586 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 178.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -119.37 166.7 12.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.977 1.889 . . . . 0.0 105.989 169.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.581 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 40.8 m95 -71.72 138.73 48.72 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-O 122.146 0.974 . . . . 0.0 112.408 -171.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -129.16 174.32 4.69 Favored Pre-proline 0 C--N 1.307 -1.251 0 N-CA-C 103.736 -2.691 . . . . 0.0 103.736 175.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -56.74 133.29 57.06 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 CA-C-N 121.364 1.523 . . . . 0.0 111.335 174.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.86 -170.88 0.12 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.681 0.753 . . . . 0.0 112.456 177.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.51 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.0 OUTLIER -91.51 -36.82 13.51 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -178.012 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -120.43 105.65 11.07 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 104.912 -2.255 . . . . 0.0 104.912 169.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.1 m -66.62 -64.3 0.88 Allowed 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.101 -176.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . 0.628 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 73.4 m-85 -93.02 135.56 34.08 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 118.834 -1.146 . . . . 0.0 110.446 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . 0.436 ' HA ' ' H ' ' A' ' 961' ' ' ALA . 77.0 p -147.2 -177.27 5.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -174.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -103.29 -178.05 3.55 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 170.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.59 -26.08 12.44 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 176.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -87.52 -51.33 5.97 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 121.907 -0.496 . . . . 0.0 110.869 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 146.05 -7.63 1.43 Allowed Glycine 0 CA--C 1.493 -1.344 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.741 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.96 108.64 1.25 Allowed 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 175.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 961' ' ' ALA . 50.7 tttm -47.19 119.94 2.88 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.598 1.186 . . . . 0.0 110.526 178.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.479 ' O ' ' HG2' ' A' ' 960' ' ' LYS . . . -90.2 175.4 7.15 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . 0.529 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -72.44 -52.82 14.2 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.148 -1.021 . . . . 0.0 112.683 -175.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 57.1 p 138.48 156.53 0.0 OUTLIER Pre-proline 0 C--N 1.309 -1.191 0 C-N-CA 126.913 2.085 . . . . 0.0 109.919 -171.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.482 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 4.8 Cg_endo -58.92 -26.34 80.68 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 121.879 1.719 . . . . 0.0 112.291 172.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 50.7 m -74.19 -53.31 10.1 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 175.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . 0.529 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 33.3 mt-10 -75.42 5.26 6.0 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.437 ' HA ' HD13 ' A' ' 967' ' ' LEU . 0.4 OUTLIER -96.79 111.94 23.9 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 172.205 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 18.7 p -110.74 174.31 5.92 Favored 'General case' 0 C--N 1.296 -1.761 0 CA-C-O 121.221 0.534 . . . . 0.0 111.491 -174.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.421 ' HA ' ' NH2' ' A' 1027 ' ' ARG . 16.1 p -108.73 128.85 24.77 Favored Pre-proline 0 N--CA 1.436 -1.152 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 173.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.647 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 73.5 Cg_endo -73.49 166.02 30.93 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.995 2.464 . . . . 0.0 110.337 177.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -49.64 -30.75 22.91 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.111 2.54 . . . . 0.0 114.13 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.689 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -107.31 23.17 27.54 Favored Glycine 0 N--CA 1.437 -1.235 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.577 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.647 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 75.7 m95 -135.74 132.84 37.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 117.629 0.714 . . . . 0.0 110.335 172.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.617 ' HB3' ' O ' ' A' 1028 ' ' LYS . 3.9 tp10 -111.54 142.15 44.2 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.547 ' CE3' ' HG2' ' A' 1025 ' ' ARG . 75.7 m95 -76.3 138.56 40.6 Favored 'General case' 0 C--N 1.298 -1.663 0 C-N-CA 118.014 -1.474 . . . . 0.0 111.106 170.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . 0.46 ' CG ' ' HB3' ' A' 1026 ' ' LYS . 4.2 pt-20 -108.92 -34.66 6.57 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . 0.425 ' HB3' ' HG3' ' A' 1025 ' ' ARG . 5.5 t0 -87.16 159.39 18.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 175.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -89.58 -31.99 17.33 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.647 -172.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -157.14 170.28 22.86 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 -174.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.555 ' HA ' ' O ' ' A' 1024 ' ' VAL . 23.6 m95 -94.73 110.07 21.96 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 175.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 50.0 m -124.57 158.94 31.8 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -178.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . 0.459 ' HA ' ' O ' ' A' 1022 ' ' ARG . 6.6 p90 -74.65 144.82 43.65 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -167.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -95.53 120.95 36.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.217 -176.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.45 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.6 pp -105.62 9.4 9.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.907 -177.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -94.46 39.68 1.09 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.793 1.282 . . . . 0.0 107.921 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.419 HH21 ' CD ' ' A' ' 994' ' ' GLU . 57.6 mtp85 -145.47 176.88 9.26 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -175.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -77.86 85.5 4.12 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 174.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.45 HG21 ' HA ' ' A' ' 984' ' ' ILE . 20.5 m -127.08 -173.34 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.933 -178.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -96.7 -174.15 2.93 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -66.22 -34.01 77.06 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.42 0.628 . . . . 0.0 109.404 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -91.31 6.12 46.55 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.124 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . 0.445 ' HA2' ' HB ' ' A' ' 988' ' ' VAL . . . 67.35 80.34 0.2 Allowed Glycine 0 C--O 1.215 -1.089 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -179.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.511 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 98.2 m95 -151.98 145.25 24.69 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.474 ' HB2' ' HB3' ' A' 1008 ' ' TRP . 4.9 pt-20 -119.4 157.29 28.5 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 122.33 1.062 . . . . 0.0 113.83 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.754 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 6.8 t80 -74.21 101.84 4.11 Favored 'General case' 0 C--O 1.209 -1.067 0 C-N-CA 128.686 2.795 . . . . 0.0 112.689 -173.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . 0.413 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -119.82 111.7 2.07 Favored Glycine 0 N--CA 1.434 -1.479 0 C-N-CA 119.63 -1.271 . . . . 0.0 111.299 173.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.608 HG22 ' HA ' ' A' 1016 ' ' HIS . 10.3 pt -121.54 145.12 28.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 175.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 13.6 t -139.04 140.39 38.09 Favored 'General case' 0 N--CA 1.425 -1.711 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 176.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.474 ' O ' HD12 ' A' ' 999' ' ' ILE . 2.3 pp -107.38 130.23 23.14 Favored Pre-proline 0 C--N 1.306 -1.306 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.087 -179.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 55.9 Cg_endo -71.69 139.98 34.88 Favored 'Trans proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.345 2.03 . . . . 0.0 112.815 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 5.7 Cg_endo -92.85 156.63 19.99 Favored 'Cis proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.747 -1.772 . . . . 0.0 112.028 -3.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 12.3 t70 -168.77 -93.98 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.001 175.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 167.83 -75.64 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.5 0 C-N-CA 125.057 1.343 . . . . 0.0 109.335 -177.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -129.14 141.06 40.48 Favored Pre-proline 0 C--N 1.317 -0.823 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -171.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.442 ' HG2' ' HB2' ' A' 1018 ' ' HIS . 80.4 Cg_exo -54.45 143.66 65.72 Favored 'Trans proline' 0 CA--C 1.511 -0.628 0 C-N-CA 123.326 2.684 . . . . 0.0 110.3 167.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 43.9 mmtt -106.16 -45.23 4.37 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 -176.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 14.4 m -97.35 144.69 26.86 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 112.624 -2.08 . . . . 0.0 111.359 -169.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.725 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 66.0 m95 -135.22 136.09 41.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.797 1.239 . . . . 0.0 107.862 -178.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.541 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 57.4 t -146.77 173.39 2.64 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.745 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -172.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . 0.448 ' N ' HG12 ' A' 1009 ' ' VAL . . . -78.91 -18.79 53.26 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 115.486 1.662 . . . . 0.0 115.486 -177.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -92.9 107.68 19.41 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -169.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.434 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 18.2 tp10 -72.19 121.59 19.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.914 0.864 . . . . 0.0 109.78 171.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.455 ' H ' ' CE1' ' A' 1016 ' ' HIS . 28.6 mtpp -124.09 152.85 42.24 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.811 -174.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 51.6 ttp -57.34 -37.99 73.41 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 124.212 0.945 . . . . 0.0 112.4 178.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -72.55 19.76 0.08 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.754 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.9 OUTLIER -69.77 175.07 4.52 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-O 122.174 0.987 . . . . 0.0 112.473 174.914 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . 0.662 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.7 OUTLIER -158.52 -35.44 0.07 Allowed 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 113.307 -1.77 . . . . 0.0 109.102 -172.924 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . 0.442 ' HB2' ' HG2' ' A' 1005 ' ' PRO . 0.2 OUTLIER -138.58 147.48 43.05 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.72 -178.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 937' ' ' ASN . 40.3 ttp180 -145.91 143.7 29.72 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 177.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.73 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.6 ptp180 -150.88 165.92 32.14 Favored 'General case' 0 C--O 1.2 -1.502 0 O-C-N 123.881 0.738 . . . . 0.0 109.362 176.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.7 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.1 ptt180 -144.59 148.55 34.51 Favored 'General case' 0 C--N 1.295 -1.788 0 O-C-N 123.613 0.57 . . . . 0.0 110.693 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.541 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 37.2 ttm180 -84.48 119.48 25.2 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 123.924 0.765 . . . . 0.0 110.254 178.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.415 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 69.4 mt -97.99 126.64 43.49 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 168.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.555 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 11.1 m -104.75 143.55 16.02 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.656 0 CA-C-O 121.01 0.433 . . . . 0.0 111.716 -174.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.547 ' HG2' ' CE3' ' A' ' 975' ' ' TRP . 0.5 OUTLIER -148.09 113.66 5.66 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.133 167.797 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.639 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.5 tmtp? -77.56 154.09 32.71 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 177.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 11.4 ptm180 -142.37 153.21 43.6 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 -176.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.617 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 36.3 ttmt -142.08 136.64 30.34 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 -172.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.689 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.0 ttmt -90.23 -24.65 20.9 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 123.057 1.408 . . . . 0.0 107.586 -177.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . 0.466 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 16.2 t0 54.7 12.33 0.55 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 112.23 -2.259 . . . . 0.0 111.043 -170.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 19.0 tp 66.71 -42.18 0.4 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.339 2.256 . . . . 0.0 112.229 -176.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 14.9 p -97.61 30.49 2.91 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -175.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.555 ' CD ' ' HB2' ' A' ' 974' ' ' GLU . 4.3 mm100 -58.16 -49.41 77.12 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.304 173.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 8.0 t -138.9 83.19 1.94 Allowed 'General case' 0 N--CA 1.434 -1.24 0 CA-C-O 122.74 1.257 . . . . 0.0 110.568 177.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -107.49 125.4 51.22 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.654 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 21.6 p -126.64 14.34 7.55 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.337 0.589 . . . . 0.0 111.089 -178.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 20.4 m -81.77 129.09 34.61 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 89.2 m -74.83 119.62 19.26 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -73.71 90.51 1.84 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.003 -176.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 . . . . . 0 C--N 1.318 -0.768 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 174.545 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 33.4 pt . . . . . 0 N--CA 1.475 0.785 0 CA-C-O 121.21 0.528 . . . . 0.0 109.647 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . 0.425 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 19.8 t70 -130.74 120.6 18.68 Favored Pre-proline 0 C--O 1.243 0.747 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.599 -176.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 19.1 Cg_exo -69.74 116.54 4.6 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 123.32 2.68 . . . . 0.0 110.898 176.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -55.45 121.41 8.94 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 113.972 -1.467 . . . . 0.0 110.457 -178.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 37.0 p 56.86 108.4 0.01 OUTLIER 'General case' 0 C--O 1.237 0.402 0 C-N-CA 125.717 1.607 . . . . 0.0 112.821 -174.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -78.24 -36.8 46.51 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . 0.411 ' HA ' ' HD2' ' A' ' 927' ' ' HIS . 17.9 t70 -124.55 99.99 6.44 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.594 175.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -90.6 5.99 45.64 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.168 176.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 120.44 49.07 0.3 Allowed Glycine 0 CA--C 1.499 -0.942 0 C-N-CA 121.249 -0.5 . . . . 0.0 111.913 -178.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.442 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 16.8 m-70 -100.53 -153.12 0.44 Allowed 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 175.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.64 120.75 5.27 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 101.71 -3.441 . . . . 0.0 101.71 165.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.531 ' HG3' ' HE2' ' A' 1026 ' ' LYS . 0.5 OUTLIER -145.27 150.26 36.34 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 176.18 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.571 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.1 t80 -143.21 140.13 30.58 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 175.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 27.8 m -77.91 127.78 32.91 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.789 -0.764 . . . . 0.0 109.886 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -96.55 149.34 21.87 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 104.627 -2.361 . . . . 0.0 104.627 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -150.03 151.49 33.36 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 118.694 0.679 . . . . 0.0 110.721 -172.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.583 HG22 ' H ' ' A' ' 935' ' ' TYR . 9.8 p -147.8 -178.26 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 N-CA-C 105.026 -2.213 . . . . 0.0 105.026 176.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.583 ' H ' HG22 ' A' ' 934' ' ' VAL . 77.0 m-85 -141.13 151.12 43.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.678 ' O ' ' HA ' ' A' 1020 ' ' ARG . 32.6 tt0 -119.74 113.47 20.68 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 -174.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -105.0 147.13 28.13 Favored 'General case' 0 C--N 1.313 -1.012 0 O-C-N 123.679 0.612 . . . . 0.0 110.684 -176.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.639 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 41.7 mt-10 -142.88 159.43 42.24 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 170.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . 0.675 ' HB3' ' CD2' ' A' 1018 ' ' HIS . 12.8 p -141.7 145.81 35.32 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' 1017 ' ' THR . 22.9 ptt180 -148.36 161.44 41.56 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 124.59 1.156 . . . . 0.0 107.949 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -67.28 158.21 82.61 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 172.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.96 88.95 0.07 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 121.656 1.571 . . . . 0.0 111.16 174.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 103.07 71.06 0.86 Allowed Glycine 0 N--CA 1.43 -1.712 0 N-CA-C 108.153 -1.979 . . . . 0.0 108.153 -175.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.04 -146.75 4.81 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.731 -174.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -129.79 132.23 46.46 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 124.475 1.11 . . . . 0.0 110.311 -176.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.639 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 40.9 m95 -76.13 151.91 36.86 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 121.792 0.806 . . . . 0.0 112.052 -173.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -143.79 153.13 57.36 Favored Pre-proline 0 C--N 1.307 -1.271 0 N-CA-C 103.807 -2.664 . . . . 0.0 103.807 176.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -49.2 126.26 15.14 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.667 2.244 . . . . 0.0 112.626 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -75.61 23.87 0.12 Allowed 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -171.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 79.3 -61.03 0.34 Allowed 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.738 1.615 . . . . 0.0 109.196 177.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -100.88 73.74 1.58 Allowed 'General case' 0 N--CA 1.415 -2.199 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 25.4 m -63.1 -60.42 3.46 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.414 -173.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . 0.564 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 68.4 m-85 -93.49 123.28 36.69 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 119.661 -0.816 . . . . 0.0 111.265 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 15.6 p -142.66 173.88 11.14 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 113.962 -1.472 . . . . 0.0 110.702 -170.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . 0.475 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 13.0 t70 -92.42 170.07 10.06 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 104.854 -2.276 . . . . 0.0 104.854 170.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.99 -30.89 27.03 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 118.591 0.632 . . . . 0.0 111.526 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -91.44 8.44 36.32 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 89.35 -7.49 81.9 Favored Glycine 0 CA--C 1.503 -0.718 0 C-N-CA 120.14 -1.029 . . . . 0.0 114.033 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . 0.475 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 20.3 t70 -52.89 101.76 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 172.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -54.9 125.86 22.01 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.885 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -125.76 175.86 7.33 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.741 -177.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . 0.595 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -70.38 160.23 32.7 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . 0.41 ' HB3' ' HD2' ' A' ' 964' ' ' PRO . 7.2 m -89.23 159.93 43.79 Favored Pre-proline 0 N--CA 1.427 -1.624 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.62 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.4 Cg_exo -47.66 -28.94 10.02 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.184 3.256 . . . . 0.0 116.771 -174.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 25.0 m -76.32 -43.17 42.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 119.041 0.837 . . . . 0.0 109.79 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . 0.595 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 35.5 mt-10 -64.9 -30.08 71.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.056 176.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.443 HD13 ' CH2' ' A' ' 980' ' ' TRP . 77.5 mt -72.34 114.42 10.44 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.909 176.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 41.6 p -121.34 170.33 9.72 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.622 -175.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 5.1 p -87.16 141.52 32.99 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 121.076 0.465 . . . . 0.0 111.356 178.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.595 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 27.8 Cg_endo -87.49 166.4 7.73 Favored 'Trans proline' 0 C--O 1.242 0.713 0 C-N-CA 122.437 2.092 . . . . 0.0 111.256 176.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.23 108.56 0.99 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 121.617 1.545 . . . . 0.0 110.292 173.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.688 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 115.53 5.67 18.45 Favored Glycine 0 N--CA 1.44 -1.057 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.874 -176.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.595 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 93.7 m95 -138.98 136.56 35.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 117.784 0.792 . . . . 0.0 111.937 178.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.511 ' HB3' ' O ' ' A' 1028 ' ' LYS . 4.8 tp10 -116.19 134.05 55.35 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 125.635 1.574 . . . . 0.0 107.706 -174.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.676 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 81.0 m95 -79.66 104.74 10.46 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 118.885 -1.126 . . . . 0.0 109.528 173.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -75.84 -42.61 49.16 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.83 143.0 55.98 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -70.74 -38.21 73.51 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -175.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.03 152.19 7.47 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 120.593 0.235 . . . . 0.0 110.392 -173.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.622 ' HA ' ' O ' ' A' 1024 ' ' VAL . 40.4 m95 -65.5 113.83 4.44 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 1.5 p -122.65 159.78 27.17 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -171.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 17.1 p90 -74.38 141.18 45.14 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 119.515 1.052 . . . . 0.0 111.205 -174.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.438 ' HB3' ' HB3' ' A' 1022 ' ' ARG . 7.8 t70 -81.56 120.8 25.51 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.701 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 12.6 pt -126.37 42.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -110.59 6.35 21.78 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 113.882 -1.508 . . . . 0.0 107.665 -172.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.513 ' HD3' ' NH1' ' A' 1022 ' ' ARG . 52.2 mtm180 -136.06 -176.25 4.25 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.534 -171.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.27 80.5 3.04 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.996 174.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.491 HG11 ' NH2' ' A' ' 986' ' ' ARG . 22.1 m -135.7 162.04 37.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.016 -174.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -56.13 173.48 0.16 Allowed 'General case' 0 N--CA 1.468 0.466 0 O-C-N 124.526 1.142 . . . . 0.0 111.207 172.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -53.28 -35.57 60.22 Favored 'General case' 0 CA--C 1.493 -1.246 0 C-N-CA 123.689 0.796 . . . . 0.0 111.671 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . 0.466 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 75.6 mmtt -106.46 12.91 29.13 Favored 'General case' 0 N--CA 1.417 -2.101 0 C-N-CA 118.878 -1.129 . . . . 0.0 111.805 -175.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 92.84 -11.46 72.05 Favored Glycine 0 CA--C 1.504 -0.648 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 174.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.509 ' CD2' ' HD2' ' A' 1019 ' ' ARG . 83.1 m95 -54.37 133.29 45.28 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 122.272 1.034 . . . . 0.0 111.848 177.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.706 ' HG2' ' O ' ' A' 1020 ' ' ARG . 5.5 pt-20 -117.82 152.04 36.14 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.579 -1.192 . . . . 0.0 109.864 -178.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.726 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 43.2 t80 -69.4 90.99 0.54 Allowed 'General case' 0 C--O 1.201 -1.451 0 CA-C-N 112.43 -2.168 . . . . 0.0 110.862 -175.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . 0.614 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -114.18 79.91 0.28 Allowed Glycine 0 N--CA 1.436 -1.361 0 C-N-CA 118.952 -1.594 . . . . 0.0 111.874 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -92.88 149.56 4.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 C-N-CA 117.123 -1.831 . . . . 0.0 108.355 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 36.9 m -124.71 98.02 5.54 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.758 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 22.2 pt -74.55 130.32 82.05 Favored Pre-proline 0 C--N 1.319 -0.728 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.479 176.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 55.3 Cg_endo -70.51 141.56 42.5 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.914 2.409 . . . . 0.0 113.071 -179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . 0.427 ' O ' ' HB2' ' A' 1002 ' ' ASP . 7.4 Cg_endo -91.29 149.84 18.27 Favored 'Cis proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.406 -1.497 . . . . 0.0 111.534 -2.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' 1001 ' ' PRO . 2.6 t70 163.69 160.55 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.987 0 O-C-N 124.972 1.42 . . . . 0.0 107.509 -177.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -134.61 33.88 3.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.314 0.578 . . . . 0.0 109.7 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 88.3 mttt -158.82 123.54 2.22 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.807 -174.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.465 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 33.4 Cg_exo -71.51 133.11 21.75 Favored 'Trans proline' 0 C--O 1.239 0.543 0 C-N-CA 122.278 1.985 . . . . 0.0 110.476 168.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 54.2 mmtt -94.27 -49.61 5.64 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 10.3 t -92.08 148.94 21.79 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.243 -177.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.669 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 58.0 m95 -138.37 137.54 37.41 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 176.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.672 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 33.0 t -144.42 169.78 8.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -172.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . 0.419 ' N ' HG12 ' A' 1009 ' ' VAL . . . -79.65 -12.96 59.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -179.217 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -91.81 109.42 20.74 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -174.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.547 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 1.0 OUTLIER -81.85 105.11 12.71 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 172.88 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.508 ' H ' ' CE1' ' A' 1016 ' ' HIS . 61.3 mtpt -107.83 161.92 14.47 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.246 -1.343 . . . . 0.0 112.123 -176.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 57.0 ttp -55.15 -44.53 75.21 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.245 -0.889 . . . . 0.0 113.158 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -72.73 18.09 0.1 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.726 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 0.8 OUTLIER -67.24 114.48 6.0 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.668 172.258 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . 0.447 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.0 OUTLIER -93.11 -25.27 17.96 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 122.8 1.286 . . . . 0.0 108.173 176.239 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . 0.675 ' CD2' ' HB3' ' A' ' 939' ' ' SER . 46.2 m80 -141.75 150.5 41.85 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.879 -1.509 . . . . 0.0 109.937 178.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.509 ' HD2' ' CD2' ' A' ' 993' ' ' TRP . 31.2 ptt180 -141.94 148.84 39.31 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 171.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.706 ' O ' ' HG2' ' A' ' 994' ' ' GLU . 37.7 ttp180 -152.61 165.51 34.97 Favored 'General case' 0 C--N 1.283 -2.283 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 29.0 ptt180 -155.35 159.26 39.8 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 178.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.513 ' NH1' ' HD3' ' A' ' 986' ' ' ARG . 38.6 ttm180 -86.46 132.81 33.84 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 45.6 mt -102.35 129.34 48.77 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 104.663 -2.347 . . . . 0.0 104.663 166.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.622 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 20.1 m -109.64 141.92 23.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.495 -171.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.502 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.9 tpt180 -141.12 98.52 3.39 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 114.048 -1.433 . . . . 0.0 107.945 172.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.531 ' HE2' ' HG3' ' A' ' 929' ' ' GLU . 0.3 OUTLIER -71.62 134.76 46.59 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 -177.55 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.676 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.3 ptm180 -128.68 143.15 50.87 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -172.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.511 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.0 ttmt -137.89 139.28 39.76 Favored 'General case' 0 C--N 1.283 -2.307 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -172.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.688 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 32.4 ttmt -91.49 -17.52 25.57 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 123.737 1.732 . . . . 0.0 107.561 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . 0.442 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 21.5 t70 53.02 8.99 0.11 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 111.37 -2.65 . . . . 0.0 112.48 -169.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 22.9 tp 69.4 -33.46 0.25 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.207 1.803 . . . . 0.0 111.75 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . 0.414 ' H ' ' C ' ' A' 1030 ' ' ASP . 12.6 t -79.03 -3.48 45.36 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -175.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -77.73 -24.95 48.98 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.84 -0.744 . . . . 0.0 111.012 177.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 8.8 t 175.77 148.83 0.1 Allowed 'General case' 0 C--O 1.238 0.471 0 O-C-N 123.939 0.775 . . . . 0.0 109.69 178.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -88.47 -61.0 1.81 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.536 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 7.1 m -141.88 16.57 2.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.744 0.307 . . . . 0.0 111.041 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 16.9 m -118.89 169.95 9.43 Favored 'General case' 0 C--N 1.319 -0.719 0 O-C-N 121.783 -0.573 . . . . 0.0 111.507 -175.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 11.4 p -96.17 139.35 32.46 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 174.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -84.44 9.3 13.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.696 0.76 . . . . 0.0 110.988 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 . . . . . 0 N--CA 1.441 -0.905 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 179.318 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 69.5 mt . . . . . 0 N--CA 1.469 0.495 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . 0.493 ' HA ' ' HB2' ' A' ' 923' ' ' ALA . 19.2 m-20 66.48 96.11 0.05 OUTLIER Pre-proline 0 N--CA 1.471 0.58 0 C-N-CA 123.984 0.914 . . . . 0.0 112.087 -177.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -63.88 -59.5 0.2 Allowed 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 121.894 1.729 . . . . 0.0 108.724 173.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -123.44 -53.76 1.79 Allowed 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 169.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 11.7 p -145.9 108.06 4.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.687 175.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . 0.493 ' HB2' ' HA ' ' A' ' 919' ' ' ASP . . . -85.64 -29.07 24.34 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -110.81 139.17 46.35 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.18 -1.373 . . . . 0.0 109.332 173.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -124.91 11.62 8.36 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.483 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . 0.428 ' O ' HD22 ' A' 1031 ' ' LEU . . . 121.14 44.45 0.4 Allowed Glycine 0 CA--C 1.492 -1.379 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.781 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.458 ' HA ' ' O ' ' A' 1030 ' ' ASP . 13.6 m-70 -115.29 -150.9 0.47 Allowed 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 172.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.15 108.99 1.94 Allowed 'General case' 0 N--CA 1.412 -2.35 0 N-CA-C 101.428 -3.545 . . . . 0.0 101.428 169.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.3 OUTLIER -137.39 144.57 42.52 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 178.233 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.497 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.8 t80 -137.39 138.06 39.48 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 105.888 -1.893 . . . . 0.0 105.888 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.632 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 26.9 m -74.08 129.98 38.9 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 176.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . 0.535 ' HB2' ' HD2' ' A' 1027 ' ' ARG . 4.6 t70 -102.34 156.26 17.7 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.528 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.0 pt-20 -150.53 153.64 36.16 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.155 0.502 . . . . 0.0 111.324 -172.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.524 ' O ' ' HA ' ' A' 1022 ' ' ARG . 9.4 p -146.53 179.01 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 N-CA-C 106.182 -1.784 . . . . 0.0 106.182 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.52 ' HA ' ' O ' ' A' 1021 ' ' ARG . 28.3 m-85 -144.07 113.95 7.25 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 119.653 1.115 . . . . 0.0 111.297 -174.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -81.36 132.78 35.35 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 123.57 0.544 . . . . 0.0 110.211 172.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . 0.481 ' OD1' ' HB3' ' A' 1020 ' ' ARG . 27.6 m-80 -121.55 155.85 34.13 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 124.385 1.074 . . . . 0.0 113.116 -176.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.678 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 42.4 mt-10 -142.29 152.82 43.36 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 105.252 -2.129 . . . . 0.0 105.252 169.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 34.5 m -128.59 144.83 51.23 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 123.488 0.492 . . . . 0.0 111.018 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.493 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 20.7 ptt180 -149.92 161.75 41.68 Favored 'General case' 0 N--CA 1.433 -1.299 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -176.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -66.18 163.15 40.97 Favored Pre-proline 0 C--N 1.312 -1.023 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 172.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -66.64 90.41 0.28 Allowed 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 121.32 1.347 . . . . 0.0 111.271 177.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 97.15 72.19 1.09 Allowed Glycine 0 N--CA 1.434 -1.444 0 N-CA-C 107.88 -2.088 . . . . 0.0 107.88 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.67 -152.57 6.94 Favored Glycine 0 N--CA 1.44 -1.061 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.769 -174.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -108.38 136.29 48.27 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.377 -0.912 . . . . 0.0 109.54 -177.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.678 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 44.8 m95 -85.29 145.81 27.35 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-O 121.782 0.801 . . . . 0.0 109.486 -178.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -127.53 169.11 13.08 Favored Pre-proline 0 C--N 1.298 -1.665 0 N-CA-C 104.232 -2.507 . . . . 0.0 104.232 178.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -57.68 124.24 15.59 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 121.497 1.464 . . . . 0.0 109.599 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.04 10.7 0.05 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -174.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 79.4 -51.39 0.42 Allowed 'General case' 0 CA--C 1.481 -1.691 0 C-N-CA 124.533 1.133 . . . . 0.0 109.577 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -113.22 94.57 4.94 Favored 'General case' 0 N--CA 1.402 -2.84 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.1 m -72.89 -56.94 4.47 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.216 -173.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -94.92 122.4 37.53 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-O 122.164 0.983 . . . . 0.0 111.694 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 77.4 p -137.77 173.09 12.01 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.503 -173.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -95.85 172.63 7.9 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 171.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.96 -32.37 45.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 119.286 0.948 . . . . 0.0 110.843 174.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -80.39 -2.33 45.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.606 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 89.52 -9.12 78.23 Favored Glycine 0 CA--C 1.496 -1.108 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.843 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -51.8 103.44 0.06 Allowed 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 124.532 0.784 . . . . 0.0 110.733 175.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -51.86 121.91 7.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.444 -1.253 . . . . 0.0 108.472 177.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -123.32 -172.95 2.62 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.177 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -82.97 162.15 21.56 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . 0.462 ' HB3' ' HD2' ' A' ' 964' ' ' PRO . 3.8 m -88.61 157.63 49.33 Favored Pre-proline 0 N--CA 1.43 -1.429 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.662 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 6.9 Cg_exo -43.03 -32.46 2.8 Favored 'Trans proline' 0 CA--C 1.542 0.884 1 C-N-CA 125.607 4.204 . . . . 0.0 117.901 -174.81 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 19.9 m -86.64 -35.25 19.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 122.194 0.997 . . . . 0.0 108.951 -176.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -72.96 -12.14 60.83 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.31 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 28.2 mt -89.35 110.36 21.17 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 21.1 p -114.25 -172.01 2.02 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.921 -174.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.588 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 15.4 p -114.96 129.49 25.01 Favored Pre-proline 0 C--N 1.317 -0.825 0 O-C-N 121.96 -0.463 . . . . 0.0 111.172 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.612 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 72.8 Cg_endo -70.69 169.82 19.19 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 123.213 2.609 . . . . 0.0 110.826 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -48.09 -33.56 21.28 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.887 2.391 . . . . 0.0 113.659 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.642 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -110.61 34.01 5.61 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-O 119.233 -0.76 . . . . 0.0 113.76 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.612 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 61.0 m95 -146.24 141.13 27.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.922 0.861 . . . . 0.0 110.878 169.192 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.6 ' HB3' ' O ' ' A' 1028 ' ' LYS . 7.5 tp10 -125.56 147.83 49.13 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 -176.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.467 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 63.6 m95 -75.91 143.54 41.62 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 122.237 1.018 . . . . 0.0 112.875 175.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . 0.623 ' HG2' ' HB3' ' A' 1028 ' ' LYS . 2.4 mm-40 -109.41 -44.38 3.91 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.564 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -91.51 159.13 16.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.137 -170.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.22 -52.81 60.73 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.067 0.947 . . . . 0.0 112.889 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -162.92 160.27 24.68 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 -173.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.662 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 23.8 m95 -75.38 116.8 16.48 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 20.8 m -125.15 159.91 30.37 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 -175.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -74.98 134.86 41.39 Favored 'General case' 0 C--N 1.298 -1.634 0 C-N-CA 119.34 -0.944 . . . . 0.0 110.629 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.513 ' HB2' HG13 ' A' 1024 ' ' VAL . 39.7 t0 -82.01 124.78 30.09 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.36 -176.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.0 pp -121.89 11.97 5.87 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 121.71 0.767 . . . . 0.0 110.516 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -87.54 23.26 1.97 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.396 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 986' ' ' ARG . 37.8 mtp-105 -146.47 -176.82 5.33 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.151 -174.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.38 83.72 7.39 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.49 HG12 ' HG2' ' A' ' 994' ' ' GLU . 27.6 m -135.37 160.49 40.22 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.745 -178.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -55.3 169.11 0.29 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.102 0.561 . . . . 0.0 110.006 169.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -59.62 -33.03 70.97 Favored 'General case' 0 CA--C 1.503 -0.842 0 O-C-N 122.012 -0.43 . . . . 0.0 111.64 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -95.36 4.15 53.68 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 119.851 -0.74 . . . . 0.0 111.046 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.07 -21.79 40.42 Favored Glycine 0 C--O 1.223 -0.571 0 CA-C-N 116.575 -0.284 . . . . 0.0 112.827 175.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.519 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 81.8 m95 -50.92 121.88 6.65 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.49 ' HG2' HG12 ' A' ' 988' ' ' VAL . 19.2 mt-10 -98.96 149.45 22.96 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.556 0.694 . . . . 0.0 110.185 177.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.688 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 55.5 t80 -76.5 87.06 3.22 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 126.304 1.842 . . . . 0.0 109.963 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . 0.614 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -112.86 91.44 0.59 Allowed Glycine 0 CA--C 1.485 -1.81 0 C-N-CA 119.966 -1.111 . . . . 0.0 110.359 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.557 HG22 ' HA ' ' A' 1016 ' ' HIS . 9.5 pt -104.48 151.14 7.07 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.521 -175.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.6 t -137.42 135.85 37.29 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 172.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 62.7 mt -117.44 106.21 47.05 Favored Pre-proline 0 C--N 1.313 -0.995 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 20.5 Cg_endo -61.94 137.74 69.29 Favored 'Trans proline' 0 C--O 1.241 0.634 0 C-N-CA 122.618 2.212 . . . . 0.0 112.873 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . 0.417 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 5.4 Cg_endo -82.9 141.85 44.76 Favored 'Cis proline' 0 N--CA 1.45 -1.06 0 C-N-CA 122.756 -1.768 . . . . 0.0 113.336 0.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 28.8 t70 -158.36 -98.62 0.03 OUTLIER 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 112.634 -2.076 . . . . 0.0 108.626 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . 0.505 ' HD2' ' HB2' ' A' 1004 ' ' LYS . 2.5 p-80 164.08 -45.78 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.719 1.262 . . . . 0.0 113.189 175.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . 0.505 ' HB2' ' HD2' ' A' 1003 ' ' HIS . 52.9 mttp -164.86 141.58 4.91 Favored Pre-proline 0 CA--C 1.51 -0.579 0 N-CA-C 106.033 -1.839 . . . . 0.0 106.033 -169.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.42 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 68.1 Cg_exo -50.16 122.33 9.09 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 121.246 1.297 . . . . 0.0 111.409 173.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . 0.407 ' H ' ' HG2' ' A' 1006 ' ' LYS . 37.6 pttt -107.2 5.5 27.78 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.784 -175.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . 0.458 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 44.7 t -141.63 138.47 32.57 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -176.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.637 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 49.1 m95 -135.39 135.55 40.73 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.569 ' HB ' ' HB3' ' A' ' 995' ' ' TYR . 81.6 t -143.27 166.37 14.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 -172.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -88.63 10.05 21.97 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -122.18 130.97 53.7 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 119.091 0.859 . . . . 0.0 112.927 -175.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.582 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 19.1 tp10 -79.09 112.67 16.52 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 122.064 0.935 . . . . 0.0 108.876 175.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.484 ' H ' ' CE1' ' A' 1016 ' ' HIS . 45.0 mttp -125.11 158.91 32.7 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.929 -1.487 . . . . 0.0 110.7 -175.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 45.0 ttp -53.95 -43.74 70.1 Favored 'General case' 0 C--N 1.311 -1.094 0 O-C-N 124.241 0.963 . . . . 0.0 112.952 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -49.7 -11.19 0.05 Allowed 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 175.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.688 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 16.8 m80 -58.93 154.4 15.38 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.86 1.314 . . . . 0.0 112.007 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -160.31 -34.45 0.05 Allowed 'General case' 0 C--N 1.286 -2.161 0 CA-C-N 111.141 -2.754 . . . . 0.0 105.765 -168.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.97 153.0 46.76 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 113.097 -1.865 . . . . 0.0 108.311 174.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.519 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 40.9 ptt180 -160.1 152.57 20.94 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 173.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.551 ' HG2' ' CZ3' ' A' 1008 ' ' TRP . 4.0 ptp180 -152.29 148.64 27.78 Favored 'General case' 0 CA--C 1.486 -1.492 0 C-N-CA 118.352 -1.339 . . . . 0.0 110.309 177.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.9 ptt180 -124.65 140.63 52.76 Favored 'General case' 0 C--N 1.293 -1.873 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.927 -177.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.528 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 38.7 ttm180 -81.07 123.12 28.12 Favored 'General case' 0 N--CA 1.422 -1.853 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.725 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 77.2 mt -95.8 127.01 41.46 Favored 'General case' 0 N--CA 1.422 -1.827 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 168.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.513 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.1 m -106.55 139.6 27.44 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.386 -174.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.531 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.7 tpt180 -143.19 101.4 3.8 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.186 -1.37 . . . . 0.0 107.845 171.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.632 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -71.44 147.46 47.84 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.214 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.535 ' HD2' ' HB2' ' A' ' 932' ' ' ASP . 12.1 ptm180 -140.91 151.46 44.27 Favored 'General case' 0 C--O 1.206 -1.213 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -172.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.827 ' HG2' ' H ' ' A' 1030 ' ' ASP . 30.4 ttmt -138.24 140.26 39.59 Favored 'General case' 0 C--O 1.197 -1.705 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 -174.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.642 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 29.3 ttmt -88.92 -4.47 58.45 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.844 0.831 . . . . 0.0 109.557 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . 0.827 ' H ' ' HG2' ' A' 1028 ' ' LYS . 2.1 t70 83.15 -68.6 0.06 Allowed 'General case' 0 CA--C 1.498 -1.055 0 CA-C-N 113.041 -1.891 . . . . 0.0 106.25 -173.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . 0.438 ' HB2' ' HA ' ' A' ' 927' ' ' HIS . 34.0 tp 149.9 -29.2 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.706 0 O-C-N 127.171 2.795 . . . . 0.0 108.584 173.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 25.6 p -114.67 14.08 17.5 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.675 0.75 . . . . 0.0 111.218 -170.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.528 ' HB2' ' O ' ' A' 1029 ' ' LYS . 29.5 tt0 -70.93 -30.59 66.95 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.278 -177.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 2.4 p -106.29 107.06 17.88 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 169.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -77.15 130.3 37.13 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -170.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . 0.784 ' HB3' ' HA ' ' A' 1040 ' ' ARG . 39.0 m -85.5 86.53 7.36 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 107.516 -1.291 . . . . 0.0 107.516 172.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 14.5 t -96.29 -60.58 1.59 Allowed 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -175.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 29.5 p -99.87 -17.48 17.6 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 121.806 0.813 . . . . 0.0 109.623 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -114.26 -174.86 2.56 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 176.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . 0.784 ' HA ' ' HB3' ' A' 1036 ' ' SER . 75.3 ttt180 . . . . . 0 C--O 1.25 1.092 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.523 0 CA-C-O 121.809 0.814 . . . . 0.0 110.565 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . 0.44 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 2.7 m-20 -122.37 135.68 25.77 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.269 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . 0.486 ' HB2' ' HB2' ' A' ' 923' ' ' ALA . 35.3 Cg_exo -64.44 -31.24 61.84 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 122.836 2.357 . . . . 0.0 112.503 175.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 66.5 -74.62 0.06 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.614 1.165 . . . . 0.0 111.83 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 23.7 p -79.27 -48.36 14.27 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . 0.486 ' HB2' ' HB2' ' A' ' 920' ' ' PRO . . . 58.11 85.61 0.09 Allowed 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 124.656 1.223 . . . . 0.0 110.483 -177.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -73.79 33.96 0.08 Allowed 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 124.142 0.977 . . . . 0.0 112.507 -174.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -88.43 93.04 9.4 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 122.991 0.516 . . . . 0.0 111.324 -177.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 64.4 31.52 81.14 Favored Glycine 0 N--CA 1.453 -0.222 0 CA-C-N 115.721 -0.672 . . . . 0.0 114.724 175.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -136.3 142.34 43.89 Favored 'General case' 0 CA--C 1.487 -1.475 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 169.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -102.4 116.42 32.6 Favored 'General case' 0 N--CA 1.409 -2.495 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 163.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.717 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.5 OUTLIER -126.55 132.24 51.38 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 179.874 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.48 ' O ' ' HG2' ' A' 1027 ' ' ARG . 87.4 t80 -124.52 139.17 54.13 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 20.5 m -74.19 123.39 24.4 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -97.82 150.31 21.41 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 105.048 -2.205 . . . . 0.0 105.048 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.553 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 9.1 pt-20 -143.66 146.89 33.57 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 118.622 0.647 . . . . 0.0 110.899 -175.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.524 HG22 ' H ' ' A' ' 935' ' ' TYR . 11.2 p -135.45 174.72 12.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.58 ' O ' ' HA ' ' A' ' 953' ' ' TYR . 59.5 m-85 -135.54 146.38 47.98 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 118.674 0.67 . . . . 0.0 110.54 -175.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.587 ' O ' ' HA ' ' A' 1020 ' ' ARG . 53.2 mt-30 -112.87 116.57 30.23 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 124.567 1.167 . . . . 0.0 108.072 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -101.95 137.64 39.96 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 121.957 0.884 . . . . 0.0 112.312 -177.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 948' ' ' PRO . 29.3 mt-10 -138.43 150.48 46.54 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 113.261 -1.791 . . . . 0.0 106.619 170.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 47.1 t -144.4 154.91 43.47 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.132 -169.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.516 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 36.6 ptt180 -141.83 157.38 45.08 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -75.91 172.94 8.03 Favored Pre-proline 0 C--N 1.305 -1.353 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -66.73 48.74 0.29 Allowed 'Trans proline' 0 N--CA 1.483 0.874 0 C-N-CA 122.99 2.46 . . . . 0.0 112.259 171.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . 0.586 ' HA2' ' SD ' ' A' 1014 ' ' MET . . . 155.98 37.15 0.02 OUTLIER Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.537 -176.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . 0.516 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -132.62 -173.39 13.29 Favored Glycine 0 CA--C 1.499 -0.949 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -120.14 165.92 14.12 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 174.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.526 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 34.3 m95 -72.56 124.52 25.4 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-O 121.15 0.5 . . . . 0.0 110.306 -173.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -124.97 159.7 57.75 Favored Pre-proline 0 C--N 1.304 -1.388 0 N-CA-C 104.411 -2.44 . . . . 0.0 104.411 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.558 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 88.4 Cg_exo -49.08 138.85 27.42 Favored 'Trans proline' 0 CA--C 1.527 0.152 0 C-N-CA 122.226 1.951 . . . . 0.0 112.493 -178.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -76.78 -161.78 0.22 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.585 -178.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -95.84 -38.24 10.38 Favored 'General case' 0 CA--C 1.481 -1.679 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . 0.714 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 27.8 m-20 -116.45 100.71 8.06 Favored 'General case' 0 N--CA 1.404 -2.726 0 N-CA-C 104.588 -2.375 . . . . 0.0 104.588 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 7.4 m -60.03 -56.78 17.49 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 123.689 0.618 . . . . 0.0 111.421 -172.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . 0.58 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 92.8 m-85 -103.86 135.3 45.65 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-O 121.455 0.645 . . . . 0.0 111.56 -179.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 76.7 p -148.98 -176.05 5.19 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -174.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -106.19 -174.22 2.48 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 173.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.6 -31.05 34.46 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 175.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -77.72 -50.24 12.8 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.959 -0.463 . . . . 0.0 111.215 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 133.65 -3.02 4.6 Favored Glycine 0 CA--C 1.494 -1.28 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -177.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -58.35 107.3 0.47 Allowed 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.174 -1.013 . . . . 0.0 109.678 175.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . 0.714 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 26.2 tptp -47.16 112.69 0.56 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 113.709 -1.587 . . . . 0.0 110.12 175.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -112.68 178.7 4.2 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.279 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . 0.497 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -71.48 155.84 40.13 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . 0.402 ' HB2' ' HD2' ' A' ' 964' ' ' PRO . 5.9 p -77.81 162.43 67.82 Favored Pre-proline 0 N--CA 1.434 -1.256 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.415 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 10.3 Cg_endo -58.61 -25.6 75.52 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.779 2.319 . . . . 0.0 112.559 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 1.2 m -68.35 -49.93 56.74 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 174.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . 0.497 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 47.4 mt-10 -64.66 -33.92 77.08 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.26 -1.336 . . . . 0.0 112.68 177.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.487 HD13 ' CH2' ' A' ' 980' ' ' TRP . 69.4 mt -67.29 112.16 4.39 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.811 0.815 . . . . 0.0 111.929 -178.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 21.7 p -117.4 171.19 8.15 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.286 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 19.2 p -87.1 138.54 32.57 Favored Pre-proline 0 C--N 1.319 -0.755 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.637 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.6 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 68.9 Cg_endo -82.88 163.61 15.87 Favored 'Trans proline' 0 C--O 1.243 0.734 0 C-N-CA 122.365 2.043 . . . . 0.0 111.083 178.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . 0.64 ' HA ' ' OG ' ' A' 1036 ' ' SER . 31.4 Cg_exo -61.82 102.98 0.26 Allowed 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 121.928 1.752 . . . . 0.0 110.15 173.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.483 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 127.21 -7.64 7.14 Favored Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.468 -0.873 . . . . 0.0 111.159 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.6 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.6 m95 -136.49 139.8 42.57 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.611 0.72 . . . . 0.0 111.105 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.617 ' HB2' HE21 ' A' 1033 ' ' GLN . 9.2 tp10 -123.66 136.9 54.75 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 126.26 1.824 . . . . 0.0 108.539 -173.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.632 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 91.3 m95 -84.6 158.73 20.79 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 119.436 1.016 . . . . 0.0 110.724 175.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -139.99 -36.78 0.49 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.09 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . 0.555 ' HB3' ' HD2' ' A' 1025 ' ' ARG . 9.9 t70 -67.43 150.52 48.8 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -68.32 -43.72 76.97 Favored 'General case' 0 C--N 1.314 -0.941 0 O-C-N 123.161 0.288 . . . . 0.0 111.577 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.07 159.27 12.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.749 0.309 . . . . 0.0 110.494 -172.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.541 ' HA ' ' O ' ' A' 1024 ' ' VAL . 17.1 m95 -76.43 91.45 3.31 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -177.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 18.5 t -103.45 162.11 13.3 Favored 'General case' 0 C--O 1.205 -1.254 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . 0.424 ' HA ' ' O ' ' A' 1022 ' ' ARG . 8.2 p90 -73.55 139.27 45.52 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 121.646 0.736 . . . . 0.0 111.801 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.466 ' HB2' HG13 ' A' 1024 ' ' VAL . 26.2 t70 -99.89 130.88 46.12 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.406 -175.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.466 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.4 pp -114.85 18.79 7.4 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.884 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.99 34.3 1.39 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -175.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.424 ' HB2' HG13 ' A' ' 988' ' ' VAL . 63.1 mtp180 -145.47 179.91 7.1 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -177.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -81.8 82.09 7.6 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 172.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.466 HG21 ' HA ' ' A' ' 984' ' ' ILE . 18.6 m -128.96 -170.79 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.794 -173.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -96.39 -172.23 2.48 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 105.265 -2.124 . . . . 0.0 105.265 -178.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -58.28 -33.42 69.41 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 122.94 0.496 . . . . 0.0 111.155 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -112.12 23.79 13.33 Favored 'General case' 0 N--CA 1.427 -1.601 0 C-N-CA 118.761 -1.176 . . . . 0.0 112.927 -178.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 90.78 -11.91 70.38 Favored Glycine 0 C--O 1.229 -0.212 0 C-N-CA 120.112 -1.042 . . . . 0.0 112.899 173.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.59 ' HA ' ' HB3' ' A' 1021 ' ' ARG . 94.8 m95 -52.18 143.85 13.61 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 175.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.583 ' O ' ' HG3' ' A' 1019 ' ' ARG . 9.6 pt-20 -130.3 143.28 50.68 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 174.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.556 ' CD2' ' HA ' ' A' 1011 ' ' ALA . 1.4 t80 -104.54 115.96 31.25 Favored 'General case' 0 C--N 1.285 -2.226 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.894 -165.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . 0.447 ' HA2' ' O ' ' A' 1007 ' ' SER . . . -132.63 144.76 16.68 Favored Glycine 0 N--CA 1.435 -1.383 0 CA-C-O 122.016 0.787 . . . . 0.0 112.354 -177.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.684 ' HA ' ' HA ' ' A' 1016 ' ' HIS . 0.1 OUTLIER -93.24 173.66 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.502 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . 0.405 ' HG1' ' HG3' ' A' 1005 ' ' PRO . 39.6 m -169.17 98.63 0.36 Allowed 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 104.995 -2.224 . . . . 0.0 104.995 178.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.448 ' O ' ' HB2' ' A' 1002 ' ' ASP . 68.0 mt -116.11 108.71 45.66 Favored Pre-proline 0 C--N 1.314 -0.969 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 -175.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.03 140.4 78.63 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 123.38 2.72 . . . . 0.0 113.609 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -76.17 150.28 93.33 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.029 -1.655 . . . . 0.0 111.295 -1.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.5 t70 -172.15 -153.69 0.08 Allowed 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.14 -0.936 . . . . 0.0 108.899 -172.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.3 m170 -151.87 -82.48 0.09 Allowed 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.44 0.696 . . . . 0.0 110.351 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 80.6 mttt -128.84 154.4 80.05 Favored Pre-proline 0 C--N 1.309 -1.188 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 177.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.405 ' HG3' ' HG1' ' A' ' 998' ' ' THR . 52.4 Cg_exo -55.52 125.34 18.81 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 121.888 1.725 . . . . 0.0 111.305 174.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 20.4 pttp -100.06 4.51 44.72 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.313 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . 0.447 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 48.5 t -142.89 122.99 13.65 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.217 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.488 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 66.8 m95 -122.89 133.15 54.42 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.36 1.464 . . . . 0.0 107.055 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.416 HG23 ' HB3' ' A' ' 995' ' ' TYR . 15.8 m -143.98 -164.98 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -178.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -91.64 -35.31 14.28 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 120.246 1.385 . . . . 0.0 110.045 174.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . 0.556 ' HA ' ' CD2' ' A' ' 995' ' ' TYR . . . 171.72 172.66 0.09 Allowed 'General case' 0 CA--C 1.508 -0.64 0 O-C-N 123.81 0.694 . . . . 0.0 111.962 -172.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' 1013 ' ' LYS . 10.9 pt-20 160.22 -61.93 0.0 OUTLIER 'General case' 0 C--N 1.345 0.4 0 O-C-N 126.691 2.494 . . . . 0.0 112.626 174.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.431 ' N ' ' HG3' ' A' 1012 ' ' GLU . 59.1 mttp -131.14 149.56 52.54 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -165.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . 0.586 ' SD ' ' HA2' ' A' ' 943' ' ' GLY . 59.4 ttp -65.02 -23.96 67.36 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.738 -1.574 . . . . 0.0 112.63 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . 0.42 ' O ' HG22 ' A' ' 997' ' ' ILE . 60.2 m-85 -61.06 -6.94 2.18 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 175.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.684 ' HA ' ' HA ' ' A' ' 997' ' ' ILE . 16.1 m80 -90.71 106.08 18.26 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.656 -2.35 . . . . 0.0 104.656 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 17.9 p -100.24 -6.45 26.0 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -169.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 13.6 m170 -129.45 142.5 50.77 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 122.062 -0.399 . . . . 0.0 110.826 -174.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 994' ' ' GLU . 10.4 ttm180 -150.94 146.99 26.63 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 177.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.587 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 3.5 ptp180 -148.55 166.51 28.02 Favored 'General case' 0 C--O 1.199 -1.566 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 177.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.59 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 23.7 ptt180 -146.35 150.85 36.49 Favored 'General case' 0 C--N 1.287 -2.128 0 O-C-N 123.389 0.431 . . . . 0.0 110.005 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.553 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.4 ttm180 -88.91 129.57 35.59 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 123.487 0.492 . . . . 0.0 111.422 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.559 HD21 ' OE1' ' A' ' 936' ' ' GLN . 70.8 mt -104.98 137.71 42.32 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 105.217 -2.142 . . . . 0.0 105.217 165.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.541 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 12.8 m -113.16 141.24 29.52 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.052 0 CA-C-O 122.027 0.918 . . . . 0.0 111.958 -176.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.555 ' HD2' ' HB3' ' A' ' 977' ' ' ASP . 11.8 tpt180 -138.7 100.69 4.14 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 113.579 -1.646 . . . . 0.0 106.682 172.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -74.14 146.22 43.67 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -178.186 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.632 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 10.3 ptm180 -142.62 166.65 24.08 Favored 'General case' 0 CA--C 1.493 -1.234 0 N-CA-C 105.842 -1.91 . . . . 0.0 105.842 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.717 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 13.3 ptpt -156.13 155.8 33.16 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-O 121.033 0.445 . . . . 0.0 110.348 -178.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 29.3 ttmt -83.73 -21.65 32.21 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 22.0 t70 44.36 23.51 0.07 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 111.298 -2.683 . . . . 0.0 112.024 -171.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 23.0 tp 66.12 -39.42 0.32 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.097 2.159 . . . . 0.0 113.455 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 9.8 t -69.95 -22.58 63.16 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 123.132 0.573 . . . . 0.0 112.092 -176.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.617 HE21 ' HB2' ' A' ' 974' ' ' GLU . 21.1 mt-30 -99.74 127.19 45.88 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 119.018 -1.073 . . . . 0.0 112.489 178.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 17.7 m -143.48 -23.11 0.6 Allowed 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.074 -1.421 . . . . 0.0 107.234 170.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -141.94 162.83 34.51 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 174.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . 0.64 ' OG ' ' HA ' ' A' ' 971' ' ' PRO . 39.0 m -129.17 25.73 5.5 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.649 0.737 . . . . 0.0 110.416 -178.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 15.4 m -112.54 35.29 3.89 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -177.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 4.3 m -66.55 -38.78 87.83 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.345 -175.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -95.73 138.92 32.7 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.732 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 . . . . . 0 N--CA 1.443 -0.817 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 179.792 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.469 0.519 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -82.42 150.64 64.05 Favored Pre-proline 0 C--N 1.317 -0.814 0 CA-C-N 116.374 -0.376 . . . . 0.0 109.992 -176.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.65 111.25 2.08 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.112 2.541 . . . . 0.0 112.483 -177.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -80.52 -20.03 44.45 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.083 -1.417 . . . . 0.0 108.284 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 8.9 t -76.9 -8.73 57.89 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.684 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . 65.28 -74.45 0.05 Allowed 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.755 1.222 . . . . 0.0 111.649 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . 0.413 ' HA ' ' HD2' ' A' ' 927' ' ' HIS . 22.1 t70 -87.52 100.39 12.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.396 0.617 . . . . 0.0 110.683 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -111.0 12.43 22.09 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.295 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 130.17 73.43 0.13 Allowed Glycine 0 N--CA 1.44 -1.049 0 N-CA-C 109.159 -1.577 . . . . 0.0 109.159 -174.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.413 ' HD2' ' HA ' ' A' ' 924' ' ' ASP . 49.4 m-70 -158.9 -60.39 0.07 Allowed 'General case' 0 CA--C 1.488 -1.433 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -175.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . 0.426 ' HB ' ' HE3' ' A' 1029 ' ' LYS . 1.5 m 63.34 87.58 0.11 Allowed 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 124.601 1.188 . . . . 0.0 107.843 -165.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.861 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.4 OUTLIER -102.75 168.19 9.4 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 179.652 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.632 ' O ' ' HG2' ' A' 1027 ' ' ARG . 89.5 t80 -153.98 120.86 5.62 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 10.2 m -79.23 121.64 25.31 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 174.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -103.51 146.12 29.01 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 104.944 -2.243 . . . . 0.0 104.944 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.456 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -145.42 147.91 32.74 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 118.331 0.514 . . . . 0.0 110.965 -173.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 4.6 p -151.88 134.02 5.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 120.981 0.42 . . . . 0.0 110.085 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' 1021 ' ' ARG . 94.9 m-85 -93.4 152.1 19.33 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -175.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.59 ' HG2' ' CE1' ' A' ' 953' ' ' TYR . 21.5 mt-30 -112.09 113.69 26.1 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 105.434 -2.062 . . . . 0.0 105.434 174.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . 0.469 ' HB3' ' HB2' ' A' ' 949' ' ' ALA . 12.2 m-80 -106.34 139.42 40.86 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -176.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.61 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 85.3 mt-10 -135.07 152.67 51.89 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 176.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 50.5 m -145.34 137.47 25.67 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.163 0.506 . . . . 0.0 111.596 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.549 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 18.3 ptt180 -139.82 161.63 37.11 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 124.446 1.098 . . . . 0.0 108.084 -174.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -65.29 161.56 48.61 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 170.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -66.21 86.73 0.25 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 121.458 1.439 . . . . 0.0 111.912 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 99.85 70.04 0.92 Allowed Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 107.728 -2.149 . . . . 0.0 107.728 -175.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -166.08 -148.04 5.41 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.57 -173.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -110.77 128.4 55.73 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 122.737 0.415 . . . . 0.0 110.984 -176.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.61 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 56.1 m95 -73.53 152.73 40.55 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-O 121.835 0.826 . . . . 0.0 109.695 176.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -133.57 169.18 14.62 Favored Pre-proline 0 C--N 1.3 -1.549 0 N-CA-C 103.452 -2.795 . . . . 0.0 103.452 171.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.2 124.4 16.16 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 N-CA-C 107.959 -1.593 . . . . 0.0 107.959 170.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . 0.469 ' HB2' ' HB3' ' A' ' 937' ' ' ASN . . . -37.68 -58.25 0.91 Allowed 'General case' 0 N--CA 1.483 1.215 0 O-C-N 124.877 1.361 . . . . 0.0 113.894 -171.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -168.29 -39.81 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 104.633 -2.358 . . . . 0.0 104.633 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -131.31 160.17 35.75 Favored 'General case' 0 N--CA 1.434 -1.259 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 168.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 29.0 m -93.65 -57.8 2.46 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 118.205 0.457 . . . . 0.0 110.391 -175.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . 0.59 ' CE1' ' HG2' ' A' ' 936' ' ' GLN . 58.3 m-85 -97.46 127.4 43.39 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 122.008 0.909 . . . . 0.0 110.729 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . 0.495 ' HB ' ' HA2' ' A' ' 958' ' ' GLY . 1.1 p -144.0 167.14 23.08 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.31 -170.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -97.63 -173.68 2.7 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . 0.494 ' HA ' ' CE1' ' A' ' 935' ' ' TYR . . . -51.25 -27.18 8.54 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . 0.563 HD21 ' HB2' ' A' ' 959' ' ' ASP . 23.1 p-10 -92.78 -37.74 12.17 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.293 0.568 . . . . 0.0 111.518 178.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . 0.495 ' HA2' ' HB ' ' A' ' 954' ' ' THR . . . 110.38 52.15 0.6 Allowed Glycine 0 CA--C 1.484 -1.864 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 -173.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . 0.563 ' HB2' HD21 ' A' ' 957' ' ' ASN . 17.7 t70 -121.07 106.38 11.51 Favored 'General case' 0 N--CA 1.419 -2.004 0 N-CA-C 100.977 -3.712 . . . . 0.0 100.977 176.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -44.21 123.89 3.67 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 124.926 1.391 . . . . 0.0 112.251 -176.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -121.93 -174.93 2.99 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 113.318 -1.764 . . . . 0.0 108.933 -175.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . 0.525 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -71.8 147.88 46.8 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 176.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 3.7 m -75.29 158.72 83.5 Favored Pre-proline 0 C--N 1.313 -1.018 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.6 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 29.2 Cg_exo -54.75 -21.49 25.66 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.916 2.411 . . . . 0.0 114.428 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 5.7 p -74.27 -49.44 23.15 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.78 0.8 . . . . 0.0 109.31 175.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . 0.525 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 32.6 mt-10 -65.36 -30.01 70.79 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.295 -1.32 . . . . 0.0 110.666 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' A' ' 964' ' ' PRO . 71.4 mt -67.49 111.74 4.29 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.284 0.634 . . . . 0.0 109.557 176.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.2 p -116.55 168.51 10.11 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -171.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.538 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 5.8 p -96.86 121.9 58.17 Favored Pre-proline 0 N--CA 1.44 -0.973 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.369 175.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.658 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 28.9 Cg_endo -82.8 175.56 8.56 Favored 'Trans proline' 0 C--O 1.242 0.686 0 C-N-CA 123.92 3.08 . . . . 0.0 111.198 178.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.86 111.05 0.85 Allowed 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 122.15 1.9 . . . . 0.0 111.645 176.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.627 ' HA3' HG23 ' A' 1034 ' ' THR . . . 108.69 -3.54 32.32 Favored Glycine 0 N--CA 1.431 -1.653 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.852 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.658 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 97.3 m95 -120.4 122.62 41.15 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 122.405 1.098 . . . . 0.0 112.688 -178.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.566 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 7.5 tp10 -108.18 123.18 48.34 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 126.953 2.101 . . . . 0.0 111.599 -172.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 24.0 m95 -78.95 105.84 10.55 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.699 172.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . 0.46 ' CD ' ' HE3' ' A' 1028 ' ' LYS . 38.9 mt-10 -73.4 -43.94 59.46 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 121.581 0.705 . . . . 0.0 109.663 175.083 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.02 146.18 54.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.466 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -76.62 -32.11 57.84 Favored 'General case' 0 C--N 1.318 -0.785 0 O-C-N 123.462 0.476 . . . . 0.0 110.84 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -163.43 157.23 19.62 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.655 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 27.1 m95 -72.93 113.22 9.72 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 177.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 18.8 m -120.45 150.36 40.93 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 -172.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' A' 1022 ' ' ARG . 0.3 OUTLIER -74.2 126.57 30.9 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.688 0.756 . . . . 0.0 110.727 -175.675 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -83.03 143.19 30.78 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-N 113.516 -1.675 . . . . 0.0 111.041 -167.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 15.6 pt -133.66 23.45 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.942 0.877 . . . . 0.0 109.38 176.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . 0.417 ' O ' ' HD3' ' A' ' 986' ' ' ARG . 3.4 t-20 -96.12 13.94 25.55 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 178.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.417 ' HD3' ' O ' ' A' ' 985' ' ' ASN . 1.0 OUTLIER -134.02 177.46 7.72 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 114.243 -1.344 . . . . 0.0 107.414 -175.071 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -88.27 82.17 7.14 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.926 0.869 . . . . 0.0 109.471 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.504 HG12 ' HG2' ' A' ' 994' ' ' GLU . 15.4 m -138.49 164.64 26.29 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 114.147 -1.388 . . . . 0.0 109.373 -177.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -55.44 169.98 0.26 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.923 0.489 . . . . 0.0 110.494 171.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -58.61 -30.92 67.6 Favored 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 121.911 -0.493 . . . . 0.0 111.664 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . 0.507 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 48.1 mttm -98.67 9.86 42.37 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 119.414 -0.915 . . . . 0.0 110.868 178.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.69 -13.98 65.28 Favored Glycine 0 C--O 1.226 -0.357 0 CA-C-N 116.724 -0.217 . . . . 0.0 112.646 174.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.507 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 85.1 m95 -51.54 130.97 29.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.844 0.83 . . . . 0.0 112.718 178.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.504 ' HG2' HG12 ' A' ' 988' ' ' VAL . 29.5 mt-10 -107.96 155.79 19.93 Favored 'General case' 0 C--O 1.251 1.148 0 C-N-CA 124.042 0.937 . . . . 0.0 109.413 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.66 ' HB3' ' H ' ' A' 1009 ' ' VAL . 26.2 t80 -81.08 96.72 7.25 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 112.456 -2.156 . . . . 0.0 110.216 -177.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . 0.402 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -121.86 106.06 1.05 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 118.863 -1.637 . . . . 0.0 111.86 174.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.517 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -111.0 151.1 13.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 O-C-N 120.931 -1.335 . . . . 0.0 108.484 178.539 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 5.2 m -127.69 103.3 7.23 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 176.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 62.9 mt -80.64 123.42 82.61 Favored Pre-proline 0 C--N 1.318 -0.803 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 176.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.43 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 25.1 Cg_endo -61.84 142.16 92.52 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.462 2.108 . . . . 0.0 112.938 -178.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . 0.43 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 11.1 Cg_endo -96.87 145.96 6.24 Favored 'Cis proline' 0 N--CA 1.452 -0.938 0 C-N-CA 123.366 -1.514 . . . . 0.0 113.636 -2.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 6.6 t70 168.28 -179.54 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 104.435 -2.431 . . . . 0.0 104.435 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -132.37 -33.86 1.25 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 118.861 0.755 . . . . 0.0 112.074 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 79.3 mttt -112.8 132.51 22.25 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -177.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.42 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 52.1 Cg_exo -59.61 134.31 57.04 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 123.179 2.586 . . . . 0.0 109.99 168.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . 0.402 ' HE2' ' HB3' ' A' 1006 ' ' LYS . 12.6 ptpt -116.94 15.86 15.16 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 122.434 1.112 . . . . 0.0 109.196 -177.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 41.9 t -148.01 137.81 22.51 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 113.948 -1.478 . . . . 0.0 108.235 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.617 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 56.5 m95 -136.17 137.34 40.82 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.66 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 47.0 t -143.21 178.65 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 N-CA-C 104.183 -2.525 . . . . 0.0 104.183 -173.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . 0.51 ' H ' HG12 ' A' 1009 ' ' VAL . . . -99.83 4.34 45.16 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 120.072 1.305 . . . . 0.0 112.657 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -86.59 -168.29 2.18 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 121.736 -0.602 . . . . 0.0 112.294 -178.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.542 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.4 OUTLIER -159.39 106.8 1.75 Allowed 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.735 0.778 . . . . 0.0 108.954 -174.739 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.44 ' H ' ' CE1' ' A' 1016 ' ' HIS . 98.2 mttt -113.55 148.32 36.34 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.761 -178.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 51.7 ttp -47.67 -39.14 16.49 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 124.146 0.904 . . . . 0.0 112.158 176.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -61.37 -0.35 0.37 Allowed 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.542 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 2.9 m80 -61.83 118.95 7.86 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 178.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . 0.536 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 25.4 p -104.79 -18.45 14.25 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.736 174.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 5.1 m80 -140.93 151.18 44.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.9 -177.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -156.94 151.88 26.0 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 170.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.453 ' HB3' ' OD1' ' A' ' 937' ' ' ASN . 6.1 ptp180 -151.26 163.84 37.96 Favored 'General case' 0 C--O 1.187 -2.199 0 C-N-CA 118.886 -1.126 . . . . 0.0 109.567 175.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.566 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 25.6 ptt180 -141.75 148.62 39.29 Favored 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.919 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.519 ' O ' ' HA ' ' A' ' 982' ' ' TYR . 41.3 ttm180 -90.42 122.11 32.99 Favored 'General case' 0 N--CA 1.44 -0.933 0 O-C-N 123.525 0.515 . . . . 0.0 111.684 -178.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.655 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 83.6 mt -91.58 129.59 37.53 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 106.009 -1.849 . . . . 0.0 106.009 166.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . . . . . . . . . 8.0 m -112.16 137.45 44.86 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 CA-C-O 122.219 1.009 . . . . 0.0 111.518 -177.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.464 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 6.3 tpt180 -137.06 101.32 4.52 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 113.1 -1.863 . . . . 0.0 108.278 171.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.493 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.0 OUTLIER -82.1 148.9 28.3 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.632 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 11.5 ptm180 -144.07 179.24 7.33 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 104.915 -2.254 . . . . 0.0 104.915 -171.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.861 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 15.8 ptpt -162.17 160.71 27.45 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 175.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.544 ' HA ' ' O ' ' A' ' 972' ' ' GLY . 35.6 ttmt -87.81 -16.47 34.01 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-O 123.027 1.394 . . . . 0.0 107.758 -177.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 22.7 t70 55.46 16.56 1.85 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 112.019 -2.355 . . . . 0.0 110.661 -172.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 37.8 tp 62.51 -56.62 0.14 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.583 1.553 . . . . 0.0 112.26 -172.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 11.6 p -87.1 0.61 54.99 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 -172.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.566 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 47.6 mt-30 -76.04 -17.53 59.62 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 118.16 -1.416 . . . . 0.0 110.302 174.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . 0.627 HG23 ' HA3' ' A' ' 972' ' ' GLY . 12.4 p -100.08 131.73 45.86 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 171.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -72.2 100.2 2.52 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 174.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 49.3 m -135.13 -31.31 1.0 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.168 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 10.1 m -79.33 108.63 12.99 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 5.1 p -91.7 158.19 16.52 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.054 -173.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -107.35 -31.66 8.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.308 -177.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . 0.558 ' HA ' ' NE ' ' A' 1040 ' ' ARG . 1.0 OUTLIER . . . . . 0 C--O 1.242 0.69 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.634 -178.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 35.9 pt . . . . . 0 N--CA 1.471 0.588 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . 0.772 ' HB2' ' HB ' ' A' ' 922' ' ' THR . 14.7 m-20 -140.54 151.86 64.77 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 -178.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -55.81 -55.15 3.2 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.978 2.452 . . . . 0.0 113.672 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -97.02 -26.65 14.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.037 0.446 . . . . 0.0 109.991 -176.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . 0.772 ' HB ' ' HB2' ' A' ' 919' ' ' ASP . 4.2 m -90.22 35.33 0.86 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 122.079 0.942 . . . . 0.0 109.37 176.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -72.17 -34.14 68.24 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.107 176.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -109.12 125.09 51.79 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.702 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -110.74 15.32 21.99 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.781 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 117.26 59.0 0.3 Allowed Glycine 0 CA--C 1.498 -1.019 0 C-N-CA 120.329 -0.939 . . . . 0.0 111.795 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.482 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 42.2 m-70 -117.54 -138.11 0.36 Allowed 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 106.155 -1.795 . . . . 0.0 106.155 176.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -168.58 116.98 0.7 Allowed 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 169.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -137.58 129.77 29.21 Favored 'General case' 0 C--N 1.288 -2.07 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 174.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -121.55 138.12 54.44 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.59 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 31.3 m -77.84 122.34 25.32 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 175.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -96.56 175.02 6.55 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.68 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.6 pt-20 -168.83 143.72 3.24 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.497 0.665 . . . . 0.0 110.958 -171.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.595 HG22 ' H ' ' A' ' 935' ' ' TYR . 13.0 p -135.47 -177.61 2.08 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 173.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.595 ' H ' HG22 ' A' ' 934' ' ' VAL . 87.3 m-85 -137.27 146.18 44.42 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 118.862 0.755 . . . . 0.0 109.09 -178.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' A' 1020 ' ' ARG . 30.9 tt0 -116.81 118.05 31.42 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 -179.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 -109.18 142.33 40.13 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-O 122.141 0.972 . . . . 0.0 111.536 -175.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.561 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 62.0 mt-10 -128.95 162.57 27.26 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 170.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 38.1 m -146.89 152.75 39.2 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.978 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.444 ' O ' ' HA ' ' A' 1017 ' ' THR . 25.9 ptt180 -149.45 159.84 43.95 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 114.947 -1.024 . . . . 0.0 108.876 177.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -75.82 161.71 74.82 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 170.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . 0.404 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 23.0 Cg_exo -66.42 92.91 0.29 Allowed 'Trans proline' 0 N--CA 1.458 -0.586 0 N-CA-C 109.169 -1.127 . . . . 0.0 109.169 171.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 119.68 11.03 7.38 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -172.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . 0.408 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -109.45 -174.07 21.01 Favored Glycine 0 CA--C 1.498 -0.988 0 N-CA-C 108.203 -1.959 . . . . 0.0 108.203 176.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -120.97 159.26 25.97 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 105.561 -2.014 . . . . 0.0 105.561 170.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.561 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 43.0 m95 -71.07 125.96 28.29 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-O 121.428 0.633 . . . . 0.0 111.374 -172.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -114.9 172.54 3.53 Favored Pre-proline 0 C--N 1.299 -1.607 0 N-CA-C 102.634 -3.099 . . . . 0.0 102.634 170.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -54.73 147.66 49.01 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 CA-C-N 121.649 1.624 . . . . 0.0 111.848 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -69.35 -170.06 0.25 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.777 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.47 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.0 OUTLIER -98.21 -29.01 13.45 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 -179.221 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -120.53 88.15 2.88 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 103.765 -2.68 . . . . 0.0 103.765 173.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 20.5 m -62.03 -51.97 65.87 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.004 -172.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . 0.47 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 79.8 m-85 -103.31 133.9 47.61 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 119.551 -0.86 . . . . 0.0 111.097 177.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 72.7 p -142.91 174.77 10.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.48 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -109.81 -173.48 2.27 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.84 -36.19 36.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 114.044 1.128 . . . . 0.0 114.044 -174.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -101.34 11.13 39.79 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 92.78 0.18 69.31 Favored Glycine 0 CA--C 1.497 -1.042 0 C-N-CA 119.53 -1.319 . . . . 0.0 111.578 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -56.82 104.11 0.14 Allowed 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 174.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . 0.473 ' HD3' ' C ' ' A' ' 960' ' ' LYS . 7.8 tmtm? -49.52 118.5 2.8 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 124.158 0.911 . . . . 0.0 108.887 176.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -121.71 176.0 5.95 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.13 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -66.32 149.9 49.68 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 123.638 0.586 . . . . 0.0 110.661 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 15.6 m -85.38 156.73 59.44 Favored Pre-proline 0 N--CA 1.437 -1.119 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.511 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.3 Cg_exo -48.16 -32.81 19.85 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.397 3.398 . . . . 0.0 116.636 -173.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 12.6 p -75.81 -45.33 36.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.461 1.124 . . . . 0.0 109.437 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -65.2 -27.26 68.56 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.037 -1.892 . . . . 0.0 110.585 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.476 HD13 ' CH2' ' A' ' 980' ' ' TRP . 33.1 mt -71.49 120.6 17.31 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.061 0.944 . . . . 0.0 110.371 175.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 26.1 p -125.07 170.94 10.68 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.979 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . . . . . . . . . 6.6 p -82.87 148.53 57.52 Favored Pre-proline 0 C--N 1.315 -0.925 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.998 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.581 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 20.0 Cg_endo -91.6 165.75 3.42 Favored 'Trans proline' 0 C--O 1.239 0.568 0 C-N-CA 123.004 2.469 . . . . 0.0 111.267 174.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.11 108.33 1.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 121.709 1.606 . . . . 0.0 110.579 174.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.616 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 118.93 1.71 14.45 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 120.908 -0.663 . . . . 0.0 111.859 -177.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.581 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 90.1 m95 -137.43 137.54 38.87 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 122.2 1.0 . . . . 0.0 111.161 177.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.594 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 9.4 tp10 -118.23 143.23 46.71 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 113.155 -1.839 . . . . 0.0 106.115 -174.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.523 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 98.7 m95 -83.53 153.77 24.2 Favored 'General case' 0 C--N 1.296 -1.736 0 O-C-N 120.693 -1.255 . . . . 0.0 110.418 171.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -121.55 -42.2 2.45 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . 0.756 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 1.6 m-20 -77.05 155.83 32.22 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.432 178.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -75.81 -56.72 4.41 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -171.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -156.54 147.88 22.37 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -175.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.511 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 17.6 m95 -61.39 120.43 10.45 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 124.167 0.917 . . . . 0.0 109.295 -172.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . 0.648 ' O ' ' HA ' ' A' 1023 ' ' LEU . 42.4 m -111.63 -166.69 1.1 Allowed 'General case' 0 C--O 1.201 -1.45 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 -175.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 17.6 p90 -109.82 154.34 23.13 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 119.825 1.193 . . . . 0.0 112.208 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' 1022 ' ' ARG . 9.0 t70 -99.89 131.57 45.78 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.672 -171.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 30.8 pt -119.87 28.32 3.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 122.209 1.004 . . . . 0.0 109.011 173.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -106.4 24.35 12.69 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 123.012 1.387 . . . . 0.0 108.963 -175.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.401 HH21 ' CD ' ' A' ' 994' ' ' GLU . 38.5 mtp85 -139.5 -177.61 5.02 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -83.93 80.76 9.05 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 172.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.904 HG12 ' HG2' ' A' ' 994' ' ' GLU . 29.2 m -135.97 156.14 36.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.352 -170.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.37 170.14 0.16 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.956 170.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -52.62 -34.18 49.93 Favored 'General case' 0 CA--C 1.498 -1.02 0 C-N-CA 123.479 0.711 . . . . 0.0 111.239 176.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . 0.445 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 84.5 mttt -98.35 2.97 48.54 Favored 'General case' 0 N--CA 1.422 -1.842 0 CA-C-N 114.924 -1.035 . . . . 0.0 111.947 -176.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 100.67 -16.08 57.94 Favored Glycine 0 C--O 1.223 -0.576 0 C-N-CA 121.27 -0.49 . . . . 0.0 111.888 178.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.738 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 71.3 m95 -55.8 116.61 3.04 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -178.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.904 ' HG2' HG12 ' A' ' 988' ' ' VAL . 5.0 mt-10 -99.76 155.44 17.64 Favored 'General case' 0 C--O 1.257 1.451 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.432 176.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.521 ' HD2' ' HB3' ' A' 1011 ' ' ALA . 21.9 t80 -69.47 102.67 1.85 Allowed 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 129.015 2.926 . . . . 0.0 110.829 -178.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -124.13 122.41 4.8 Favored Glycine 0 CA--C 1.503 -0.659 0 C-N-CA 119.33 -1.414 . . . . 0.0 111.876 172.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.973 ' HB ' ' HD2' ' A' 1016 ' ' HIS . 1.3 tt -133.24 139.57 48.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 O-C-N 121.663 -0.904 . . . . 0.0 109.291 -179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 35.0 m -132.61 116.81 17.13 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.405 ' HA ' ' HD2' ' A' 1000 ' ' PRO . 12.2 pt -114.18 97.38 45.39 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-O 121.188 0.518 . . . . 0.0 111.891 -175.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 999' ' ' ILE . 18.7 Cg_endo -58.88 132.98 50.77 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.632 2.888 . . . . 0.0 114.415 -175.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -79.59 146.02 75.26 Favored 'Cis proline' 0 N--CA 1.454 -0.835 0 C-N-CA 122.743 -1.774 . . . . 0.0 112.015 -0.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 6.2 t70 -153.53 -159.91 1.05 Allowed 'General case' 0 C--N 1.293 -1.878 0 CA-C-N 113.873 -1.512 . . . . 0.0 107.91 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -138.0 -57.67 0.66 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.248 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 63.0 mttp -165.26 155.69 12.09 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 102.837 -3.023 . . . . 0.0 102.837 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -60.53 122.0 10.61 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 CA-C-N 121.758 1.664 . . . . 0.0 109.244 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 46.7 pttt -83.78 -7.51 59.45 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.566 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 9.6 t -144.01 135.22 25.62 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -174.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.597 ' HE3' ' HB2' ' A' ' 994' ' ' GLU . 42.6 m95 -134.24 135.39 42.91 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 125.436 1.71 . . . . 0.0 106.405 175.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.51 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 2.6 m -162.9 -174.01 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 -174.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -97.4 104.74 16.78 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . 0.521 ' HB3' ' HD2' ' A' ' 995' ' ' TYR . . . -178.25 -176.96 0.55 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -175.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.517 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.2 OUTLIER -174.63 118.03 0.2 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.805 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 46.9 mttp -132.37 153.4 50.81 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.421 -172.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 23.0 ttt -53.03 -44.03 67.03 Favored 'General case' 0 C--N 1.315 -0.918 0 O-C-N 124.607 1.192 . . . . 0.0 113.38 -177.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . 0.404 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 54.0 m-85 -68.47 9.63 0.33 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.973 ' HD2' ' HB ' ' A' ' 997' ' ' ILE . 22.0 m170 -69.72 175.65 4.1 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.908 0.861 . . . . 0.0 112.233 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . 0.444 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 1.1 m -155.75 -42.0 0.08 Allowed 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 -169.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 16.7 m170 -132.02 144.31 50.68 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.49 -174.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.738 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 42.7 ttp180 -151.92 146.09 25.36 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 5.5 ptp180 -156.15 165.48 36.28 Favored 'General case' 0 C--O 1.198 -1.627 0 C-N-CA 117.575 -1.65 . . . . 0.0 110.824 178.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.582 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 29.4 ptt180 -144.38 151.36 39.17 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.792 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.68 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 36.2 ttm180 -83.7 129.76 34.95 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.648 ' HA ' ' O ' ' A' ' 981' ' ' SER . 72.9 mt -98.95 128.22 45.05 Favored 'General case' 0 N--CA 1.414 -2.275 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 167.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.522 HG13 ' HB2' ' A' ' 983' ' ' ASP . 1.4 m -104.76 145.1 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.828 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.503 -171.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.756 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -156.22 114.08 3.29 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 124.999 1.437 . . . . 0.0 111.299 168.001 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.8 tmmm? -82.09 144.83 30.52 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 -176.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.523 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 6.3 ptm180 -135.79 137.89 42.04 Favored 'General case' 0 C--O 1.209 -1.036 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 -172.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.562 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 30.2 ttmt -123.08 137.85 54.82 Favored 'General case' 0 C--N 1.284 -2.258 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.012 -171.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.639 ' C ' ' H ' ' A' 1031 ' ' LEU . 36.8 ttmt -89.1 -21.14 23.53 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-O 123.228 1.49 . . . . 0.0 108.26 -177.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 21.5 t70 66.67 -22.91 0.1 Allowed 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 111.927 -2.397 . . . . 0.0 112.28 -169.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . 0.639 ' H ' ' C ' ' A' 1029 ' ' LYS . 27.6 tp 88.46 -25.34 0.08 Allowed 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 129.029 2.932 . . . . 0.0 110.899 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 34.4 p -74.77 -16.35 60.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.307 0.575 . . . . 0.0 111.363 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.594 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 98.0 mt-30 -78.92 -7.57 58.11 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.459 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . 0.433 HG21 ' HD3' ' A' 1029 ' ' LYS . 24.6 p -122.74 110.56 15.64 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.243 178.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -74.53 110.18 8.61 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 176.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 17.4 t -88.19 -18.58 28.39 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.378 0.609 . . . . 0.0 109.579 -177.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 36.8 t -104.58 150.15 24.89 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.405 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 11.7 t -107.85 -1.83 20.45 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -87.33 117.22 25.95 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.398 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 . . . . . 0 C--N 1.313 -1.0 0 CA-C-O 117.899 -1.048 . . . . 0.0 109.393 179.621 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 2.7 pp . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . 0.48 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 16.1 t70 -73.98 123.47 89.3 Favored Pre-proline 0 C--O 1.236 0.389 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 174.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 16.7 Cg_exo -68.99 123.31 10.22 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 123.099 2.533 . . . . 0.0 113.654 -174.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -85.77 -11.1 54.38 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 113.725 -1.579 . . . . 0.0 109.277 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 34.1 m -149.13 100.85 3.09 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.323 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -109.67 93.4 4.48 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 106.058 -1.83 . . . . 0.0 106.058 174.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . 0.522 ' HA ' ' CD2' ' A' ' 927' ' ' HIS . 23.5 t70 -104.71 116.7 32.49 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -169.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -111.75 17.21 20.07 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.581 173.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 109.58 66.18 0.56 Allowed Glycine 0 N--CA 1.437 -1.237 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 -177.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.522 ' CD2' ' HA ' ' A' ' 924' ' ' ASP . 56.9 m-70 -107.75 -147.92 0.41 Allowed 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 175.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.6 m -161.2 124.43 3.25 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 102.804 -3.035 . . . . 0.0 102.804 168.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.473 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.4 OUTLIER -153.25 145.96 24.29 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 178.639 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -141.14 143.7 34.42 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.637 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 25.7 m -74.15 125.71 28.97 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 177.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -101.36 156.78 17.25 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 105.085 -2.191 . . . . 0.0 105.085 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.475 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.0 pt-20 -147.77 152.48 37.79 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.448 -174.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.499 HG11 ' HG3' ' A' ' 964' ' ' PRO . 12.2 p -141.95 174.76 5.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.503 ' HA ' ' O ' ' A' 1021 ' ' ARG . 68.6 m-85 -135.61 150.39 49.65 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.524 ' O ' ' HA ' ' A' 1020 ' ' ARG . 36.8 tt0 -126.18 127.53 45.85 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -178.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . 0.96 ' HB3' ' HG2' ' A' 1020 ' ' ARG . 0.0 OUTLIER -137.92 152.23 48.78 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 -177.05 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.642 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 46.3 mt-10 -135.22 161.05 36.48 Favored 'General case' 0 C--O 1.245 0.834 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 178.065 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . 0.495 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 17.9 p -133.36 147.92 51.83 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.143 0.497 . . . . 0.0 111.336 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.474 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 21.6 ptt180 -149.02 161.44 41.91 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.81 158.38 69.69 Favored Pre-proline 0 C--N 1.315 -0.921 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 171.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . 0.456 ' HG3' HG22 ' A' 1017 ' ' THR . 24.5 Cg_exo -62.78 92.32 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 121.345 1.363 . . . . 0.0 110.259 174.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 97.0 70.58 1.03 Allowed Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 108.974 -1.65 . . . . 0.0 108.974 -176.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -160.5 -131.24 1.2 Allowed Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.102 -175.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -137.42 131.07 31.45 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.547 -0.827 . . . . 0.0 111.047 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.642 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 36.1 m95 -78.92 149.98 32.22 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-O 121.512 0.672 . . . . 0.0 110.485 -177.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -137.84 166.06 29.07 Favored Pre-proline 0 C--N 1.305 -1.352 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 171.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -49.31 127.95 19.04 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 CA-C-N 121.262 1.486 . . . . 0.0 110.285 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . 0.495 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -47.78 -51.7 21.46 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 124.725 1.266 . . . . 0.0 111.613 -174.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 163.33 -35.37 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 178.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . 0.433 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 15.6 m-20 -132.13 102.27 5.73 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 174.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . 0.437 ' O ' ' HA ' ' A' ' 936' ' ' GLN . 24.1 m -68.96 -46.2 68.76 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -172.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . 0.419 ' CE1' ' HB2' ' A' ' 936' ' ' GLN . 59.7 m-85 -104.79 130.57 52.87 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.874 0.845 . . . . 0.0 110.591 175.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 5.0 p -145.02 173.09 12.19 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.264 -1.334 . . . . 0.0 111.017 -166.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . 0.509 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 11.3 t70 -97.72 170.74 8.79 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 175.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.49 -27.95 7.52 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 119.548 1.067 . . . . 0.0 113.67 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -95.39 2.19 54.5 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 98.07 -3.87 60.5 Favored Glycine 0 CA--C 1.497 -1.049 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.845 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . 0.509 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 38.6 t70 -51.74 108.41 0.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 O-C-N 124.388 0.699 . . . . 0.0 110.308 176.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . 0.433 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 51.8 tptt -47.14 111.1 0.36 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.537 1.148 . . . . 0.0 109.076 172.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -120.96 -179.91 4.17 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.604 -174.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -74.75 146.63 42.01 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 13.6 m -76.16 156.82 83.73 Favored Pre-proline 0 C--N 1.313 -1.011 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.567 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 53.1 Cg_exo -50.91 -25.13 15.14 Favored 'Trans proline' 0 N--CA 1.487 1.101 0 C-N-CA 123.537 2.825 . . . . 0.0 115.407 -177.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 9.3 p -71.3 -49.47 42.46 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.861 0.839 . . . . 0.0 108.993 176.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -66.2 -28.15 68.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.699 175.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.479 HD12 ' HA ' ' A' ' 964' ' ' PRO . 67.7 mt -66.46 110.72 3.24 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 10.6 p -126.27 -179.95 4.98 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.891 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.678 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 24.0 p -94.65 124.92 53.44 Favored Pre-proline 0 C--N 1.308 -1.239 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.689 178.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.626 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 80.3 Cg_endo -78.53 162.84 27.38 Favored 'Trans proline' 0 C--N 1.336 -0.118 0 C-N-CA 123.197 2.598 . . . . 0.0 110.461 178.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -59.45 100.91 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 121.66 1.574 . . . . 0.0 110.942 174.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.654 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 127.34 -3.57 7.2 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -176.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.678 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 94.7 m95 -141.21 145.98 36.33 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 122.68 0.392 . . . . 0.0 110.307 177.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.57 ' HB2' ' NE2' ' A' 1033 ' ' GLN . 5.5 tp10 -131.69 157.57 43.41 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 126.004 1.722 . . . . 0.0 106.41 -175.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.644 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 98.4 m95 -90.34 148.05 23.09 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 120.468 -1.395 . . . . 0.0 112.691 170.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -113.2 -43.82 3.33 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 178.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . 0.474 ' HB3' ' NE ' ' A' 1025 ' ' ARG . 69.4 m-20 -78.22 161.19 27.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.788 -177.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -84.18 -57.48 3.16 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 115.186 1.551 . . . . 0.0 115.186 -176.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -155.77 142.69 18.99 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 121.408 -0.808 . . . . 0.0 110.404 -170.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.567 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 15.4 m95 -66.84 130.49 43.33 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.118 0.485 . . . . 0.0 109.97 -173.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . 0.443 ' O ' ' HA ' ' A' 1023 ' ' LEU . 62.3 m -128.67 166.39 19.01 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 -179.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 20.4 p90 -74.41 142.55 44.98 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -178.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.526 ' HB2' HG13 ' A' 1024 ' ' VAL . 31.9 t0 -97.96 122.03 40.6 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.024 -177.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.2 pp -114.46 22.66 5.65 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.385 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -97.98 27.44 4.52 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.526 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 50.6 mtp180 -141.78 -177.16 5.06 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 -173.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.31 84.89 6.97 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 175.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 16.8 m -141.1 157.21 22.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.477 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -53.06 169.45 0.1 Allowed 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.773 172.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -55.33 -34.17 63.98 Favored 'General case' 0 CA--C 1.507 -0.675 0 C-N-CA 123.061 0.544 . . . . 0.0 112.439 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -98.68 11.85 37.26 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.418 0.628 . . . . 0.0 110.008 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 69.85 81.27 0.24 Allowed Glycine 0 N--CA 1.431 -1.654 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.243 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.509 ' CE3' ' HD2' ' A' 1019 ' ' ARG . 99.5 m95 -148.13 131.53 16.63 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 176.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.687 ' HG2' ' O ' ' A' 1020 ' ' ARG . 6.4 pt-20 -108.02 150.88 26.58 Favored 'General case' 0 C--O 1.248 1.0 0 CA-C-O 121.611 0.719 . . . . 0.0 112.493 -177.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.693 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -74.67 94.63 2.72 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 112.556 -2.111 . . . . 0.0 111.329 -173.339 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -110.88 101.37 1.34 Allowed Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 120.33 -0.938 . . . . 0.0 111.272 177.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.492 HD12 ' HB3' ' A' 1015 ' ' TYR . 0.7 OUTLIER -110.19 133.19 56.34 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.055 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.792 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 8.7 m -118.61 97.05 5.54 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 120.608 0.242 . . . . 0.0 110.357 -177.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.444 ' O ' HD12 ' A' ' 999' ' ' ILE . 2.4 pp -81.41 133.59 53.01 Favored Pre-proline 0 C--N 1.319 -0.724 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.764 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 51.5 Cg_endo -70.55 143.36 46.8 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.825 2.35 . . . . 0.0 113.736 -175.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 9.3 Cg_endo -93.7 143.86 9.01 Favored 'Cis proline' 0 N--CA 1.451 -1.009 0 C-N-CA 123.057 -1.643 . . . . 0.0 112.198 -3.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 2.7 t70 170.0 167.28 0.06 Allowed 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 113.342 -1.754 . . . . 0.0 107.718 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 13.9 p-80 -142.24 33.49 1.51 Allowed 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.845 0.355 . . . . 0.0 110.148 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -163.5 124.74 1.5 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.426 -175.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.562 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 51.5 Cg_exo -63.79 126.29 17.13 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 121.525 1.484 . . . . 0.0 109.445 166.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 55.2 pttt -107.21 7.71 29.58 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.949 0.88 . . . . 0.0 109.188 -178.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 31.0 t -144.28 138.03 27.65 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.421 -1.263 . . . . 0.0 108.651 -177.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.593 ' CE3' ' HG3' ' A' ' 994' ' ' GLU . 66.9 m95 -133.72 140.24 46.88 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 98.4 t -139.34 152.86 23.65 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -78.86 100.32 7.13 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 175.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . 0.563 ' HB3' ' HD2' ' A' ' 995' ' ' TYR . . . 177.19 -174.2 0.12 Allowed 'General case' 0 C--O 1.235 0.293 0 O-C-N 123.876 0.735 . . . . 0.0 110.588 -171.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.696 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.3 OUTLIER -172.34 104.52 0.17 Allowed 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 106.491 -1.67 . . . . 0.0 106.491 177.61 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.479 ' H ' ' CE1' ' A' 1016 ' ' HIS . 21.9 mttp -141.66 166.93 23.39 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 112.852 -1.976 . . . . 0.0 110.283 -170.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 55.6 ttp -49.95 -47.34 52.62 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -173.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . 0.492 ' HB3' HD12 ' A' ' 997' ' ' ILE . 33.2 m-85 -62.25 -0.89 0.61 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.696 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 15.3 m80 -59.28 111.05 1.22 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 118.55 0.613 . . . . 0.0 112.229 175.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . 0.456 HG22 ' HG3' ' A' ' 942' ' ' PRO . 42.1 p -96.32 -28.63 14.4 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 123.478 1.609 . . . . 0.0 107.525 174.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 7.2 m170 -139.3 156.26 47.16 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 112.658 -2.064 . . . . 0.0 109.348 -178.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.509 ' HD2' ' CE3' ' A' ' 993' ' ' TRP . 38.0 ptt180 -149.93 145.76 26.67 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 171.016 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.96 ' HG2' ' HB3' ' A' ' 937' ' ' ASN . 53.9 mtp180 -144.09 167.4 22.46 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.503 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 22.3 ptt180 -157.38 154.48 28.96 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.611 174.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.526 ' NH1' ' HD2' ' A' ' 986' ' ' ARG . 35.8 ttm180 -90.31 133.27 35.07 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 123.604 0.565 . . . . 0.0 109.775 178.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.531 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 71.9 mt -102.12 130.76 48.81 Favored 'General case' 0 N--CA 1.421 -1.909 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 165.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.526 HG13 ' HB2' ' A' ' 983' ' ' ASP . 1.8 m -106.35 145.09 14.56 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.354 -174.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.748 ' NE ' ' HA ' ' A' 1025 ' ' ARG . 0.6 OUTLIER -158.99 115.99 2.73 Favored 'General case' 0 C--N 1.31 -1.146 0 O-C-N 125.218 1.574 . . . . 0.0 113.017 168.233 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.8 tmmm? -76.29 142.38 41.34 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.204 0.526 . . . . 0.0 109.765 -177.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.644 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 11.2 ptm180 -130.69 144.52 51.49 Favored 'General case' 0 CA--C 1.497 -1.076 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -173.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 58.5 tttt -134.02 135.3 43.29 Favored 'General case' 0 C--N 1.286 -2.157 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.191 -167.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.654 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 34.6 ttmt -84.58 -20.26 31.77 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 123.473 1.606 . . . . 0.0 107.362 179.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . 0.453 ' H ' ' HG2' ' A' 1028 ' ' LYS . 24.6 t70 61.95 -17.71 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 111.246 -2.706 . . . . 0.0 113.555 -171.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . 0.611 ' H ' ' C ' ' A' 1029 ' ' LYS . 18.5 tp 81.25 -10.54 1.19 Allowed 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 128.43 2.692 . . . . 0.0 110.621 -178.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 17.6 p -87.69 -3.5 58.96 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.384 0.612 . . . . 0.0 111.394 -177.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.57 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 80.3 mt-30 -93.8 7.77 43.62 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.691 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 7.0 t -160.09 155.47 25.24 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -178.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -115.58 -43.37 3.04 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.426 0.632 . . . . 0.0 109.386 175.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 45.3 t -144.38 -29.46 0.48 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.985 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 48.7 m -150.47 -174.64 4.82 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.862 -0.524 . . . . 0.0 110.389 -176.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 17.2 m -60.11 -53.88 52.48 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.089 0.471 . . . . 0.0 110.688 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -91.66 6.73 44.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.16 0.505 . . . . 0.0 110.991 -178.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 . . . . . 0 C--N 1.322 -0.629 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -178.752 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.471 0.58 0 N-CA-C 110.688 -0.116 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . 0.442 ' HB2' ' HD3' ' A' ' 920' ' ' PRO . 7.2 m-20 -107.09 -56.25 0.06 OUTLIER Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . 0.442 ' HD3' ' HB2' ' A' ' 919' ' ' ASP . 11.0 Cg_exo -70.07 154.3 66.65 Favored 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 123.562 2.841 . . . . 0.0 112.914 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -91.5 -37.75 12.96 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 113.994 -1.457 . . . . 0.0 108.873 179.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 11.6 t -115.13 105.15 12.59 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 176.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -122.96 138.45 54.68 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.365 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -91.21 145.42 24.68 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.319 0.58 . . . . 0.0 112.243 -175.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -139.84 22.66 2.46 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 176.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 103.31 66.96 0.74 Allowed Glycine 0 N--CA 1.438 -1.195 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.848 -173.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.518 ' HB3' ' HA ' ' A' 1030 ' ' ASP . 6.1 m-70 -131.81 160.85 34.41 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 176.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.87 127.26 48.77 Favored 'General case' 0 N--CA 1.42 -1.971 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 162.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.56 ' HG2' ' HE2' ' A' 1026 ' ' LYS . 0.0 OUTLIER -138.48 149.66 45.64 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 104.853 -2.277 . . . . 0.0 104.853 171.715 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.414 ' O ' ' HG2' ' A' 1027 ' ' ARG . 72.1 t80 -154.48 138.65 16.53 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 -174.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 45.4 m -79.77 132.82 36.25 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -110.04 156.88 19.94 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 178.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.449 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.0 pt-20 -154.21 159.48 41.37 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 121.282 0.563 . . . . 0.0 111.118 -173.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.641 ' O ' ' HA ' ' A' 1022 ' ' ARG . 8.8 p -147.96 179.6 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 176.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.568 ' H ' HG22 ' A' ' 934' ' ' VAL . 77.9 m-85 -139.97 118.51 12.25 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 118.468 0.576 . . . . 0.0 110.418 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.473 ' O ' ' HA ' ' A' 1020 ' ' ARG . 47.3 mt-30 -78.46 122.47 25.87 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 170.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . 0.506 ' HB3' ' HB3' ' A' ' 949' ' ' ALA . 24.5 m-80 -117.5 143.24 46.26 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 123.338 0.655 . . . . 0.0 112.049 -176.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.67 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 52.4 mt-10 -136.18 150.76 49.16 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 174.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . 0.482 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 31.8 p -134.85 146.63 49.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 117.895 0.316 . . . . 0.0 111.72 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.536 ' HG2' ' CE3' ' A' ' 946' ' ' TRP . 25.0 ptt180 -153.3 161.33 42.48 Favored 'General case' 0 N--CA 1.438 -1.038 0 C-N-CA 124.156 0.982 . . . . 0.0 108.685 -178.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -68.71 153.21 96.16 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 172.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . 0.485 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 70.2 Cg_exo -55.49 97.97 0.06 OUTLIER 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 121.893 1.729 . . . . 0.0 111.219 174.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 93.88 66.99 1.05 Allowed Glycine 0 N--CA 1.435 -1.374 0 N-CA-C 107.849 -2.101 . . . . 0.0 107.849 -175.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -159.01 -155.68 7.73 Favored Glycine 0 N--CA 1.434 -1.485 0 C-N-CA 120.138 -1.03 . . . . 0.0 113.145 -176.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -116.47 131.23 57.0 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 113.541 -1.329 . . . . 0.0 110.032 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.67 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 48.1 m95 -79.9 154.21 28.49 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.407 0.622 . . . . 0.0 110.609 -175.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -136.53 173.96 5.0 Favored Pre-proline 0 C--N 1.306 -1.284 0 N-CA-C 103.806 -2.665 . . . . 0.0 103.806 173.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.63 128.9 32.3 Favored 'Trans proline' 0 C--N 1.346 0.436 0 CA-C-N 121.522 1.579 . . . . 0.0 109.47 173.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . 0.506 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . . . -71.51 37.58 0.06 Allowed 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.849 1.426 . . . . 0.0 114.849 -175.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 85.18 -57.45 0.09 Allowed 'General case' 0 CA--C 1.474 -1.948 0 C-N-CA 125.274 1.43 . . . . 0.0 107.981 174.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -119.04 101.56 8.11 Favored 'General case' 0 N--CA 1.401 -2.903 0 N-CA-C 104.393 -2.447 . . . . 0.0 104.393 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.2 m -64.05 -57.76 8.7 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.085 0.241 . . . . 0.0 111.545 -172.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -98.35 126.3 43.82 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 37.5 p -149.66 -178.23 6.33 Favored 'General case' 0 C--O 1.246 0.896 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -172.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -105.33 -177.15 3.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 175.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.16 -31.63 32.29 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.27 -41.46 20.15 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 129.5 -2.07 6.09 Favored Glycine 0 CA--C 1.498 -0.974 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.887 177.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.43 104.36 0.62 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 114.626 -0.787 . . . . 0.0 109.181 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . 0.414 ' HD3' ' N ' ' A' ' 961' ' ' ALA . 9.3 tmtt? -48.87 120.14 3.66 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.414 ' N ' ' HD3' ' A' ' 960' ' ' LYS . . . -125.39 -172.45 2.59 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.653 -175.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . 0.458 ' CB ' ' HG ' ' A' ' 967' ' ' LEU . . . -62.16 140.89 58.41 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 121.902 0.858 . . . . 0.0 111.35 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . 0.491 ' O ' ' HB2' ' A' ' 967' ' ' LEU . 15.0 m -102.47 162.64 19.61 Favored Pre-proline 0 N--CA 1.43 -1.466 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -176.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.606 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 5.2 Cg_endo -51.23 -37.95 60.35 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.733 2.289 . . . . 0.0 114.249 -177.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 25.5 p -79.91 -47.46 15.02 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 121.906 -0.496 . . . . 0.0 111.03 175.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . 0.483 ' HB2' ' H ' ' A' ' 963' ' ' SER . 45.2 mt-10 -65.65 -8.23 19.39 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.491 ' HB2' ' O ' ' A' ' 963' ' ' SER . 1.0 OUTLIER -102.02 112.49 25.15 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 -175.322 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.91 155.5 18.88 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.089 -176.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 16.0 p -76.85 126.95 85.07 Favored Pre-proline 0 C--N 1.313 -1.005 0 C-N-CA 120.169 -0.613 . . . . 0.0 109.49 174.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.637 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 52.6 Cg_endo -80.27 166.14 20.64 Favored 'Trans proline' 0 C--O 1.238 0.479 0 C-N-CA 122.886 2.39 . . . . 0.0 111.363 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.82 102.8 0.21 Allowed 'Trans proline' 0 C--O 1.24 0.585 0 C-N-CA 121.84 1.694 . . . . 0.0 110.266 173.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.661 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 121.63 3.47 10.18 Favored Glycine 0 N--CA 1.429 -1.8 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.383 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.637 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 93.5 m95 -138.57 137.62 37.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.96 0.886 . . . . 0.0 112.177 177.094 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.632 ' HB3' ' O ' ' A' 1028 ' ' LYS . 3.5 tp10 -122.0 137.2 54.89 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.163 -1.38 . . . . 0.0 108.262 -175.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.618 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 80.9 m95 -81.07 100.41 9.0 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 120.996 -1.065 . . . . 0.0 110.48 175.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . 0.462 ' HB3' ' HB3' ' A' 1028 ' ' LYS . 8.4 pt-20 -75.9 -31.54 59.24 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 177.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -78.07 146.43 35.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.387 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.59 -46.38 66.45 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -166.75 156.41 11.22 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.437 0.637 . . . . 0.0 111.596 -173.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.71 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 37.7 m95 -70.75 119.63 15.18 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.422 -0.808 . . . . 0.0 108.822 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 19.6 m -125.35 148.51 48.72 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -175.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . 0.53 ' HA ' ' O ' ' A' 1022 ' ' ARG . 7.2 p90 -73.68 135.85 43.75 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 119.251 0.932 . . . . 0.0 110.284 -175.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.588 ' OD2' ' HD3' ' A' ' 986' ' ' ARG . 12.5 t70 -88.21 126.34 35.1 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 114.423 -1.262 . . . . 0.0 111.048 -172.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.467 ' HA ' HG21 ' A' ' 988' ' ' VAL . 2.3 pp -121.01 16.19 6.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.471 -179.092 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . 0.514 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 16.7 t-20 -90.36 16.89 7.94 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.848 -177.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.588 ' HD3' ' OD2' ' A' ' 983' ' ' ASP . 5.0 mpt_? -141.47 -175.86 4.52 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -175.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -73.85 84.21 1.68 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.286 0.565 . . . . 0.0 110.812 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.528 HG12 ' HG2' ' A' ' 994' ' ' GLU . 17.9 m -141.13 -171.89 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -104.0 -172.7 2.15 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -58.36 -35.44 71.95 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.734 0.778 . . . . 0.0 111.829 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . 0.413 ' HA ' ' CE2' ' A' ' 982' ' ' TYR . 80.4 mttt -106.75 9.1 31.19 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.363 -176.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 102.72 -121.55 7.2 Favored Glycine 0 C--O 1.205 -1.701 0 N-CA-C 105.691 -2.964 . . . . 0.0 105.691 -174.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.601 ' H ' ' HB3' ' A' 1021 ' ' ARG . 42.9 m95 52.72 99.4 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 173.075 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.528 ' HG2' HG12 ' A' ' 988' ' ' VAL . 26.2 mt-10 -98.6 148.95 23.28 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.69 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.62 ' HB3' ' H ' ' A' 1009 ' ' VAL . 19.9 t80 -65.79 96.65 0.3 Allowed 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 127.059 2.144 . . . . 0.0 111.098 177.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -118.93 102.89 0.96 Allowed Glycine 0 N--CA 1.444 -0.825 0 C-N-CA 119.255 -1.45 . . . . 0.0 111.975 174.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.443 HG22 ' HD2' ' A' 1016 ' ' HIS . 0.1 OUTLIER -108.71 143.24 19.37 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 O-C-N 119.951 -1.911 . . . . 0.0 107.563 178.447 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . 0.493 ' OG1' ' HG3' ' A' 1005 ' ' PRO . 7.9 m -138.92 127.97 23.84 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.7 mp -100.37 97.95 7.17 Favored Pre-proline 0 C--N 1.313 -0.99 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.26 140.85 38.02 Favored 'Trans proline' 0 C--O 1.238 0.478 0 C-N-CA 122.607 2.204 . . . . 0.0 114.071 -173.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -80.89 155.98 84.18 Favored 'Cis proline' 0 CA--C 1.512 -0.575 0 C-N-CA 123.177 -1.593 . . . . 0.0 110.857 -2.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' 1003 ' ' HIS . 21.1 t70 -159.18 -133.84 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.336 -174.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . 0.424 ' H ' ' CG ' ' A' 1002 ' ' ASP . 5.8 p-80 -158.37 -45.09 0.06 Allowed 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 122.999 0.52 . . . . 0.0 111.25 -174.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 61.1 tttt -167.26 145.67 4.18 Favored Pre-proline 0 N--CA 1.448 -0.543 0 C-N-CA 119.651 -0.819 . . . . 0.0 108.793 -173.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.493 ' HG3' ' OG1' ' A' ' 998' ' ' THR . 52.1 Cg_exo -64.55 124.61 13.53 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 121.058 1.172 . . . . 0.0 109.724 167.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 57.8 pttt -70.64 -59.42 2.84 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 34.3 t -97.38 150.59 20.83 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 120.594 0.235 . . . . 0.0 111.179 -177.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.518 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 53.0 m95 -137.37 145.55 43.43 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 125.113 1.508 . . . . 0.0 107.454 175.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.62 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 10.8 m -161.92 -155.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 -177.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -103.14 -36.34 8.16 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 119.553 1.07 . . . . 0.0 113.104 -174.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -61.22 108.88 0.98 Allowed 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -168.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.444 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 4.9 tp10 -66.58 118.04 9.61 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 172.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.447 ' HD3' ' CZ ' ' A' 1015 ' ' TYR . 83.1 mttt -122.18 155.92 34.8 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.747 -174.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 23.7 ttt -55.88 -47.66 76.97 Favored 'General case' 0 CA--C 1.503 -0.864 0 O-C-N 123.951 0.782 . . . . 0.0 111.593 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . 0.485 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 31.6 p90 -75.09 28.07 0.09 Allowed 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.083 -0.647 . . . . 0.0 112.66 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.579 ' CE1' ' HA ' ' A' ' 995' ' ' TYR . 9.0 m170 -82.54 116.81 22.13 Favored 'General case' 0 C--N 1.316 -0.883 0 O-C-N 121.731 -0.606 . . . . 0.0 110.61 173.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 4.4 m -93.2 -28.99 15.94 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 123.088 1.423 . . . . 0.0 107.561 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . 0.415 ' CD2' ' HB3' ' A' ' 939' ' ' SER . 31.2 m80 -139.19 156.83 46.83 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 113.383 -1.735 . . . . 0.0 110.68 -176.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -156.37 150.74 25.53 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 105.75 -1.945 . . . . 0.0 105.75 169.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.473 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 4.9 ptp180 -149.99 163.65 37.56 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 118.267 -1.373 . . . . 0.0 110.86 176.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.601 ' HB3' ' H ' ' A' ' 993' ' ' TRP . 21.9 ptt180 -143.36 142.3 31.23 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.911 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.641 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 33.0 ttm180 -82.3 129.19 34.8 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.112 -178.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.71 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 97.0 mt -102.16 133.65 46.68 Favored 'General case' 0 N--CA 1.427 -1.609 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 166.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.536 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 13.8 m -111.11 138.99 37.09 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.009 -176.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.49 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 13.8 tpt180 -138.56 110.28 7.12 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.543 170.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.56 ' HE2' ' HG2' ' A' ' 929' ' ' GLU . 2.2 tmtp? -69.63 147.02 51.21 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.618 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 9.8 ptm180 -140.71 129.49 23.04 Favored 'General case' 0 C--O 1.201 -1.496 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -177.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.632 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 36.0 ttmt -121.55 135.5 55.01 Favored 'General case' 0 C--N 1.275 -2.661 0 CA-C-N 115.373 -0.831 . . . . 0.0 108.849 -174.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 35.5 ttmt -84.59 -23.54 29.57 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 123.709 1.719 . . . . 0.0 107.058 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . 0.518 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 16.7 t70 61.77 -5.24 0.15 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 110.811 -2.904 . . . . 0.0 111.62 -169.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . 0.563 ' H ' ' C ' ' A' 1029 ' ' LYS . 36.7 tp 74.56 -34.33 0.27 Allowed 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 127.67 2.388 . . . . 0.0 111.892 -177.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 8.1 t -68.27 -15.46 63.58 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -175.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.483 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 93.4 mt-30 -72.27 -34.46 68.23 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.429 -0.509 . . . . 0.0 110.764 177.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 20.7 p -94.33 -41.06 9.63 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-O 121.02 0.438 . . . . 0.0 110.121 178.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -99.58 79.75 2.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 22.9 t -92.71 95.57 9.64 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 3.4 p -80.87 158.58 25.29 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.146 -177.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 59.0 p 61.25 -74.01 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.524 1.93 . . . . 0.0 114.038 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -112.24 145.37 40.06 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.702 0.287 . . . . 0.0 110.657 -176.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 . . . . . 0 C--N 1.318 -0.798 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.822 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 41.1 pt . . . . . 0 C--O 1.241 0.622 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . 0.442 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 32.3 m-20 -130.32 136.98 29.83 Favored Pre-proline 0 C--N 1.316 -0.864 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 27.5 Cg_exo -68.87 95.87 0.5 Allowed 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.511 2.14 . . . . 0.0 112.02 178.154 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -73.29 -23.17 60.26 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.849 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 25.9 m -70.65 -16.46 62.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.239 176.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . 61.12 -159.38 0.32 Allowed 'General case' 0 C--O 1.243 0.738 0 C-N-CA 123.625 0.77 . . . . 0.0 109.536 -177.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -76.33 170.54 16.15 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 176.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . 73.23 153.75 0.14 Allowed 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.831 1.252 . . . . 0.0 110.531 -171.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 82.28 14.89 75.61 Favored Glycine 0 CA--C 1.491 -1.439 0 N-CA-C 109.86 -1.296 . . . . 0.0 109.86 -175.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.456 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 46.1 m-70 -123.61 -140.35 0.31 Allowed 'General case' 0 N--CA 1.421 -1.913 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 176.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.09 115.73 0.97 Allowed 'General case' 0 N--CA 1.413 -2.314 0 N-CA-C 101.495 -3.52 . . . . 0.0 101.495 172.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -142.22 132.08 24.32 Favored 'General case' 0 C--N 1.274 -2.686 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 177.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -128.69 140.43 51.75 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -177.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.64 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 38.7 m -70.64 126.72 30.4 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -96.35 166.36 11.75 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -161.07 149.31 15.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-O 121.204 0.526 . . . . 0.0 110.719 -172.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.571 ' O ' ' HA ' ' A' 1022 ' ' ARG . 14.8 p -145.33 175.07 2.69 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 176.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.606 ' CD2' ' HD3' ' A' 1020 ' ' ARG . 75.8 m-85 -135.62 151.47 50.28 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.495 ' O ' ' HA ' ' A' 1020 ' ' ARG . 13.0 tt0 -123.2 118.09 26.84 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 178.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -106.82 141.11 38.58 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.831 0.824 . . . . 0.0 111.121 -174.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 67.5 mt-10 -136.65 157.66 46.25 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 175.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 40.7 t -144.69 141.63 29.45 Favored 'General case' 0 N--CA 1.426 -1.632 0 CA-C-O 121.073 0.463 . . . . 0.0 109.997 -178.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.612 HH21 ' HB2' ' A' 1016 ' ' HIS . 21.6 ptt180 -139.03 159.61 41.73 Favored 'General case' 0 N--CA 1.435 -1.203 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 177.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -71.89 161.42 78.84 Favored Pre-proline 0 C--N 1.303 -1.452 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 170.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . 0.554 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 31.4 Cg_exo -61.84 86.16 0.1 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 121.374 1.383 . . . . 0.0 111.031 175.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 103.15 70.18 0.83 Allowed Glycine 0 N--CA 1.434 -1.484 0 N-CA-C 107.716 -2.154 . . . . 0.0 107.716 -173.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -163.62 -140.57 2.9 Favored Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 120.35 -0.929 . . . . 0.0 113.647 -175.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -127.97 122.62 32.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.702 -0.749 . . . . 0.0 111.532 -173.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.613 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 74.6 m95 -70.47 135.59 48.77 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -142.88 178.78 1.36 Allowed Pre-proline 0 C--N 1.302 -1.482 0 N-CA-C 103.073 -2.936 . . . . 0.0 103.073 -179.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.05 124.29 15.91 Favored 'Trans proline' 0 C--O 1.238 0.501 0 CA-C-N 122.735 2.012 . . . . 0.0 111.423 176.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -49.23 -49.99 40.52 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.626 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 173.88 -38.7 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 960' ' ' LYS . 46.1 m-20 -122.5 116.07 23.3 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 174.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 6.6 m -63.64 -59.51 4.51 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -174.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . 0.472 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 91.7 m-85 -110.03 135.3 51.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.788 0.328 . . . . 0.0 110.425 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . 0.434 ' HA ' ' HA ' ' A' ' 960' ' ' LYS . 58.5 p -142.74 179.91 6.72 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.55 0.691 . . . . 0.0 110.183 -171.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -98.21 174.36 6.55 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 104.911 -2.255 . . . . 0.0 104.911 172.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.54 -34.96 52.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 118.587 0.631 . . . . 0.0 110.952 174.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -86.36 -0.54 56.13 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 96.6 -10.12 66.69 Favored Glycine 0 CA--C 1.501 -0.782 0 C-N-CA 119.739 -1.219 . . . . 0.0 113.308 177.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -51.64 99.2 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 954' ' ' THR . 0.2 OUTLIER -60.36 137.9 58.06 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -177.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -134.24 -178.98 5.29 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.397 -175.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . 0.537 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -70.72 153.06 43.15 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 172.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 3.7 m -76.32 158.51 81.53 Favored Pre-proline 0 C--N 1.313 -1.017 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -178.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.596 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 53.9 Cg_exo -44.94 -31.73 5.68 Favored 'Trans proline' 0 N--CA 1.485 0.974 0 C-N-CA 124.263 3.308 . . . . 0.0 116.317 -178.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.8 t -71.61 -45.54 61.83 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . 0.537 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 35.2 mt-10 -65.19 -25.88 67.9 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.373 175.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.522 HD12 ' HA ' ' A' ' 964' ' ' PRO . 57.4 mt -71.43 112.05 7.24 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.702 0.763 . . . . 0.0 110.208 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 20.6 p -118.77 169.99 9.38 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.881 -172.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 20.3 p -83.91 129.21 59.9 Favored Pre-proline 0 N--CA 1.443 -0.781 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.646 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.614 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 53.5 Cg_endo -82.59 163.28 16.64 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.931 2.421 . . . . 0.0 110.642 177.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -59.61 104.82 0.23 Allowed 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.02 1.813 . . . . 0.0 110.657 174.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.511 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 121.19 -1.67 11.57 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.066 -177.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.614 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.4 m95 -136.81 141.57 42.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 117.256 0.528 . . . . 0.0 111.167 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 1.044 ' HB3' HE22 ' A' 1033 ' ' GLN . 2.9 pt-20 -117.94 148.37 42.25 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -177.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.54 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 85.5 m95 -84.64 98.36 10.15 Favored 'General case' 0 C--N 1.296 -1.732 0 C-N-CA 119.169 -1.013 . . . . 0.0 110.327 167.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . 0.428 ' HG2' ' HE3' ' A' 1026 ' ' LYS . 8.9 tp10 -67.83 -41.19 83.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.06 -1.427 . . . . 0.0 108.21 176.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . 0.554 ' HB3' ' NE ' ' A' 1025 ' ' ARG . 64.9 m-20 -84.1 158.68 21.32 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.842 -177.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -75.53 -63.79 1.21 Allowed 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 -175.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -154.21 144.38 22.02 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -171.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.596 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 6.8 m95 -68.4 130.06 41.76 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -173.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . 0.532 ' O ' ' HA ' ' A' 1023 ' ' LEU . 22.9 t -136.18 -175.12 3.88 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . 0.58 ' CD2' ' HA ' ' A' ' 991' ' ' LYS . 0.1 OUTLIER -77.05 151.82 35.35 Favored 'General case' 0 C--N 1.295 -1.791 0 CA-C-N 118.986 0.812 . . . . 0.0 112.179 -175.394 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.554 ' HB2' HG13 ' A' 1024 ' ' VAL . 54.0 t0 -91.0 125.5 35.82 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 172.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.3 pp -119.06 6.76 6.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . 0.548 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 67.1 t30 -93.63 18.36 10.21 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.801 0.81 . . . . 0.0 110.767 -172.066 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.548 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 5.7 mpt_? -139.86 -176.35 4.55 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -177.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -75.29 75.55 2.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.991 0.9 . . . . 0.0 110.302 176.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.601 HG12 ' HG2' ' A' ' 994' ' ' GLU . 9.7 m -143.92 152.81 15.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.169 -1.378 . . . . 0.0 108.531 -177.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -55.8 170.52 0.28 Allowed 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 123.64 0.776 . . . . 0.0 111.966 177.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -57.5 -33.39 67.98 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 121.374 0.607 . . . . 0.0 111.074 174.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . 0.58 ' HA ' ' CD2' ' A' ' 982' ' ' TYR . 81.6 mttt -96.38 6.79 48.02 Favored 'General case' 0 N--CA 1.428 -1.546 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.931 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 93.62 -14.2 65.83 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.058 175.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.571 ' CD1' ' HB2' ' A' ' 991' ' ' LYS . 74.2 m95 -50.84 135.34 24.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.199 1.0 . . . . 0.0 113.262 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.601 ' HG2' HG12 ' A' ' 988' ' ' VAL . 41.7 mt-10 -114.61 148.75 37.64 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.407 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.768 ' O ' ' HA ' ' A' 1008 ' ' TRP . 3.9 t80 -81.37 100.9 9.49 Favored 'General case' 0 C--O 1.199 -1.561 0 CA-C-N 112.985 -1.916 . . . . 0.0 108.966 -177.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -123.29 101.64 0.71 Allowed Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 119.125 -1.512 . . . . 0.0 111.895 173.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.563 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.7 OUTLIER -102.57 151.04 6.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 O-C-N 120.864 -1.374 . . . . 0.0 107.741 179.65 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 15.8 m -127.91 102.77 6.91 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 15.8 pt -86.89 112.5 47.67 Favored Pre-proline 0 C--N 1.319 -0.721 0 C-N-CA 120.08 -0.648 . . . . 0.0 110.935 174.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -70.55 147.04 56.89 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.72 2.28 . . . . 0.0 112.975 -176.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -83.6 136.04 26.13 Favored 'Cis proline' 0 N--CA 1.451 -0.999 0 C-N-CA 122.931 -1.695 . . . . 0.0 112.993 -0.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 39.3 t0 167.23 154.98 0.03 OUTLIER 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 111.524 -2.58 . . . . 0.0 105.359 -176.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -119.11 -40.9 2.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 118.704 -1.199 . . . . 0.0 112.346 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 70.2 mttt -104.29 132.15 21.24 Favored Pre-proline 0 C--N 1.31 -1.143 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -176.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.443 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 74.5 Cg_exo -56.05 125.32 18.71 Favored 'Trans proline' 0 CA--C 1.515 -0.427 0 C-N-CA 123.117 2.545 . . . . 0.0 111.019 170.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -94.43 -48.07 6.29 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 35.4 t -85.15 134.72 34.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.44 -1.255 . . . . 0.0 111.093 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.768 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 54.4 m95 -131.54 136.41 47.83 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 124.457 1.098 . . . . 0.0 108.48 176.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.769 HG12 ' H ' ' A' 1010 ' ' ALA . 11.2 t -147.32 -164.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 103.664 -2.717 . . . . 0.0 103.664 -176.245 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . 0.769 ' H ' HG12 ' A' 1009 ' ' VAL . . . -114.98 12.16 16.69 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 120.381 1.446 . . . . 0.0 111.755 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -88.08 -166.36 1.57 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -177.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.44 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 8.5 tp10 -158.74 105.96 1.84 Allowed 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -175.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.545 ' O ' ' HB2' ' A' 1016 ' ' HIS . 56.5 mtpt -111.69 151.44 28.88 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 177.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . 0.405 ' C ' ' H ' ' A' 1016 ' ' HIS . 50.8 ttp -53.24 -37.54 62.17 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 123.881 0.738 . . . . 0.0 111.013 175.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . 0.554 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 97.8 m-85 -69.2 16.08 0.06 Allowed 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 177.009 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.612 ' HB2' HH21 ' A' ' 940' ' ' ARG . 0.2 OUTLIER -79.54 115.91 19.44 Favored 'General case' 0 CA--C 1.499 -1.019 0 O-C-N 121.906 -0.496 . . . . 0.0 110.981 176.309 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 10.9 p -95.95 -27.03 15.35 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.701 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -139.15 153.82 48.0 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.693 -1.139 . . . . 0.0 111.648 -175.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 39.0 ptt180 -156.73 151.26 25.55 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 170.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.606 ' HD3' ' CD2' ' A' ' 935' ' ' TYR . 2.7 ptp180 -149.4 165.21 32.76 Favored 'General case' 0 C--O 1.193 -1.871 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 175.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.594 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.3 ptt180 -145.06 148.03 33.23 Favored 'General case' 0 C--N 1.285 -2.229 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.699 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.571 ' HA ' ' O ' ' A' ' 934' ' ' VAL . 41.2 ttm180 -89.4 122.52 32.69 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.532 ' HA ' ' O ' ' A' ' 981' ' ' SER . 78.0 mt -98.27 125.68 43.46 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 103.706 -2.701 . . . . 0.0 103.706 168.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.554 HG13 ' HB2' ' A' ' 983' ' ' ASP . 2.5 m -106.5 151.16 8.57 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.069 -173.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.772 ' NE ' ' HA ' ' A' 1025 ' ' ARG . 0.5 OUTLIER -159.09 110.08 2.05 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 125.427 1.705 . . . . 0.0 112.614 169.421 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.64 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 3.2 tmmm? -78.21 146.86 34.72 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.398 0.618 . . . . 0.0 109.409 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.54 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 6.0 ptm180 -135.75 146.96 48.21 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 -171.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.456 ' O ' ' HG2' ' A' ' 974' ' ' GLU . 34.3 ttmt -129.94 136.27 49.28 Favored 'General case' 0 C--O 1.193 -1.873 0 O-C-N 123.429 0.456 . . . . 0.0 110.573 -172.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 38.7 ttmt -85.82 -22.3 27.69 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 123.466 1.603 . . . . 0.0 107.668 -176.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 9.3 t70 56.98 12.17 1.15 Allowed 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 111.431 -2.622 . . . . 0.0 110.044 -171.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . 0.456 ' HB2' ' HA ' ' A' ' 927' ' ' HIS . 22.6 tp 69.24 -52.1 0.6 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.635 1.974 . . . . 0.0 111.659 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 10.3 t -69.44 -10.08 56.43 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -173.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 1.044 HE22 ' HB3' ' A' ' 974' ' ' GLU . 76.2 mt-30 -77.81 -11.12 59.85 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.255 177.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . 0.5 ' OG1' ' HD3' ' A' 1029 ' ' LYS . 58.4 p -120.31 137.34 54.31 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 175.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -120.81 140.12 52.17 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 17.1 m -76.47 -38.66 55.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 122.011 0.91 . . . . 0.0 109.013 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 61.2 p -139.71 111.95 7.62 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-N 114.902 -1.045 . . . . 0.0 110.277 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 28.5 m -91.36 -30.71 16.39 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.599 -1.259 . . . . 0.0 107.599 175.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -68.57 -66.95 0.51 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.528 177.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 . . . . . 0 C--O 1.24 0.553 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.235 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 8.5 tp . . . . . 0 N--CA 1.466 0.34 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . 0.43 ' HA ' ' HD3' ' A' ' 920' ' ' PRO . 45.3 m-20 79.12 113.31 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 124.336 1.054 . . . . 0.0 111.135 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 919' ' ' ASP . 4.7 Cg_exo -83.21 25.35 0.69 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 123.902 3.068 . . . . 0.0 112.921 179.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -134.12 -156.66 0.75 Allowed 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 105.846 -1.909 . . . . 0.0 105.846 178.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.8 98.97 0.14 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 118.263 0.483 . . . . 0.0 110.003 173.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -78.19 85.14 4.37 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.421 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -78.51 108.35 11.82 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.286 -174.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -151.38 31.97 0.58 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.176 -1.374 . . . . 0.0 109.555 -178.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 84.76 23.46 49.8 Favored Glycine 0 CA--C 1.493 -1.33 0 C-N-CA 121.05 -0.595 . . . . 0.0 113.407 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -86.69 -32.15 20.64 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 173.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . 0.483 ' HB ' ' HB3' ' A' 1029 ' ' LYS . 1.5 m 63.39 90.97 0.08 Allowed 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.799 -169.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -135.95 129.11 31.67 Favored 'General case' 0 N--CA 1.42 -1.94 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 173.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.452 ' O ' ' HG2' ' A' 1027 ' ' ARG . 70.8 t80 -122.62 139.86 53.46 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -178.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.564 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 9.0 m -76.01 121.14 22.31 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -99.54 157.38 16.49 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 -175.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.672 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 0.0 OUTLIER -159.06 156.29 28.97 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 119.433 1.015 . . . . 0.0 111.668 -175.489 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.476 HG11 HD11 ' A' ' 967' ' ' LEU . 20.3 m -145.99 142.71 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 174.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.486 ' CG ' ' HD3' ' A' 1020 ' ' ARG . 98.5 m-85 -101.15 113.67 26.92 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 120.861 -1.149 . . . . 0.0 111.516 178.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.561 ' HB3' ' CE2' ' A' ' 953' ' ' TYR . 3.8 pt20 -81.41 137.01 35.72 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 171.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . 0.884 ' HB3' ' HB3' ' A' 1020 ' ' ARG . 0.0 OUTLIER -140.56 163.23 33.41 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -175.2 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.657 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 43.2 mt-10 -136.67 161.35 36.17 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 113.334 -1.757 . . . . 0.0 107.422 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 19.6 m -138.46 147.61 43.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 120.7 0.286 . . . . 0.0 111.143 179.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.594 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 16.2 ptt180 -156.07 162.47 40.28 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 123.59 0.756 . . . . 0.0 109.756 -173.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -60.33 162.43 10.86 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 171.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -67.96 78.37 0.57 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.071 1.848 . . . . 0.0 112.32 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 105.28 74.31 0.94 Allowed Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 108.533 -1.827 . . . . 0.0 108.533 -175.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -165.41 -150.1 6.11 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.236 -176.109 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -101.28 130.02 47.35 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.991 -0.604 . . . . 0.0 110.07 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.657 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 45.6 m95 -82.79 139.67 33.42 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 177.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -117.52 163.79 22.28 Favored Pre-proline 0 C--N 1.292 -1.932 0 N-CA-C 101.279 -3.6 . . . . 0.0 101.279 171.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.22 149.02 47.07 Favored 'Trans proline' 0 C--O 1.238 0.49 0 CA-C-N 121.456 1.556 . . . . 0.0 110.353 175.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.14 -171.07 0.1 Allowed 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.161 0.505 . . . . 0.0 110.787 177.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.26 -38.61 30.58 Favored 'General case' 0 CA--C 1.476 -1.885 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -117.94 99.01 6.63 Favored 'General case' 0 N--CA 1.397 -3.085 0 N-CA-C 103.804 -2.665 . . . . 0.0 103.804 -178.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 27.3 m -61.5 -50.35 73.09 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 123.342 0.401 . . . . 0.0 111.365 -172.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . 0.561 ' CE2' ' HB3' ' A' ' 936' ' ' GLN . 81.4 m-85 -101.83 132.44 47.59 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 18.4 p -142.73 177.22 8.47 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 123.393 0.677 . . . . 0.0 110.835 -171.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -104.97 171.17 7.46 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 171.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.88 -37.44 52.25 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 118.971 0.805 . . . . 0.0 110.159 174.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -73.23 -10.19 59.51 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 95.07 -7.79 69.78 Favored Glycine 0 CA--C 1.5 -0.872 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.15 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -58.7 105.76 0.34 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -47.01 124.0 5.89 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.54 178.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -115.76 168.54 9.95 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.903 -176.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -71.6 157.0 38.75 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.882 177.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.1 m -89.08 149.9 44.1 Favored Pre-proline 0 N--CA 1.435 -1.192 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.566 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 2.8 Cg_exo -43.57 -38.51 9.0 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 125.001 3.801 . . . . 0.0 116.925 -176.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 28.4 m -74.3 -41.8 60.59 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 122.143 0.973 . . . . 0.0 109.391 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -64.57 -28.77 69.86 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.041 -1.436 . . . . 0.0 110.565 173.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.482 HD13 ' CH2' ' A' ' 980' ' ' TRP . 39.6 mt -74.08 120.17 19.29 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 121.776 0.798 . . . . 0.0 110.616 178.22 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 22.0 p -124.38 169.09 12.17 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.042 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 16.9 p -90.44 138.96 26.66 Favored Pre-proline 0 C--N 1.312 -1.054 0 C-N-CA 120.459 -0.496 . . . . 0.0 109.906 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.616 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 92.8 Cg_endo -79.2 172.38 14.81 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.912 2.408 . . . . 0.0 111.066 173.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . 0.548 ' HG3' ' HA ' ' A' 1040 ' ' ARG . 98.7 Cg_exo -45.88 -43.52 19.45 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 123.211 2.607 . . . . 0.0 114.329 178.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.965 ' HA2' ' HB3' ' A' 1033 ' ' GLN . . . -102.76 22.79 35.95 Favored Glycine 0 N--CA 1.434 -1.438 0 C-N-CA 121.478 -0.391 . . . . 0.0 113.614 -175.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.616 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 78.1 m95 -135.42 138.11 42.93 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 117.946 0.873 . . . . 0.0 110.743 172.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.602 ' HB3' ' O ' ' A' 1028 ' ' LYS . 7.3 tp10 -118.85 131.02 56.06 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 125.671 1.588 . . . . 0.0 108.315 -175.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.443 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 82.5 m95 -77.07 98.75 5.11 Favored 'General case' 0 C--N 1.306 -1.288 0 O-C-N 120.92 -1.113 . . . . 0.0 110.129 173.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -69.72 -35.15 74.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 177.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . 0.768 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 1.5 m-20 -87.22 151.43 23.17 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.383 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.65 -65.08 0.75 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -170.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -153.81 146.39 24.13 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -171.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.589 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 19.7 m95 -60.62 125.64 24.47 Favored 'General case' 0 CA--C 1.502 -0.903 0 O-C-N 124.325 1.016 . . . . 0.0 109.834 -169.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' 1023 ' ' LEU . 18.0 m -111.95 -171.74 1.9 Allowed 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 -175.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -107.26 149.36 27.85 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 119.804 1.184 . . . . 0.0 109.224 175.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.532 ' O ' HG21 ' A' ' 988' ' ' VAL . 52.4 t0 -86.59 119.72 27.13 Favored 'General case' 0 C--N 1.317 -0.815 0 O-C-N 123.206 0.316 . . . . 0.0 110.216 -175.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 24.2 pt -120.11 13.33 6.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 122.227 1.013 . . . . 0.0 108.97 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.59 18.86 6.87 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.845 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -137.22 -176.24 4.32 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.401 -178.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.83 81.17 8.66 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 172.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.532 HG21 ' O ' ' A' ' 983' ' ' ASP . 16.5 m -134.66 162.67 38.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 114.429 -1.259 . . . . 0.0 109.555 -176.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -54.7 170.27 0.17 Allowed 'General case' 0 C--O 1.239 0.551 0 O-C-N 123.976 0.798 . . . . 0.0 110.026 170.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -53.04 -34.51 56.77 Favored 'General case' 0 CA--C 1.5 -0.973 0 CA-C-O 121.993 0.902 . . . . 0.0 110.538 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . 0.469 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 26.3 mttp -103.63 11.83 35.61 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.401 -1.272 . . . . 0.0 111.607 -174.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 90.73 -13.87 64.59 Favored Glycine 0 C--N 1.331 0.285 0 CA-C-N 116.739 -0.21 . . . . 0.0 113.483 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.634 ' CE3' ' HG2' ' A' 1019 ' ' ARG . 97.7 m95 -51.9 146.78 7.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.566 0.698 . . . . 0.0 112.47 176.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -135.68 150.46 49.59 Favored 'General case' 0 C--O 1.252 1.198 0 CA-C-O 122.24 1.019 . . . . 0.0 112.216 -177.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.841 ' HA ' ' NE2' ' A' 1016 ' ' HIS . 50.5 t80 -80.87 93.2 6.23 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 111.792 -2.458 . . . . 0.0 112.208 -172.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . 0.612 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -118.31 93.72 0.58 Allowed Glycine 0 CA--C 1.49 -1.478 0 C-N-CA 119.44 -1.362 . . . . 0.0 111.243 177.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.571 HG22 ' HA ' ' A' 1016 ' ' HIS . 12.0 pt -103.83 148.59 8.51 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.883 0 C-N-CA 118.204 -1.399 . . . . 0.0 108.556 -178.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 11.6 t -138.72 132.21 30.4 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.355 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.3 mp -114.45 114.47 45.12 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.03 136.34 64.74 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 123.068 2.512 . . . . 0.0 113.113 -178.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -85.23 138.42 25.69 Favored 'Cis proline' 0 N--CA 1.449 -1.11 0 C-N-CA 122.774 -1.761 . . . . 0.0 113.898 1.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 7.9 t0 162.02 126.52 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 111.271 -2.695 . . . . 0.0 104.624 -179.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -85.19 -43.04 14.16 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.739 -168.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 84.7 mttt -127.14 141.34 40.42 Favored Pre-proline 0 C--N 1.309 -1.157 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.347 -174.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -50.26 127.88 21.24 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.617 2.211 . . . . 0.0 110.614 169.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 21.2 pttm -110.62 15.52 21.98 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.012 -0.995 . . . . 0.0 108.484 -177.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 42.6 t -146.95 137.13 23.46 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.448 -175.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.673 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 59.7 m95 -137.62 135.89 36.99 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 125.367 1.667 . . . . 0.0 107.085 175.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.415 ' HB ' ' HB3' ' A' ' 995' ' ' TYR . 96.5 t -144.95 165.74 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 -171.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -82.99 -2.16 54.47 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -175.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -112.23 122.09 46.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 119.018 0.826 . . . . 0.0 112.538 -174.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.435 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 52.0 tp10 -72.13 120.58 17.93 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 174.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.538 ' H ' ' CE1' ' A' 1016 ' ' HIS . 94.5 mttt -124.66 155.79 38.6 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.004 -178.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 52.3 ttp -53.12 -40.08 63.92 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 123.863 0.727 . . . . 0.0 112.554 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -52.49 -7.98 0.08 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.568 1.321 . . . . 0.0 114.568 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.841 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 13.5 m80 -57.85 154.8 11.46 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 122.53 1.157 . . . . 0.0 112.993 179.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -161.55 -33.41 0.05 OUTLIER 'General case' 0 C--N 1.294 -1.827 0 CA-C-N 111.295 -2.684 . . . . 0.0 106.599 -167.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 14.2 m80 -135.21 141.49 45.83 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.697 -1.592 . . . . 0.0 108.601 174.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.634 ' HG2' ' CE3' ' A' ' 993' ' ' TRP . 43.3 ttt180 -152.47 142.49 22.22 Favored 'General case' 0 CA--C 1.483 -1.598 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.884 ' HB3' ' HB3' ' A' ' 937' ' ' ASN . 2.5 ptp180 -150.57 167.89 25.89 Favored 'General case' 0 C--N 1.294 -1.822 0 O-C-N 124.074 0.859 . . . . 0.0 109.626 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.552 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 26.5 ptt180 -148.62 151.47 35.05 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.672 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 32.5 ttm180 -90.21 129.45 36.47 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.261 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' A' ' 981' ' ' SER . 84.8 mt -94.46 125.87 39.38 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 167.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.517 HG13 ' HB2' ' A' ' 983' ' ' ASP . 2.5 m -105.46 136.62 38.76 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.803 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.366 -174.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.768 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -144.24 109.75 5.2 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 124.641 1.213 . . . . 0.0 111.726 168.639 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.668 ' HB3' ' OD1' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -78.73 141.98 37.43 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -178.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.509 ' N ' ' HD2' ' A' 1026 ' ' LYS . 12.1 ptm180 -135.78 143.19 45.1 Favored 'General case' 0 C--O 1.201 -1.452 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -171.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.602 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.7 ttmt -125.9 138.53 53.79 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 123.606 0.566 . . . . 0.0 109.65 -175.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.666 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.7 ttmt -89.33 -22.3 22.7 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 123.285 1.517 . . . . 0.0 108.124 -178.132 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 21.6 t70 55.45 21.08 4.06 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 111.098 -2.774 . . . . 0.0 109.331 -169.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 42.8 tp 57.53 -41.54 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.849 2.059 . . . . 0.0 115.227 -174.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 9.4 t -69.15 -23.6 63.98 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 122.953 0.501 . . . . 0.0 112.32 -170.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.965 ' HB3' ' HA2' ' A' ' 972' ' ' GLY . 3.8 mt-30 -63.15 -46.21 88.24 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -175.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . 0.548 ' OG1' ' HD3' ' A' 1029 ' ' LYS . 12.2 p -75.8 -42.93 48.58 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.402 179.397 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -57.44 -44.07 84.42 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.178 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 47.4 t -79.0 -56.94 4.01 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.743 179.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 70.0 m 56.02 72.11 0.51 Allowed 'General case' 0 C--O 1.238 0.468 0 CA-C-O 122.254 1.026 . . . . 0.0 108.602 -170.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 8.2 m -83.39 -51.54 7.3 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 114.206 -1.361 . . . . 0.0 109.043 -176.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -133.79 162.28 32.43 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.143 -177.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . 0.548 ' HA ' ' HG3' ' A' ' 971' ' ' PRO . 13.6 ptt180 . . . . . 0 C--N 1.312 -1.024 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 177.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 31.6 pt . . . . . 0 N--CA 1.469 0.479 0 CA-C-O 121.692 0.758 . . . . 0.0 109.893 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -94.54 143.97 27.16 Favored Pre-proline 0 C--N 1.315 -0.915 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.623 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -62.25 -17.55 57.64 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.868 2.379 . . . . 0.0 113.487 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -123.81 98.43 5.81 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 13.0 t -156.01 -38.79 0.08 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.413 0.625 . . . . 0.0 110.534 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -113.45 30.51 7.17 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . 0.745 ' HB3' ' HD2' ' A' ' 927' ' ' HIS . 5.9 m-20 -122.84 100.51 6.94 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 111.778 -2.465 . . . . 0.0 108.915 -169.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -75.51 99.51 4.25 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.245 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 51.43 43.06 51.79 Favored Glycine 0 CA--C 1.506 -0.504 0 N-CA-C 115.582 0.993 . . . . 0.0 115.582 174.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.745 ' HD2' ' HB3' ' A' ' 924' ' ' ASP . 31.0 m-70 -98.24 -167.93 1.58 Allowed 'General case' 0 CA--C 1.493 -1.249 0 N-CA-C 105.37 -2.085 . . . . 0.0 105.37 171.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . 0.661 ' HB ' ' HB2' ' A' 1029 ' ' LYS . 1.0 OUTLIER -143.72 120.01 10.89 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 102.132 -3.285 . . . . 0.0 102.132 168.442 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.521 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.0 OUTLIER -142.16 168.36 19.92 Favored 'General case' 0 C--N 1.272 -2.783 0 C-N-CA 118.865 -1.134 . . . . 0.0 110.797 -178.375 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.642 ' O ' ' HG2' ' A' 1027 ' ' ARG . 54.7 t80 -157.19 124.7 5.31 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.638 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 17.8 m -75.42 126.85 31.84 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 118.897 0.771 . . . . 0.0 109.617 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -104.72 159.18 15.99 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 -177.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.491 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 12.4 pt-20 -153.42 145.01 23.31 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -174.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.469 HG22 ' H ' ' A' ' 935' ' ' TYR . 12.0 p -139.5 172.89 12.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.198 0 N-CA-C 105.365 -2.087 . . . . 0.0 105.365 178.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.582 ' HA ' ' O ' ' A' 1021 ' ' ARG . 54.8 m-85 -132.52 138.88 47.67 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 118.7 0.682 . . . . 0.0 110.248 -174.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.616 ' O ' ' HA ' ' A' 1020 ' ' ARG . 24.3 tt0 -113.77 126.21 54.97 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 -176.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . 0.498 ' HA ' ' O ' ' A' 1019 ' ' ARG . 0.0 OUTLIER -124.25 141.31 52.17 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 122.127 0.965 . . . . 0.0 113.432 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 35.8 mt-10 -115.31 158.5 22.3 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 104.972 -2.232 . . . . 0.0 104.972 171.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 36.8 m -139.62 152.58 46.9 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 119.007 0.821 . . . . 0.0 109.846 -172.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.682 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 24.6 ptt180 -156.99 160.95 39.53 Favored 'General case' 0 N--CA 1.44 -0.953 0 O-C-N 124.548 1.155 . . . . 0.0 109.499 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -78.55 161.26 70.29 Favored Pre-proline 0 C--N 1.312 -1.038 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 170.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -63.36 87.09 0.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 121.374 1.383 . . . . 0.0 111.273 172.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.22 1.93 5.17 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -176.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . 0.611 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -100.21 -178.68 30.19 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 109.88 -1.288 . . . . 0.0 109.88 177.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -108.38 163.1 13.5 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 171.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.682 ' CZ3' ' HG2' ' A' ' 940' ' ' ARG . 53.5 m95 -83.87 137.61 33.59 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 117.901 0.318 . . . . 0.0 110.756 -173.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -129.78 139.1 34.66 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 170.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.498 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 6.8 Cg_endo -50.28 123.4 11.05 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.691 2.261 . . . . 0.0 112.777 -176.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -52.04 151.2 3.83 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -57.3 -45.97 83.64 Favored 'General case' 0 CA--C 1.484 -1.561 0 CA-C-N 114.799 -1.091 . . . . 0.0 108.453 172.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . 0.45 ' HB3' ' HG2' ' A' ' 960' ' ' LYS . 52.8 m-20 -96.4 77.12 2.97 Favored 'General case' 0 N--CA 1.414 -2.267 0 N-CA-C 105.113 -2.18 . . . . 0.0 105.113 175.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 3.9 m -63.77 -41.73 97.91 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.439 -168.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . 0.436 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 66.9 m-85 -108.74 137.73 46.21 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 122.02 0.914 . . . . 0.0 112.18 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 4.6 p -144.87 174.47 10.97 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 125.485 1.514 . . . . 0.0 108.257 -170.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -106.07 178.69 4.49 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 173.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.47 -28.35 13.02 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -93.62 -13.16 27.96 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.934 -0.479 . . . . 0.0 111.455 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 107.33 -2.95 34.82 Favored Glycine 0 CA--C 1.491 -1.461 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.099 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -58.07 107.33 0.46 Allowed 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . 0.45 ' HG2' ' HB3' ' A' ' 951' ' ' ASP . 1.1 tmtp? -47.03 119.64 2.66 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 124.556 1.16 . . . . 0.0 110.169 178.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.45 179.59 4.07 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.047 -0.978 . . . . 0.0 110.306 -175.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . 0.47 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -78.4 156.37 29.5 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.813 178.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 13.0 p -76.21 161.23 75.87 Favored Pre-proline 0 N--CA 1.437 -1.096 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 178.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -61.12 -18.28 57.17 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 122.716 2.278 . . . . 0.0 112.454 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 4.2 m -74.27 -48.83 26.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 174.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . 0.47 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 42.4 mt-10 -65.26 -37.31 86.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.499 -1.228 . . . . 0.0 112.389 177.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.47 111.0 2.14 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.236 0.541 . . . . 0.0 110.396 -177.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 73.0 p -107.24 165.36 11.43 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.863 -176.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.605 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 9.1 p -97.81 128.6 33.57 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.705 172.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.62 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 61.3 Cg_endo -71.11 169.0 21.66 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.488 2.125 . . . . 0.0 110.34 177.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -46.91 -34.78 16.96 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.125 2.55 . . . . 0.0 114.685 -178.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.544 ' O ' ' HG2' ' A' 1029 ' ' LYS . . . -101.43 8.42 56.85 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 119.943 -1.122 . . . . 0.0 112.995 -177.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.62 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 76.1 m95 -124.2 133.47 53.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.829 0.823 . . . . 0.0 110.451 179.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.546 ' HB3' ' O ' ' A' 1028 ' ' LYS . 5.5 tp10 -126.01 119.45 27.71 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 126.563 1.945 . . . . 0.0 109.569 -173.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.67 ' CE3' ' HG2' ' A' 1025 ' ' ARG . 90.2 m95 -70.35 104.56 2.73 Favored 'General case' 0 C--N 1.314 -0.966 0 O-C-N 121.416 -0.802 . . . . 0.0 111.716 -178.033 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -70.49 -38.55 74.37 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.563 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . 0.545 ' HB2' ' HG3' ' A' 1025 ' ' ARG . 83.5 m-20 -78.46 152.67 31.98 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.269 0.557 . . . . 0.0 111.811 -176.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -88.69 107.57 19.01 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 174.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . 57.13 173.04 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 123.37 1.557 . . . . 0.0 114.405 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.459 ' HA ' ' O ' ' A' 1024 ' ' VAL . 24.5 m95 -91.2 124.09 35.15 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 112.851 -1.977 . . . . 0.0 108.08 177.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 15.1 m -124.31 155.62 38.37 Favored 'General case' 0 C--O 1.206 -1.211 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -175.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' 1022 ' ' ARG . 11.0 p90 -74.46 144.68 44.1 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 119.044 0.838 . . . . 0.0 111.206 -174.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.466 ' HB3' ' HD2' ' A' 1022 ' ' ARG . 18.0 t70 -102.67 126.16 49.66 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.633 -174.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.0 pp -114.86 26.5 3.69 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.111 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -109.25 27.27 9.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 123.489 1.614 . . . . 0.0 107.31 -178.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.607 ' HG2' ' H ' ' A' ' 987' ' ' ALA . 11.3 ttt180 -141.24 -178.58 5.66 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 -178.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.607 ' H ' ' HG2' ' A' ' 986' ' ' ARG . . . -89.0 82.0 6.75 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 119.451 1.023 . . . . 0.0 109.732 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 983' ' ' ASP . 28.3 m -128.41 -172.15 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 114.337 -1.301 . . . . 0.0 109.289 -178.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -92.9 -178.8 4.93 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 177.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -57.07 -33.45 67.27 Favored 'General case' 0 CA--C 1.494 -1.181 0 C-N-CA 123.987 0.915 . . . . 0.0 111.721 179.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -108.25 17.41 22.25 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.222 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 86.13 -23.06 10.08 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.12 -0.945 . . . . 0.0 113.588 177.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.879 ' HB3' ' HD2' ' A' 1019 ' ' ARG . 79.0 m95 -56.25 111.68 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.695 0.759 . . . . 0.0 112.5 -177.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.707 ' HG3' ' CE3' ' A' 1008 ' ' TRP . 7.4 pt-20 -98.62 157.25 16.37 Favored 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 124.244 1.018 . . . . 0.0 109.944 -178.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.514 ' HB3' ' H ' ' A' 1009 ' ' VAL . 59.3 t80 -64.99 99.08 0.32 Allowed 'General case' 0 C--O 1.211 -0.953 0 CA-C-N 111.803 -2.453 . . . . 0.0 113.002 -174.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -120.9 114.93 2.75 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 119.462 -1.351 . . . . 0.0 112.573 172.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.413 ' HA ' ' H ' ' A' 1017 ' ' THR . 1.6 pt -118.57 151.84 20.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 N-CA-C 106.131 -1.803 . . . . 0.0 106.131 174.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 76.7 m -133.37 97.32 3.93 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-O 122.168 0.985 . . . . 0.0 110.589 174.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.401 ' HA ' ' HD3' ' A' 1000 ' ' PRO . 77.0 mt -97.42 115.52 65.75 Favored Pre-proline 0 C--N 1.317 -0.845 0 CA-C-N 114.014 -1.448 . . . . 0.0 109.184 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 999' ' ' ILE . 27.0 Cg_exo -60.57 141.87 96.43 Favored 'Trans proline' 0 C--O 1.241 0.649 0 C-N-CA 122.82 2.347 . . . . 0.0 112.864 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . 0.442 ' O ' ' HB2' ' A' 1002 ' ' ASP . 9.7 Cg_endo -90.41 141.13 13.37 Favored 'Cis proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.862 -1.724 . . . . 0.0 114.365 0.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . 0.442 ' HB2' ' O ' ' A' 1001 ' ' PRO . 7.8 t0 160.17 166.59 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 111.867 -2.424 . . . . 0.0 106.521 176.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -117.04 -33.63 4.66 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 174.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 33.8 mttm -105.88 134.12 19.88 Favored Pre-proline 0 N--CA 1.429 -1.507 0 CA-C-N 114.806 -1.088 . . . . 0.0 113.463 -171.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.572 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 31.7 Cg_exo -66.26 126.28 15.43 Favored 'Trans proline' 0 C--N 1.329 -0.463 0 C-N-CA 122.775 2.317 . . . . 0.0 109.782 167.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -84.03 -57.39 3.21 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 122.217 1.008 . . . . 0.0 109.409 -177.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 3.7 m -87.5 136.01 33.11 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 112.742 -2.026 . . . . 0.0 111.608 -173.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.707 ' CE3' ' HG3' ' A' ' 994' ' ' GLU . 60.4 m95 -134.65 137.2 43.42 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.514 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 11.0 m -163.11 -173.31 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -175.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -97.3 97.6 9.28 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 175.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -165.27 167.37 18.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.426 -176.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.59 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.9 tp10 -148.2 101.24 3.25 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-O 122.066 0.936 . . . . 0.0 109.553 178.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 90.4 mttt -118.0 135.92 53.85 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 113.662 -1.608 . . . . 0.0 107.363 174.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 56.8 ttp -44.87 -22.77 0.1 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -177.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -68.01 -9.03 42.5 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 178.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.59 ' CE1' ' HA ' ' A' 1012 ' ' GLU . 2.5 m80 -50.49 107.7 0.18 Allowed 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 123.754 0.821 . . . . 0.0 112.419 176.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . 0.413 ' H ' ' HA ' ' A' ' 997' ' ' ILE . 2.6 m -103.21 -21.38 13.87 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.78 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 3.5 m170 -145.54 123.3 11.9 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.576 -172.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.879 ' HD2' ' HB3' ' A' ' 993' ' ' TRP . 17.8 mmt180 -100.36 136.36 40.37 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 170.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.616 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 41.8 ttm180 -140.25 161.97 36.39 Favored 'General case' 0 C--O 1.197 -1.674 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 178.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.582 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.6 ptt180 -159.28 159.21 33.8 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 118.068 0.395 . . . . 0.0 110.257 174.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.491 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.5 ttm180 -90.6 120.99 32.13 Favored 'General case' 0 N--CA 1.424 -1.771 0 O-C-N 123.842 0.714 . . . . 0.0 109.934 177.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.405 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 65.7 mt -102.66 126.89 49.92 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 104.648 -2.352 . . . . 0.0 104.648 167.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 6.9 m -110.29 151.54 12.48 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.895 0 CA-C-O 122.032 0.92 . . . . 0.0 111.667 -175.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.67 ' HG2' ' CE3' ' A' ' 975' ' ' TRP . 0.6 OUTLIER -149.53 111.49 4.6 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 113.054 -1.884 . . . . 0.0 108.997 169.017 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 1.5 tmmm? -70.86 138.05 49.9 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.654 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 14.1 ptm180 -122.02 150.95 41.37 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 104.092 -2.559 . . . . 0.0 104.092 -173.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.546 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 71.3 tttt -144.8 132.07 20.63 Favored 'General case' 0 C--N 1.283 -2.31 0 O-C-N 123.265 0.353 . . . . 0.0 110.399 -167.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.661 ' HB2' ' HB ' ' A' ' 928' ' ' THR . 24.3 mtpp -88.58 -24.42 22.87 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 123.685 1.707 . . . . 0.0 108.049 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . 0.482 ' HB3' HG22 ' A' 1032 ' ' THR . 29.8 t0 50.21 10.25 0.05 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 110.895 -2.866 . . . . 0.0 112.742 -168.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . 0.411 ' H ' ' C ' ' A' 1029 ' ' LYS . 20.8 tp 60.15 13.68 4.01 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.053 1.741 . . . . 0.0 111.625 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . 0.482 HG22 ' HB3' ' A' 1030 ' ' ASP . 13.5 t -125.55 7.07 7.59 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 -174.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.508 ' OE1' ' HB2' ' A' ' 974' ' ' GLU . 6.0 tt0 -112.28 138.03 49.57 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.914 -177.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 6.3 t -50.19 95.66 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 -173.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -100.05 -37.84 8.81 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 169.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 16.8 m -97.14 84.9 3.59 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.198 -1.365 . . . . 0.0 108.769 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 15.6 m -79.63 -12.38 59.83 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.31 178.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 24.6 m -60.98 128.34 35.96 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.957 177.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -75.44 86.34 2.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.362 0.601 . . . . 0.0 111.134 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 . . . . . 0 C--N 1.314 -0.959 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 175.548 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.471 0.623 0 CA-C-O 120.993 0.425 . . . . 0.0 110.875 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . 0.713 ' HB3' ' HB ' ' A' ' 922' ' ' THR . 6.7 t70 -133.82 147.89 66.13 Favored Pre-proline 0 C--N 1.315 -0.902 0 N-CA-C 107.832 -1.174 . . . . 0.0 107.832 177.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -42.76 -40.54 8.07 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 123.654 2.903 . . . . 0.0 114.235 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -104.98 -41.05 5.7 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 122.246 -0.284 . . . . 0.0 110.281 177.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . 0.713 ' HB ' ' HB3' ' A' ' 919' ' ' ASP . 92.2 m -84.45 75.47 10.25 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 122.515 1.15 . . . . 0.0 109.952 177.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -80.44 -28.09 37.78 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.877 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . 0.404 ' CG ' ' H ' ' A' ' 926' ' ' GLY . 15.2 t70 -130.39 143.08 50.54 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.429 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -126.87 15.19 7.45 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.122 178.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' 1031 ' ' LEU . . . 106.6 56.35 0.64 Allowed Glycine 0 CA--C 1.496 -1.144 0 N-CA-C 110.565 -1.014 . . . . 0.0 110.565 -178.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 65.2 m-70 -105.09 -31.63 9.08 Favored 'General case' 0 CA--C 1.499 -1.008 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.735 177.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 2.9 m 60.84 85.38 0.11 Allowed 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.962 0.887 . . . . 0.0 108.784 -167.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.906 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.6 OUTLIER -104.76 165.92 10.74 Favored 'General case' 0 C--N 1.282 -2.33 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 178.225 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.574 ' O ' ' HG2' ' A' 1027 ' ' ARG . 79.2 t80 -148.45 123.56 10.13 Favored 'General case' 0 C--N 1.297 -1.679 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 -178.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 21.1 m -75.97 114.76 14.96 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 173.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -93.66 163.37 13.57 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.562 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 11.9 pt-20 -162.01 145.98 12.32 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 118.64 0.655 . . . . 0.0 110.368 -171.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 5.8 p -155.43 128.31 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.537 0.684 . . . . 0.0 111.381 172.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.653 ' HA ' ' O ' ' A' 1021 ' ' ARG . 70.1 m-85 -90.32 113.38 25.23 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.518 ' O ' ' HA ' ' A' 1020 ' ' ARG . 16.3 tt0 -79.52 128.62 33.59 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.792 171.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . 0.454 HD22 ' N ' ' A' ' 937' ' ' ASN . 0.5 OUTLIER -117.89 146.58 43.82 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 123.501 0.72 . . . . 0.0 109.907 -177.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.61 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 38.4 mt-10 -129.07 172.11 11.72 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 171.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 27.1 t -152.08 136.76 17.0 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 118.529 0.604 . . . . 0.0 110.622 -175.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.701 HH21 ' HB2' ' A' 1016 ' ' HIS . 22.4 ptt180 -136.85 159.63 41.3 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 176.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -81.21 166.92 35.56 Favored Pre-proline 0 C--N 1.308 -1.227 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 171.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . 0.453 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 15.6 Cg_exo -69.66 86.69 0.56 Allowed 'Trans proline' 0 N--CA 1.452 -0.948 0 N-CA-C 108.988 -1.197 . . . . 0.0 108.988 170.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.13 8.18 3.41 Favored Glycine 0 N--CA 1.436 -1.352 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 -173.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . 0.515 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -117.89 -179.26 17.32 Favored Glycine 0 CA--C 1.503 -0.713 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -112.02 158.28 19.74 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 119.822 1.811 . . . . 0.0 107.012 172.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.61 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 28.9 m95 -67.35 138.69 56.96 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-O 121.392 0.615 . . . . 0.0 110.798 -174.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -129.12 179.31 1.33 Allowed Pre-proline 0 C--N 1.302 -1.498 0 N-CA-C 101.412 -3.551 . . . . 0.0 101.412 174.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.9 144.48 99.57 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 CA-C-N 123.243 2.194 . . . . 0.0 111.406 177.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -66.94 -170.09 0.1 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.481 0.658 . . . . 0.0 110.818 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.518 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.0 OUTLIER -90.62 -35.74 14.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 -177.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -123.28 100.15 6.7 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 104.556 -2.387 . . . . 0.0 104.556 168.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 27.6 m -69.13 -59.45 3.02 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -173.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -96.0 128.25 42.73 Favored 'General case' 0 C--N 1.313 -0.99 0 O-C-N 121.277 -0.889 . . . . 0.0 109.719 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 18.1 p -148.89 -178.05 6.14 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.705 0.764 . . . . 0.0 111.352 -168.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -108.3 168.49 9.27 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 104.314 -2.476 . . . . 0.0 104.314 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.38 -30.88 31.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 119.153 0.888 . . . . 0.0 111.114 174.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -78.54 -8.34 58.47 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 177.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 95.07 -4.75 68.02 Favored Glycine 0 CA--C 1.501 -0.799 0 C-N-CA 120.263 -0.97 . . . . 0.0 112.224 178.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -62.08 102.25 0.27 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . 0.412 ' HD3' ' C ' ' A' ' 960' ' ' LYS . 12.5 tmtt? -50.68 122.78 7.74 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.571 1.17 . . . . 0.0 109.438 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.24 -173.2 2.41 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.317 -178.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . 0.619 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -78.9 152.94 30.89 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 177.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.3 m -79.05 157.7 75.68 Favored Pre-proline 0 C--N 1.315 -0.892 0 N-CA-C 107.435 -1.321 . . . . 0.0 107.435 178.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.582 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 7.5 Cg_exo -49.18 -24.89 8.66 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.586 2.857 . . . . 0.0 115.653 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.8 t -80.24 -43.34 21.58 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 177.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . 0.619 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 46.2 mm-40 -64.87 -32.2 73.79 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.768 175.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.484 HD13 ' CH2' ' A' ' 980' ' ' TRP . 83.6 mt -68.59 118.55 11.76 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 175.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 10.0 p -126.14 -175.39 3.35 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.126 -171.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.663 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 25.9 p -109.99 124.94 32.2 Favored Pre-proline 0 N--CA 1.435 -1.189 0 O-C-N 121.905 -0.497 . . . . 0.0 110.457 177.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.662 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 98.1 Cg_endo -77.04 173.24 14.77 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 122.908 2.405 . . . . 0.0 110.713 174.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -41.93 -48.64 6.02 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 124.271 3.314 . . . . 0.0 115.451 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.462 ' O ' ' HA ' ' A' 1029 ' ' LYS . . . -101.38 14.01 58.21 Favored Glycine 0 N--CA 1.439 -1.102 0 C-N-CA 120.141 -1.028 . . . . 0.0 113.584 -175.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.663 ' O ' ' HB2' ' A' ' 969' ' ' CYS . 88.5 m95 -119.95 121.4 38.91 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 118.437 1.118 . . . . 0.0 111.71 179.342 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.464 ' HB2' ' OE1' ' A' 1033 ' ' GLN . 7.5 tp10 -110.08 127.69 55.01 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 126.602 1.961 . . . . 0.0 109.585 -172.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -70.77 106.89 3.73 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.722 0.772 . . . . 0.0 112.393 174.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . 0.449 ' H ' ' HA ' ' A' 1027 ' ' ARG . 5.5 tp10 -72.15 -47.11 53.41 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 172.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . 0.785 ' HB3' ' NH1' ' A' 1025 ' ' ARG . 3.6 m-20 -87.41 160.6 18.26 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.704 -1.135 . . . . 0.0 112.229 -178.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -91.13 -53.32 4.41 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -168.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -148.32 132.67 17.53 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -173.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.582 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 17.1 m95 -61.11 123.1 16.69 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 123.989 0.805 . . . . 0.0 109.806 -172.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 49.8 p -122.8 156.02 35.38 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -177.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . 0.485 ' HB3' ' HD2' ' A' 1021 ' ' ARG . 0.0 OUTLIER -72.47 140.84 48.49 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.334 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.53 ' HB2' HG13 ' A' 1024 ' ' VAL . 52.6 t0 -91.16 130.5 37.04 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.832 -1.077 . . . . 0.0 111.117 -171.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 2.1 pp -115.59 14.25 7.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.501 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . 0.593 ' C ' ' HD2' ' A' ' 986' ' ' ARG . 3.5 t-20 -97.37 16.45 20.07 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.009 0.909 . . . . 0.0 109.146 -176.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.593 ' HD2' ' C ' ' A' ' 985' ' ' ASN . 7.6 mpt_? -139.87 179.75 6.42 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -175.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -76.85 86.2 3.43 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.691 0.758 . . . . 0.0 110.768 179.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . . . . . . . . . 18.2 m -125.73 -179.23 2.37 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 114.933 -1.03 . . . . 0.0 109.39 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -73.67 177.82 5.17 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -64.82 -28.14 69.36 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 118.725 0.693 . . . . 0.0 111.768 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 57.3 mttt -85.87 -57.42 3.05 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 141.08 71.79 0.03 OUTLIER Glycine 0 CA--C 1.498 -1.013 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.667 177.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -145.6 140.79 27.63 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -99.93 160.08 14.59 Favored 'General case' 0 C--O 1.252 1.235 0 CA-C-N 118.944 0.793 . . . . 0.0 109.996 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.636 ' O ' ' HA ' ' A' 1008 ' ' TRP . 21.6 t80 -83.65 99.36 10.16 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 127.412 2.285 . . . . 0.0 109.547 -176.078 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . 0.521 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -120.97 120.95 4.65 Favored Glycine 0 N--CA 1.433 -1.505 0 C-N-CA 119.005 -1.569 . . . . 0.0 110.741 175.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.566 HG22 ' HA ' ' A' 1016 ' ' HIS . 13.8 pt -127.47 143.17 41.52 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 C-N-CA 118.579 -1.248 . . . . 0.0 109.148 177.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.7 t -146.1 155.63 42.89 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 20.5 pt -116.6 107.91 45.92 Favored Pre-proline 0 C--N 1.315 -0.927 0 C-N-CA 119.931 -0.708 . . . . 0.0 110.865 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -69.13 136.6 35.11 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.497 2.131 . . . . 0.0 112.556 -178.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -87.15 150.35 38.57 Favored 'Cis proline' 0 N--CA 1.45 -1.035 0 C-N-CA 122.938 -1.692 . . . . 0.0 112.816 -1.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 25.0 t70 -165.0 -86.68 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 113.336 -1.756 . . . . 0.0 107.707 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -178.5 -81.14 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 63.3 mttm -144.19 160.42 49.06 Favored Pre-proline 0 C--N 1.317 -0.811 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.614 ' HG2' ' HB2' ' A' 1018 ' ' HIS . 36.1 Cg_exo -58.5 144.34 97.04 Favored 'Trans proline' 0 C--O 1.241 0.675 0 C-N-CA 122.433 2.089 . . . . 0.0 110.882 169.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 39.8 mmtt -98.85 -48.18 5.01 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 -177.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 3.4 m -89.06 139.14 30.76 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 111.724 -2.489 . . . . 0.0 111.406 -173.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.636 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 61.8 m95 -135.11 132.64 38.34 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 175.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 37.1 t -142.11 170.04 12.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 -169.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -90.53 97.99 11.51 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 119.619 1.099 . . . . 0.0 108.274 172.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . 0.416 ' HB3' ' CD2' ' A' ' 995' ' ' TYR . . . -177.08 177.26 1.28 Allowed 'General case' 0 C--O 1.238 0.492 0 C-N-CA 122.81 0.444 . . . . 0.0 109.862 -176.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.526 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 0.1 OUTLIER -169.48 110.62 0.46 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.242 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 76.3 mttt -122.34 150.81 41.87 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.384 -1.28 . . . . 0.0 108.756 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 24.2 ttt -53.43 -36.26 61.35 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . 0.453 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 59.7 m-85 -72.85 14.21 0.3 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.03 0.532 . . . . 0.0 111.62 -179.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.701 ' HB2' HH21 ' A' ' 940' ' ' ARG . 0.3 OUTLIER -63.45 176.38 0.84 Allowed 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 121.863 0.84 . . . . 0.0 110.12 171.032 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . 0.644 ' HA ' ' O ' ' A' ' 940' ' ' ARG . 0.7 OUTLIER -163.41 -31.04 0.04 OUTLIER 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.006 -1.452 . . . . 0.0 108.793 -168.236 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . 0.614 ' HB2' ' HG2' ' A' 1005 ' ' PRO . 59.7 m80 -145.56 155.87 43.33 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.416 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -154.66 152.52 30.06 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 105.863 -1.903 . . . . 0.0 105.863 176.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.518 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 3.8 ptp180 -151.65 165.58 33.9 Favored 'General case' 0 C--O 1.195 -1.805 0 C-N-CA 118.418 -1.313 . . . . 0.0 109.837 178.188 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.653 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 20.3 ptt180 -149.17 145.71 27.3 Favored 'General case' 0 C--N 1.289 -2.05 0 C-N-CA 119.471 -0.891 . . . . 0.0 109.64 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.562 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 35.7 ttm180 -85.91 114.99 23.26 Favored 'General case' 0 N--CA 1.424 -1.749 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.509 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 65.6 mt -84.67 123.31 30.22 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 103.603 -2.74 . . . . 0.0 103.603 167.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.53 HG13 ' HB2' ' A' ' 983' ' ' ASP . 3.3 m -102.3 149.41 6.89 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.92 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -176.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.785 ' NH1' ' HB3' ' A' ' 977' ' ' ASP . 0.0 OUTLIER -152.34 110.0 3.62 Favored 'General case' 0 C--N 1.289 -2.048 0 O-C-N 125.138 1.524 . . . . 0.0 111.542 166.558 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.437 ' HD2' ' N ' ' A' 1027 ' ' ARG . 2.7 tmmm? -84.35 146.42 27.71 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -176.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' A' ' 930' ' ' PHE . 12.2 ptm180 -142.98 179.9 6.76 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 104.643 -2.355 . . . . 0.0 104.643 -170.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.906 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 14.1 ptpt -162.56 155.58 19.83 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 118.648 0.658 . . . . 0.0 109.767 178.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 972' ' ' GLY . 33.1 ttmt -91.24 -12.56 34.86 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.166 0.984 . . . . 0.0 109.953 -172.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 33.9 t70 60.03 19.44 8.58 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.208 -1.815 . . . . 0.0 108.734 -175.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' A' ' 926' ' ' GLY . 37.3 tp 62.33 -29.46 0.08 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.865 2.066 . . . . 0.0 115.196 -179.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 13.4 t -136.41 19.87 3.14 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 119.508 1.049 . . . . 0.0 110.106 -169.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.464 ' OE1' ' HB2' ' A' ' 974' ' ' GLU . 18.5 tt0 -75.94 -20.76 57.69 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.559 0.695 . . . . 0.0 110.561 -179.027 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 1.5 m -83.57 111.0 18.7 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -57.82 122.22 12.36 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.542 0.526 . . . . 0.0 110.742 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 16.0 m -95.65 -33.81 12.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 52.4 m -114.44 127.77 56.0 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.937 176.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 20.3 m -117.49 107.89 14.86 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -99.03 172.67 7.25 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.244 -0.435 . . . . 0.0 109.94 -179.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 . . . . . 0 C--N 1.315 -0.914 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.452 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . 0.414 HD12 ' HE2' ' A' ' 921' ' ' PHE . 27.0 pt . . . . . 0 N--CA 1.473 0.685 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -94.43 154.38 40.26 Favored Pre-proline 0 C--N 1.31 -1.134 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -64.31 95.72 0.22 Allowed 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.705 2.27 . . . . 0.0 111.816 178.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . 0.414 ' HE2' HD12 ' A' ' 918' ' ' ILE . 95.4 m-85 -62.34 -41.01 98.23 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.017 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 5.7 m -101.93 -9.23 20.86 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.082 -173.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . 67.33 111.16 0.04 OUTLIER 'General case' 0 C--O 1.237 0.422 0 CA-C-O 122.023 0.916 . . . . 0.0 108.536 -172.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -91.31 101.91 14.61 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 122.129 0.966 . . . . 0.0 111.304 -173.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -102.52 -150.99 0.42 Allowed 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 171.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -77.98 79.62 1.43 Allowed Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.204 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -127.74 132.31 49.58 Favored 'General case' 0 CA--C 1.487 -1.478 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.483 176.104 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . 0.452 ' OG1' ' HB3' ' A' 1029 ' ' LYS . 0.5 OUTLIER -91.34 113.29 25.52 Favored 'General case' 0 N--CA 1.415 -2.213 0 N-CA-C 104.809 -2.293 . . . . 0.0 104.809 160.555 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.644 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.4 OUTLIER -129.28 129.62 45.14 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 176.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -121.64 135.14 54.99 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -179.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 26.0 m -71.16 123.06 21.3 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 177.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -98.54 156.53 16.74 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 104.651 -2.351 . . . . 0.0 104.651 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.799 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 13.1 pt-20 -154.93 159.21 40.26 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 118.209 0.459 . . . . 0.0 110.672 -170.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.443 HG12 ' CZ3' ' A' ' 980' ' ' TRP . 7.7 p -158.77 131.37 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 170.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.456 ' HA ' ' O ' ' A' 1021 ' ' ARG . 37.7 m-85 -82.3 150.19 27.38 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 122.284 1.04 . . . . 0.0 111.063 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.504 ' O ' ' HA ' ' A' 1020 ' ' ARG . 23.8 tt0 -126.12 125.42 42.49 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 -179.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . 0.984 ' HB3' ' HG2' ' A' 1020 ' ' ARG . 0.0 OUTLIER -124.1 145.68 49.11 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.787 0.804 . . . . 0.0 111.398 -178.392 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.594 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 18.8 mt-10 -139.13 153.3 47.96 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 105.549 -2.019 . . . . 0.0 105.549 -178.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 15.2 m -136.37 149.55 48.39 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 121.168 0.509 . . . . 0.0 111.544 -172.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.591 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 20.2 ptt180 -146.62 161.34 40.74 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 114.14 -1.391 . . . . 0.0 108.343 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -66.89 158.76 79.33 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 170.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . 0.58 ' HG3' HG23 ' A' 1017 ' ' THR . 36.9 Cg_exo -61.13 85.85 0.09 OUTLIER 'Trans proline' 0 C--O 1.237 0.458 0 CA-C-N 120.687 1.281 . . . . 0.0 110.39 172.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 110.03 73.52 0.75 Allowed Glycine 0 N--CA 1.434 -1.457 0 N-CA-C 106.74 -2.544 . . . . 0.0 106.74 -173.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -166.34 -144.89 4.25 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 119.721 -1.228 . . . . 0.0 113.65 -172.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -128.91 123.6 33.02 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.417 -0.892 . . . . 0.0 110.639 -172.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.594 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 64.3 m95 -73.84 136.44 43.48 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 -178.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -142.34 163.16 41.12 Favored Pre-proline 0 C--N 1.295 -1.763 0 N-CA-C 102.791 -3.04 . . . . 0.0 102.791 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -49.2 137.06 30.52 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.851 1.7 . . . . 0.0 113.575 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -64.38 -172.7 0.08 Allowed 'General case' 0 C--O 1.24 0.558 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.349 175.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.54 ' CD ' ' H ' ' A' ' 950' ' ' GLU . 0.1 OUTLIER -84.36 -35.91 22.86 Favored 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 -178.452 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . 0.503 ' HB3' ' HD3' ' A' ' 960' ' ' LYS . 53.4 m-20 -123.03 97.45 5.44 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 170.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 25.7 m -61.16 -49.67 76.3 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -170.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -102.73 126.17 49.74 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.026 0.917 . . . . 0.0 111.783 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 10.6 p -135.16 165.59 25.05 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.702 -174.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 24.6 t70 -91.19 170.05 10.33 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 172.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.93 -29.88 22.05 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.101 0.864 . . . . 0.0 112.635 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -96.02 13.05 28.33 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 70.67 49.39 30.32 Favored Glycine 0 CA--C 1.484 -1.898 0 C-N-CA 121.061 -0.59 . . . . 0.0 111.711 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . 0.406 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 16.8 t70 -107.73 109.43 21.02 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 103.617 -2.734 . . . . 0.0 103.617 177.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . 0.503 ' HD3' ' HB3' ' A' ' 951' ' ' ASP . 20.9 tptm -45.16 113.54 0.59 Allowed 'General case' 0 C--N 1.312 -1.027 0 O-C-N 124.6 1.188 . . . . 0.0 111.276 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -118.11 176.02 5.41 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.002 -176.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . 0.512 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -80.5 159.88 25.41 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 1.2 m -86.87 159.02 52.67 Favored Pre-proline 0 N--CA 1.433 -1.304 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.624 ' HB3' ' CD1' ' A' ' 980' ' ' TRP . 15.4 Cg_exo -46.57 -26.77 4.58 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 124.225 3.283 . . . . 0.0 115.608 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 22.9 t -71.93 -49.22 39.46 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . 0.512 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 1.5 mp0 -64.56 -33.15 75.25 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.15 0.5 . . . . 0.0 110.181 176.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.448 ' HB2' ' HA ' ' A' ' 964' ' ' PRO . 73.5 mt -64.89 110.96 2.61 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.978 0.894 . . . . 0.0 109.591 178.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.09 179.21 5.88 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.141 -173.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.508 ' HB3' ' NE1' ' A' ' 975' ' ' TRP . 25.0 p -94.74 136.87 22.65 Favored Pre-proline 0 C--N 1.321 -0.632 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.974 -176.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.601 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 44.7 Cg_endo -84.78 167.66 11.24 Favored 'Trans proline' 0 C--O 1.241 0.641 0 C-N-CA 122.977 2.452 . . . . 0.0 110.731 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . 0.595 ' HB2' ' HB2' ' A' 1035 ' ' ALA . 14.9 Cg_exo -67.01 103.96 0.79 Allowed 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 121.607 1.538 . . . . 0.0 110.289 175.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.514 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 124.59 -2.23 8.74 Favored Glycine 0 N--CA 1.438 -1.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.92 -177.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.601 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 94.5 m95 -133.98 130.75 38.08 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 122.035 0.921 . . . . 0.0 111.255 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -117.24 131.41 56.85 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 126.586 1.954 . . . . 0.0 109.602 -170.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.581 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 91.9 m95 -83.95 156.74 22.18 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.571 177.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -140.11 -36.36 0.49 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.183 -178.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -68.15 146.52 53.35 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.507 178.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -67.55 -43.63 80.22 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -177.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.73 168.51 12.43 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -176.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.624 ' CD1' ' HB3' ' A' ' 964' ' ' PRO . 45.2 m95 -70.07 118.37 12.81 Favored 'General case' 0 C--N 1.309 -1.159 0 O-C-N 124.435 1.085 . . . . 0.0 108.446 -179.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . 0.687 ' O ' ' HA ' ' A' 1023 ' ' LEU . 21.0 m -110.3 -161.0 0.73 Allowed 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 104.853 -2.277 . . . . 0.0 104.853 -173.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . 0.416 ' HB2' ' HA3' ' A' ' 992' ' ' GLY . 15.4 p90 -119.75 153.06 36.24 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 121.669 2.031 . . . . 0.0 109.697 177.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.523 ' HB2' ' HD2' ' A' 1022 ' ' ARG . 20.8 t70 -83.28 114.95 21.75 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.719 0.771 . . . . 0.0 111.063 -173.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.436 ' HA ' HG21 ' A' ' 988' ' ' VAL . 23.4 pt -107.1 -157.89 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.649 176.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 10.1 t30 49.79 44.01 24.85 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.923 1.344 . . . . 0.0 108.589 -172.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.45 ' HD3' ' CG1' ' A' ' 988' ' ' VAL . 52.4 ttt85 -153.43 -179.71 8.01 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 -172.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.409 ' H ' ' HG2' ' A' ' 986' ' ' ARG . . . -87.95 69.82 9.42 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.832 -1.174 . . . . 0.0 107.832 176.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.45 ' CG1' ' HD3' ' A' ' 986' ' ' ARG . 24.1 m -122.79 150.66 26.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.67 -1.15 . . . . 0.0 113.154 -173.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . 0.453 ' HB3' ' HB2' ' A' ' 993' ' ' TRP . 23.8 t70 -55.25 171.68 0.16 Allowed 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 113.271 -1.786 . . . . 0.0 110.751 168.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.53 -34.01 47.89 Favored 'General case' 0 CA--C 1.499 -0.991 0 C-N-CA 123.669 0.788 . . . . 0.0 111.304 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . 0.543 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 71.3 mmtt -106.46 16.92 24.07 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.347 -174.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . 0.416 ' HA3' ' HB2' ' A' ' 982' ' ' TYR . . . 93.69 -11.1 71.79 Favored Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.586 173.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.623 ' CG ' ' HD3' ' A' 1019 ' ' ARG . 97.1 m95 -59.93 153.31 21.45 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -137.49 152.38 49.47 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-N 115.238 -0.892 . . . . 0.0 112.252 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.693 ' HD2' ' HB ' ' A' 1009 ' ' VAL . 0.3 OUTLIER -62.32 99.85 0.15 Allowed 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 113.429 -1.714 . . . . 0.0 111.853 -178.267 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . 0.509 ' O ' ' HB2' ' A' 1018 ' ' HIS . . . -117.91 84.36 0.37 Allowed Glycine 0 CA--C 1.49 -1.497 0 C-N-CA 118.964 -1.589 . . . . 0.0 111.829 172.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.772 ' O ' ' HA ' ' A' 1005 ' ' PRO . 2.3 tt -92.4 131.79 38.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 O-C-N 121.581 -0.953 . . . . 0.0 109.806 -176.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 29.4 m -131.23 110.93 11.48 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 61.0 mt -117.81 119.46 33.87 Favored Pre-proline 0 C--N 1.314 -0.975 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.489 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 44.9 Cg_exo -58.53 144.62 96.88 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 122.816 2.344 . . . . 0.0 112.145 177.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . 0.421 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 12.2 Cg_endo -90.86 127.22 6.48 Favored 'Cis proline' 0 N--CA 1.445 -1.341 0 C-N-CA 123.279 -1.55 . . . . 0.0 112.805 -1.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 49.3 t0 156.8 141.7 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 110.878 -2.874 . . . . 0.0 105.84 -176.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 4.0 p80 -125.43 41.95 3.4 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 122.997 1.38 . . . . 0.0 108.7 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 59.1 mttp -138.5 139.42 24.7 Favored Pre-proline 0 N--CA 1.434 -1.257 0 CA-C-N 112.915 -1.948 . . . . 0.0 107.441 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.772 ' HA ' ' O ' ' A' ' 997' ' ' ILE . 81.5 Cg_exo -57.23 170.38 1.66 Allowed 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.234 1.956 . . . . 0.0 113.081 167.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -110.16 -46.33 3.46 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.85 -173.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 13.4 t -160.81 147.23 15.09 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -174.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . . . . . . . . . 42.8 m95 -112.83 124.33 52.36 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.693 ' HB ' ' HD2' ' A' ' 995' ' ' TYR . 46.3 t -143.88 161.62 15.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 -169.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -93.34 -1.2 56.21 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.835 0.35 . . . . 0.0 111.483 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . 0.515 ' H ' HG12 ' A' 1009 ' ' VAL . . . -101.08 116.5 32.99 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.158 0.504 . . . . 0.0 111.045 -175.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.41 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 42.9 tp10 -71.36 114.99 10.0 Favored 'General case' 0 N--CA 1.439 -1.025 0 CA-C-O 122.226 1.012 . . . . 0.0 111.033 177.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.484 ' H ' ' CE1' ' A' 1016 ' ' HIS . 66.4 mttm -120.59 147.92 44.57 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 113.985 -1.461 . . . . 0.0 108.51 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 54.8 ttp -51.13 -37.43 46.08 Favored 'General case' 0 C--N 1.307 -1.28 0 O-C-N 124.091 0.869 . . . . 0.0 112.799 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -55.11 -12.14 0.84 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.665 ' NE2' ' HA ' ' A' ' 995' ' ' TYR . 26.5 m80 -58.19 109.76 0.82 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.071 0.463 . . . . 0.0 111.833 175.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . 0.58 HG23 ' HG3' ' A' ' 942' ' ' PRO . 0.0 OUTLIER -97.63 -31.34 12.34 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 123.268 1.508 . . . . 0.0 109.319 175.62 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . 0.509 ' HB2' ' O ' ' A' ' 996' ' ' GLY . 30.4 m170 -136.41 155.93 49.33 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 113.774 -1.557 . . . . 0.0 108.162 -176.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.623 ' HD3' ' CG ' ' A' ' 993' ' ' TRP . 11.3 ttm180 -153.08 139.37 18.47 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 177.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.984 ' HG2' ' HB3' ' A' ' 937' ' ' ASN . 95.9 mtt180 -134.05 166.02 23.7 Favored 'General case' 0 CA--C 1.481 -1.69 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -177.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.602 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 24.5 ptt180 -155.74 153.47 29.94 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 124.23 0.956 . . . . 0.0 108.616 168.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.799 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 34.4 ttm180 -86.52 120.75 28.18 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 176.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.687 ' HA ' ' O ' ' A' ' 981' ' ' SER . 77.6 mt -86.71 129.45 34.87 Favored 'General case' 0 N--CA 1.423 -1.791 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 169.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.456 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 14.1 m -108.3 135.26 47.61 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 CA-C-O 121.419 0.628 . . . . 0.0 112.397 -172.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.464 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 11.3 tpt180 -142.98 97.63 3.13 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 170.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.565 ' HD3' ' HB2' ' A' ' 929' ' ' GLU . 0.0 OUTLIER -74.65 152.79 39.15 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 -179.607 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.581 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 8.1 ptm180 -142.18 166.58 24.31 Favored 'General case' 0 CA--C 1.496 -1.098 0 N-CA-C 106.255 -1.757 . . . . 0.0 106.255 -171.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.644 ' HA ' ' HA ' ' A' ' 929' ' ' GLU . 13.6 ptpt -155.19 152.74 29.74 Favored 'General case' 0 C--O 1.196 -1.727 0 CA-C-O 121.042 0.449 . . . . 0.0 110.842 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.514 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 36.9 ttmt -91.39 -21.28 21.07 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 -178.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 14.3 t70 46.97 27.53 0.74 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 111.175 -2.738 . . . . 0.0 110.411 -169.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . . . . . . . . . 34.8 tp 70.82 -47.52 0.65 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.332 1.853 . . . . 0.0 114.005 177.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 11.3 t -90.55 14.82 12.13 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -170.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -119.06 113.78 21.47 Favored 'General case' 0 C--O 1.216 -0.692 0 O-C-N 121.237 -0.914 . . . . 0.0 110.833 175.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . 0.458 ' OG1' ' HB2' ' A' 1037 ' ' SER . 37.2 p -137.53 -179.37 5.7 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 175.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . 0.595 ' HB2' ' HB2' ' A' ' 971' ' ' PRO . . . -92.61 -39.12 11.5 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 177.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 50.6 m -77.95 -38.69 44.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.198 -0.91 . . . . 0.0 112.812 -177.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . 0.458 ' HB2' ' OG1' ' A' 1034 ' ' THR . 74.4 m -85.59 85.01 7.44 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 122.235 1.017 . . . . 0.0 111.674 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 15.5 p -83.55 -42.53 16.7 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 174.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -134.17 -36.53 0.9 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.409 -1.269 . . . . 0.0 110.19 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 . . . . . 0 C--O 1.241 0.648 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.504 179.812 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 34.3 pt . . . . . 0 N--CA 1.472 0.626 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -97.59 107.05 37.19 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -98.11 -178.96 0.31 Allowed 'Trans proline' 0 N--CA 1.448 -1.15 0 C-N-CA 122.818 2.345 . . . . 0.0 112.813 -178.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -99.16 -22.92 15.43 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 174.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 5.4 m -78.13 84.18 4.38 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.162 175.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . -142.3 133.7 26.44 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . 0.564 ' HB2' ' H ' ' A' ' 927' ' ' HIS . 2.3 p-10 -138.26 150.48 46.72 Favored 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.086 -173.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -91.23 -32.25 15.84 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 170.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . -178.74 46.46 0.09 OUTLIER Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 114.29 -1.323 . . . . 0.0 112.518 174.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.564 ' H ' ' HB2' ' A' ' 924' ' ' ASP 0.259 0.6 OUTLIER -117.35 140.43 49.58 Favored 'General case' 0 CA--C 1.492 -1.277 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 174.335 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.66 122.91 35.55 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 163.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.438 ' HA ' ' HZ3' ' A' ' 973' ' ' TRP . 0.1 OUTLIER -139.19 137.86 36.4 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 170.758 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.419 ' O ' ' HG2' ' A' 1027 ' ' ARG . 91.8 t80 -136.19 140.62 43.71 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.689 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 28.0 m -72.2 129.65 38.95 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 118.673 0.67 . . . . 0.0 112.108 178.257 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -100.19 160.56 14.23 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 105.989 -1.856 . . . . 0.0 105.989 177.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -158.94 145.24 16.84 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.323 0.582 . . . . 0.0 110.961 -171.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.552 HG11 ' HG3' ' A' ' 964' ' ' PRO . 14.6 p -141.02 171.47 12.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 177.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.426 ' H ' HG22 ' A' ' 934' ' ' VAL . 83.5 m-85 -127.89 143.13 51.11 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -176.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.615 ' O ' ' HA ' ' A' 1020 ' ' ARG . 16.9 tt0 -117.65 118.21 31.49 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.397 179.265 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -95.89 126.17 40.96 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 124.365 1.041 . . . . 0.0 111.288 -178.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.527 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 47.8 mt-10 -121.27 154.38 36.42 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 169.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 33.8 m -144.84 158.19 43.89 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.566 -0.853 . . . . 0.0 110.727 -173.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.498 ' HG2' ' CZ3' ' A' ' 946' ' ' TRP . 28.7 ptt180 -151.64 159.58 43.98 Favored 'General case' 0 N--CA 1.427 -1.598 0 O-C-N 124.57 1.169 . . . . 0.0 108.612 178.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -76.51 166.85 41.68 Favored Pre-proline 0 C--N 1.309 -1.185 0 N-CA-C 105.292 -2.114 . . . . 0.0 105.292 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.73 74.36 1.28 Allowed 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 121.359 1.373 . . . . 0.0 111.212 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 139.86 8.14 0.94 Allowed Glycine 0 CA--C 1.528 0.86 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 -176.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . 0.493 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -101.43 -166.33 27.54 Favored Glycine 0 C--N 1.336 0.538 0 N-CA-C 111.071 -0.811 . . . . 0.0 111.071 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -125.61 159.9 31.0 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.588 ' CH2' ' HB3' ' A' 1016 ' ' HIS . 45.5 m95 -73.53 129.76 38.65 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 122.127 0.965 . . . . 0.0 110.304 -175.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . 0.409 ' HA ' ' HD3' ' A' ' 948' ' ' PRO . 17.8 pttp -146.39 138.45 13.55 Favored Pre-proline 0 C--N 1.287 -2.15 0 N-CA-C 103.627 -2.731 . . . . 0.0 103.627 172.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.491 ' HA ' ' HA ' ' A' ' 938' ' ' GLU . 80.2 Cg_exo -49.87 124.6 12.78 Favored 'Trans proline' 0 C--O 1.239 0.548 0 C-N-CA 123.148 2.565 . . . . 0.0 114.733 -169.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -52.44 -177.49 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.231 169.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -102.61 -0.08 32.49 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 115.883 -2.327 . . . . 0.0 109.215 -163.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . 0.511 ' HB3' ' HG3' ' A' ' 960' ' ' LYS . 20.3 m-20 -132.63 82.92 2.03 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 103.018 -2.956 . . . . 0.0 103.018 169.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 28.0 m -69.31 -37.04 77.57 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.342 -167.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -109.12 131.01 55.48 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.531 0.681 . . . . 0.0 112.204 -176.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 42.5 p -145.54 178.81 7.85 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.842 -169.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -99.19 171.5 7.97 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 176.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -52.01 -31.88 31.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 118.335 0.516 . . . . 0.0 111.231 174.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -81.21 -15.23 56.28 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.065 0.46 . . . . 0.0 112.037 177.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 101.64 -4.32 53.76 Favored Glycine 0 CA--C 1.497 -1.064 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.458 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.87 102.5 0.08 Allowed 'General case' 0 CA--C 1.503 -0.829 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . 0.511 ' HG3' ' HB3' ' A' ' 951' ' ' ASP . 5.3 tmmm? -51.65 130.69 28.86 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 124.432 1.082 . . . . 0.0 109.571 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -130.54 175.73 8.75 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.014 -0.993 . . . . 0.0 109.484 -173.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . 0.425 ' HB1' ' HB2' ' A' ' 966' ' ' GLU . . . -64.18 144.44 57.12 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 176.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 2.0 m -68.91 159.42 82.72 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -178.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.584 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 51.8 Cg_exo -52.65 -21.66 15.21 Favored 'Trans proline' 0 N--CA 1.48 0.733 0 C-N-CA 123.865 3.043 . . . . 0.0 114.705 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 5.2 p -70.94 -53.45 14.93 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . 0.425 ' HB2' ' HB1' ' A' ' 962' ' ' ALA . 3.0 mp0 -68.84 -24.8 64.4 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.297 176.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.572 ' HB2' ' HA ' ' A' ' 964' ' ' PRO . 37.3 mt -63.56 111.37 2.33 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.206 1.003 . . . . 0.0 108.68 175.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 2.7 p -130.08 169.52 15.2 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.85 -171.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 15.8 p -87.15 143.07 34.17 Favored Pre-proline 0 C--N 1.313 -0.985 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.981 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.573 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 96.8 Cg_endo -75.09 175.61 11.01 Favored 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 122.703 2.269 . . . . 0.0 110.017 174.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.61 -45.4 41.31 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.928 1.752 . . . . 0.0 114.272 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . . . . . . . . . . . -76.56 -45.4 13.72 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.073 -1.06 . . . . 0.0 112.779 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.573 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 97.5 m95 -76.82 145.15 38.63 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 -179.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.521 ' HB3' ' O ' ' A' 1028 ' ' LYS . 4.6 tp10 -125.59 149.78 48.08 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 -179.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.603 ' CE3' ' HB3' ' A' 1027 ' ' ARG . 94.6 m95 -86.07 156.33 20.45 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 120.495 -1.378 . . . . 0.0 111.594 172.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -120.42 -44.98 2.45 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . 0.572 ' OD1' ' HB3' ' A' 1026 ' ' LYS . 1.0 OUTLIER -78.75 157.14 28.56 Favored 'General case' 0 CA--C 1.499 -1.018 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.914 -176.629 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -88.62 110.05 20.61 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.863 177.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . 0.519 ' C ' ' HD3' ' A' 1025 ' ' ARG . . . 57.51 176.77 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 O-C-N 125.223 1.577 . . . . 0.0 113.71 174.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.584 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 36.9 m95 -89.53 120.66 31.02 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 113.905 -1.498 . . . . 0.0 107.291 176.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 36.7 m -125.64 145.28 50.22 Favored 'General case' 0 C--N 1.295 -1.77 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 -176.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -73.21 135.03 44.52 Favored 'General case' 0 C--N 1.301 -1.536 0 CA-C-O 121.691 0.757 . . . . 0.0 110.044 -174.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -85.72 133.36 34.01 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 114.195 -1.366 . . . . 0.0 111.608 -170.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.574 ' HA ' HG21 ' A' ' 988' ' ' VAL . 1.8 pp -114.22 21.85 6.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.024 177.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -104.39 30.5 5.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.856 0.836 . . . . 0.0 108.798 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.563 ' HB2' HG13 ' A' ' 988' ' ' VAL . 78.1 mtp180 -136.84 -179.52 5.75 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 -178.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -81.34 84.17 6.71 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 171.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.574 HG21 ' HA ' ' A' ' 984' ' ' ILE . 11.9 m -115.5 -178.78 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 122.485 1.136 . . . . 0.0 113.928 -173.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . 0.574 ' HB3' ' H ' ' A' ' 993' ' ' TRP . 3.7 t70 -74.15 179.12 4.62 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 112.727 -2.033 . . . . 0.0 108.67 178.094 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.49 -31.56 69.47 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 118.768 0.713 . . . . 0.0 111.967 178.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -102.06 -44.65 5.4 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.169 -174.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 139.19 75.37 0.05 OUTLIER Glycine 0 CA--C 1.489 -1.534 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.899 176.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.619 ' HA ' ' HB3' ' A' 1021 ' ' ARG . 72.2 m95 -139.45 179.68 6.41 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.537 ' HG3' ' CE3' ' A' 1008 ' ' TRP . 6.9 pt-20 -143.15 153.54 42.97 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 122.285 1.04 . . . . 0.0 110.917 -177.308 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.763 ' O ' ' HA ' ' A' 1008 ' ' TRP . 9.6 t80 -81.99 104.44 12.35 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 112.777 -2.011 . . . . 0.0 112.272 -173.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . 0.457 ' HA3' ' CZ3' ' A' 1008 ' ' TRP . . . -128.78 116.8 2.32 Favored Glycine 0 C--O 1.216 -0.995 0 C-N-CA 118.478 -1.82 . . . . 0.0 112.667 172.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.808 HD12 ' HE1' ' A' 1015 ' ' TYR . 0.5 OUTLIER -109.18 149.61 12.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 O-C-N 120.349 -1.677 . . . . 0.0 109.461 -179.157 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 33.1 m -138.27 115.86 11.33 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 174.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 2.6 mp -100.42 108.13 51.44 Favored Pre-proline 0 C--N 1.305 -1.326 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 177.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -68.32 150.3 76.1 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.519 2.146 . . . . 0.0 113.057 -175.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -89.33 148.33 23.77 Favored 'Cis proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.474 -1.886 . . . . 0.0 112.474 -2.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 13.4 t70 -164.05 -89.16 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.419 -1.718 . . . . 0.0 109.032 177.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 159.32 -76.85 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.0 1.32 . . . . 0.0 109.925 -177.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 90.8 mttt -126.42 150.59 70.82 Favored Pre-proline 0 N--CA 1.447 -0.589 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.049 -172.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -63.85 147.07 92.33 Favored 'Trans proline' 0 C--O 1.239 0.571 0 C-N-CA 123.555 2.837 . . . . 0.0 110.425 170.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -93.89 -50.73 5.2 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 20.7 m -102.06 152.15 21.31 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 112.774 -2.012 . . . . 0.0 112.543 -172.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.763 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 67.3 m95 -135.22 137.09 42.28 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.214 -1.357 . . . . 0.0 107.929 -178.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.68 ' H ' ' HB3' ' A' ' 995' ' ' TYR . 20.9 t -136.63 -109.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.864 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 -175.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . . . . . . . . . . . -167.44 -31.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 118.65 0.659 . . . . 0.0 110.939 -171.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -72.16 -169.44 0.5 Allowed 'General case' 0 C--O 1.237 0.433 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.457 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 9.2 tp10 -150.0 105.95 3.45 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.528 -172.336 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . . . . . . . . . 87.4 mttt -115.0 139.15 50.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.761 -1.108 . . . . 0.0 109.456 176.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . 0.473 ' HA ' ' NH2' ' A' ' 940' ' ' ARG . 24.4 ttt -45.92 -32.56 2.76 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . 0.808 ' HE1' HD12 ' A' ' 997' ' ' ILE . 40.5 p90 -74.79 5.27 5.16 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 118.794 -1.162 . . . . 0.0 111.366 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.588 ' HB3' ' CH2' ' A' ' 946' ' ' TRP . 0.6 OUTLIER -60.02 118.35 6.18 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.535 171.282 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 21.1 p -110.5 -13.04 14.31 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.081 174.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 27.0 m80 -140.5 147.52 39.69 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 122.653 1.216 . . . . 0.0 113.265 -174.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -151.47 144.87 24.8 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 176.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.615 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 98.0 mtt180 -138.27 168.79 19.0 Favored 'General case' 0 CA--C 1.466 -2.252 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -179.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.619 ' HB3' ' HA ' ' A' ' 993' ' ' TRP . 30.3 ptt180 -154.16 153.64 32.15 Favored 'General case' 0 C--N 1.284 -2.281 0 O-C-N 124.677 1.235 . . . . 0.0 108.007 168.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.442 ' HG2' HG13 ' A' 1024 ' ' VAL . 41.8 ttm180 -91.51 115.65 28.22 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 123.558 0.536 . . . . 0.0 109.837 179.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.57 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 81.3 mt -90.12 125.19 35.35 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 169.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 17.6 m -112.83 153.45 14.42 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.866 0 CA-C-O 121.776 0.798 . . . . 0.0 111.33 -174.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.543 ' HG3' ' HB2' ' A' ' 977' ' ' ASP . 31.3 ttp180 -158.83 110.28 2.14 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-N 112.798 -2.001 . . . . 0.0 109.691 168.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.689 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.7 tmmm? -76.0 149.52 37.58 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -178.285 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.603 ' HB3' ' CE3' ' A' ' 975' ' ' TRP . 7.4 ptm180 -136.17 139.41 42.83 Favored 'General case' 0 C--O 1.204 -1.336 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -169.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 30.2 ttmt -125.74 135.83 52.5 Favored 'General case' 0 C--N 1.283 -2.283 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.078 -173.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.55 ' C ' ' H ' ' A' 1031 ' ' LEU . 35.3 ttmt -88.34 -21.02 24.59 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 123.571 1.653 . . . . 0.0 107.781 -177.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . . . . . . . . . 3.2 t70 53.65 -2.92 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 111.135 -2.757 . . . . 0.0 114.127 -170.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . 0.55 ' H ' ' C ' ' A' 1029 ' ' LYS . 15.9 tp 61.68 16.31 7.66 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 125.905 1.682 . . . . 0.0 111.305 178.078 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 13.5 t -123.09 3.45 9.31 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 -179.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -102.6 130.97 49.64 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 113.852 -1.522 . . . . 0.0 107.141 -178.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 40.6 p 64.08 13.3 7.66 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.742 1.617 . . . . 0.0 111.463 -172.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -129.27 172.68 11.22 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 114.363 -1.289 . . . . 0.0 107.626 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 20.9 m 66.18 90.82 0.09 Allowed 'General case' 0 C--O 1.239 0.535 0 O-C-N 124.397 1.061 . . . . 0.0 109.818 -179.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 20.1 m -120.11 97.74 5.74 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.587 -176.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 27.4 m -102.51 126.94 49.73 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 175.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -68.52 102.42 1.45 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 173.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 80.3 mtt180 . . . . . 0 C--N 1.318 -0.803 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 -177.328 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . . . . . . . . . 44.1 pt . . . . . 0 N--CA 1.477 0.882 0 CA-C-O 120.843 0.354 . . . . 0.0 110.331 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -110.42 144.91 31.13 Favored Pre-proline 0 C--N 1.32 -0.699 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -71.7 -13.38 29.67 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.111 1.874 . . . . 0.0 111.901 176.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -81.72 -31.41 32.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.936 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 5.0 p -94.16 -41.48 9.48 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.053 0.454 . . . . 0.0 110.788 177.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . . . . . . . . . . . 61.14 45.51 8.99 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 114.442 -1.253 . . . . 0.0 108.811 -175.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -46.79 118.03 1.89 Allowed 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 113.996 -1.457 . . . . 0.0 112.526 -174.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -160.88 29.18 0.15 Allowed 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.154 -1.384 . . . . 0.0 107.961 -177.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 81.11 64.23 1.8 Allowed Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.671 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.441 ' HA ' ' HB2' ' A' 1031 ' ' LEU . 20.1 m-70 -117.65 -152.2 0.5 Allowed 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 171.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -161.92 116.79 1.94 Allowed 'General case' 0 N--CA 1.413 -2.312 0 N-CA-C 102.267 -3.234 . . . . 0.0 102.267 172.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -142.29 138.65 31.48 Favored 'General case' 0 C--N 1.282 -2.337 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 175.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . 0.433 ' O ' ' HG2' ' A' 1027 ' ' ARG . 84.4 t80 -131.13 139.55 49.83 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.557 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 33.3 m -78.75 123.0 26.73 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -99.79 159.72 14.85 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.284 -2.117 . . . . 0.0 105.284 -173.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -154.51 156.25 36.33 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 119.589 -0.845 . . . . 0.0 111.492 -171.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . 0.527 HG22 ' H ' ' A' ' 935' ' ' TYR . 14.2 p -150.37 177.4 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 N-CA-C 106.768 -1.568 . . . . 0.0 106.768 175.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.565 ' HA ' ' O ' ' A' 1021 ' ' ARG . 78.7 m-85 -138.28 151.22 47.4 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.4 ' O ' ' HA ' ' A' 1020 ' ' ARG . 28.0 tt0 -120.34 124.83 46.51 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 -177.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -117.79 149.71 40.34 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-O 121.528 0.68 . . . . 0.0 111.849 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.598 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 38.9 mt-10 -144.0 159.33 42.78 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 125.306 1.442 . . . . 0.0 107.44 175.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . . . . . . . . . 46.1 m -142.3 142.63 32.56 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.452 0.644 . . . . 0.0 111.777 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.503 ' HB3' ' HA ' ' A' ' 946' ' ' TRP . 17.8 ptt180 -141.78 161.07 38.86 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -176.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -67.68 152.67 96.09 Favored Pre-proline 0 C--N 1.311 -1.103 0 N-CA-C 105.291 -2.114 . . . . 0.0 105.291 170.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . 0.551 ' HB3' ' HA ' ' A' 1015 ' ' TYR . 40.8 Cg_exo -60.59 90.37 0.09 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 121.636 1.558 . . . . 0.0 112.131 176.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 101.44 68.58 0.83 Allowed Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . . . . . . . . . . . -157.98 -123.15 0.72 Allowed Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.176 -1.012 . . . . 0.0 111.106 -175.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -145.98 131.03 18.28 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.77 -0.715 . . . . 0.0 109.928 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.598 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 51.2 m95 -72.35 141.3 48.79 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.942 0.877 . . . . 0.0 109.448 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -125.02 149.66 64.07 Favored Pre-proline 0 C--N 1.289 -2.032 0 N-CA-C 101.955 -3.35 . . . . 0.0 101.955 175.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.549 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . 31.8 Cg_exo -56.39 152.01 41.85 Favored 'Trans proline' 0 C--N 1.323 -0.787 0 C-N-CA 121.394 1.396 . . . . 0.0 111.697 -177.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . . . . . . . . . . . -70.07 -171.55 0.45 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.121 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -105.98 -18.92 13.89 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -119.18 85.82 2.44 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 103.635 -2.728 . . . . 0.0 103.635 169.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 9.6 m -56.62 -54.0 51.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.032 -173.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . 0.505 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 70.5 m-85 -105.73 134.22 49.2 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-O 121.666 0.746 . . . . 0.0 111.106 177.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . . . . . . . . . 15.5 p -143.9 171.63 13.97 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.628 -171.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . 0.702 ' HB3' ' HB3' ' A' ' 959' ' ' ASP . 20.7 t0 -107.64 -176.23 3.01 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 106.187 -1.783 . . . . 0.0 106.187 178.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -50.05 -35.56 25.53 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -175.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -105.9 10.42 32.44 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 100.14 -1.9 56.41 Favored Glycine 0 CA--C 1.497 -1.091 0 C-N-CA 119.36 -1.4 . . . . 0.0 112.457 177.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . 0.702 ' HB3' ' HB3' ' A' ' 955' ' ' ASP . 23.9 t70 -51.48 101.95 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 O-C-N 124.791 0.936 . . . . 0.0 109.165 173.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -56.53 123.64 15.48 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.559 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -120.95 -179.88 4.16 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.817 -175.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -75.98 154.87 35.52 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 175.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 6.1 m -83.29 150.42 60.63 Favored Pre-proline 0 N--CA 1.431 -1.389 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.711 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 50.7 Cg_exo -42.71 -33.75 3.12 Favored 'Trans proline' 0 N--CA 1.48 0.686 0 C-N-CA 124.841 3.694 . . . . 0.0 117.324 -174.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 15.5 t -79.05 -43.62 23.85 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -66.8 -25.72 66.59 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.0 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.505 HD13 ' CH2' ' A' ' 980' ' ' TRP . 7.0 mt -66.3 110.43 3.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.398 0.618 . . . . 0.0 110.904 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 19.3 p -105.5 154.01 20.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.251 0.548 . . . . 0.0 112.211 -176.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.4 ' HB3' ' CE2' ' A' ' 975' ' ' TRP . 8.1 p -90.43 153.71 46.24 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.143 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.581 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 89.7 Cg_endo -77.58 168.89 21.89 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.05 1.833 . . . . 0.0 110.118 173.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . 0.407 ' HB3' ' H ' ' A' 1037 ' ' SER . 25.9 Cg_exo -65.03 -9.75 22.84 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.111 1.874 . . . . 0.0 113.74 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.616 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . -115.05 17.45 17.24 Favored Glycine 0 C--O 1.221 -0.665 0 C-N-CA 121.331 -0.462 . . . . 0.0 112.6 178.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.581 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 75.6 m95 -137.31 134.9 36.59 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-O 122.066 0.936 . . . . 0.0 110.133 175.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.658 ' HB3' ' O ' ' A' 1028 ' ' LYS . 8.7 tp10 -116.92 133.49 55.95 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-N 113.609 -1.632 . . . . 0.0 109.573 -169.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.665 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 65.9 m95 -82.39 100.26 9.9 Favored 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.422 -0.911 . . . . 0.0 109.911 174.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -74.44 -40.14 62.14 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.61 138.3 58.46 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 114.057 -1.428 . . . . 0.0 112.081 -177.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -52.39 -60.3 3.39 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 124.115 0.884 . . . . 0.0 111.953 176.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -167.5 154.72 8.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.99 -171.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.711 ' CG ' ' HB3' ' A' ' 964' ' ' PRO . 28.3 m95 -65.33 117.22 7.55 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -178.119 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . . . . . . . . . 19.8 m -120.98 151.75 39.36 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 -173.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -73.52 133.17 43.54 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 119.055 0.843 . . . . 0.0 110.434 -177.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.462 ' HB2' HG13 ' A' 1024 ' ' VAL . 45.0 t0 -82.35 122.45 28.0 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.123 -172.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . . . . . . . . . 31.2 pt -114.03 8.36 7.77 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.314 -177.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -93.38 33.27 1.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.809 0.814 . . . . 0.0 109.064 -175.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . 0.631 ' HD2' ' NH1' ' A' 1022 ' ' ARG . 53.6 mtp180 -143.58 -176.25 4.89 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -176.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -84.79 78.65 9.84 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 172.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.425 HG21 ' O ' ' A' ' 983' ' ' ASP . 17.3 m -138.71 161.42 30.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 114.794 -1.093 . . . . 0.0 110.624 -175.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . 0.401 ' HB3' ' HB2' ' A' ' 993' ' ' TRP . 11.7 t70 -55.58 169.34 0.32 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.293 1.037 . . . . 0.0 110.914 172.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -54.76 -33.6 61.49 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.479 0.657 . . . . 0.0 110.176 178.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . 0.514 ' HB2' ' CD1' ' A' ' 993' ' ' TRP . 86.4 mttt -98.38 9.07 43.94 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 115.092 -0.958 . . . . 0.0 112.106 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . . . . . . . . . . . 91.68 -11.81 71.11 Favored Glycine 0 C--O 1.227 -0.314 0 N-CA-C 111.674 -0.57 . . . . 0.0 111.674 175.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . 0.671 ' HB3' ' CD ' ' A' 1019 ' ' ARG . 59.6 m95 -54.16 138.97 36.92 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.536 -0.832 . . . . 0.0 112.91 178.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.42 ' HG2' HG12 ' A' ' 988' ' ' VAL . 31.2 mt-10 -113.48 155.56 25.12 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.437 0.637 . . . . 0.0 111.462 -177.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.709 ' HB3' ' H ' ' A' 1009 ' ' VAL . 15.1 t80 -77.46 100.53 6.05 Favored 'General case' 0 C--O 1.209 -1.074 0 C-N-CA 127.08 2.152 . . . . 0.0 111.329 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . . . . . . . . . . . -126.59 97.84 0.5 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 119.056 -1.545 . . . . 0.0 113.218 173.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.598 HG22 ' CD2' ' A' 1016 ' ' HIS . 0.3 OUTLIER -97.75 146.7 7.41 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 O-C-N 120.628 -1.513 . . . . 0.0 107.179 178.869 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 25.0 m -115.12 79.03 1.22 Allowed 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.719 0.771 . . . . 0.0 109.418 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.505 ' HA ' ' HD3' ' A' 1000 ' ' PRO . 2.0 pp -72.98 125.46 91.07 Favored Pre-proline 0 N--CA 1.447 -0.586 0 CA-C-N 114.592 -1.186 . . . . 0.0 111.846 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.505 ' HD3' ' HA ' ' A' ' 999' ' ' ILE . 2.7 Cg_exo -71.31 143.34 43.3 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.401 2.067 . . . . 0.0 114.183 -177.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . 0.447 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.9 Cg_endo -97.27 137.31 3.94 Favored 'Cis proline' 0 N--CA 1.444 -1.384 0 C-N-CA 122.973 -1.678 . . . . 0.0 112.873 -3.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 3.9 t70 -177.18 177.92 1.17 Allowed 'General case' 0 C--N 1.286 -2.18 0 CA-C-N 112.312 -2.222 . . . . 0.0 106.507 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . . . . . . . . . 10.7 m170 -119.61 -43.51 2.58 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 82.1 mttt -125.15 150.6 67.42 Favored Pre-proline 0 C--N 1.307 -1.249 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.128 -174.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . 0.531 ' HB2' ' CZ2' ' A' 1008 ' ' TRP . 77.0 Cg_exo -57.7 124.6 16.42 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.335 2.023 . . . . 0.0 110.305 171.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . 0.407 ' H ' ' HG2' ' A' 1006 ' ' LYS . 41.5 pttt -112.14 11.18 20.32 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 121.918 0.866 . . . . 0.0 109.726 -177.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . . . . . . . . . 46.8 t -148.85 140.98 23.94 Favored 'General case' 0 N--CA 1.431 -1.386 0 CA-C-N 114.611 -1.177 . . . . 0.0 107.933 -176.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.641 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 47.1 m95 -138.76 141.82 38.83 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.229 0.956 . . . . 0.0 108.836 -178.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.844 HG12 ' H ' ' A' 1010 ' ' ALA . 21.5 t -152.14 -165.08 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 102.933 -2.988 . . . . 0.0 102.933 -176.248 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . 0.844 ' H ' HG12 ' A' 1009 ' ' VAL . . . -101.67 -32.92 10.09 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 120.112 1.324 . . . . 0.0 112.554 -179.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . . . . . . . . . . . -68.64 122.81 19.29 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -167.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.52 ' HA ' ' CE1' ' A' 1016 ' ' HIS . 3.0 tp10 -70.98 117.91 13.08 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 171.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.454 ' HD3' ' HE2' ' A' ' 995' ' ' TYR . 56.5 mtpt -115.34 151.95 33.69 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 173.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 25.6 ttt -49.48 -44.6 46.04 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 124.442 1.089 . . . . 0.0 111.677 174.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . 0.551 ' HA ' ' HB3' ' A' ' 942' ' ' PRO . 88.4 m-85 -65.32 7.44 0.21 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.598 ' CD2' HG22 ' A' ' 997' ' ' ILE . 6.2 m170 -66.79 114.16 5.45 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 121.86 0.838 . . . . 0.0 112.366 176.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.31 -35.19 11.32 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-N 112.852 -1.976 . . . . 0.0 108.156 177.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 25.6 m170 -136.31 154.29 50.91 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.104 -174.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . 0.671 ' CD ' ' HB3' ' A' ' 993' ' ' TRP . 9.1 ttm180 -160.44 147.16 15.64 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 994' ' ' GLU . 2.2 ptm180 -151.06 154.73 37.56 Favored 'General case' 0 C--O 1.196 -1.743 0 C-N-CA 119.516 -0.874 . . . . 0.0 110.676 -177.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.565 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 23.2 ptt180 -135.25 149.29 49.82 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 119.563 -0.855 . . . . 0.0 111.428 -176.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.631 ' NH1' ' HD2' ' A' ' 986' ' ' ARG . 34.7 ttm180 -87.95 129.55 35.21 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 123.2 0.313 . . . . 0.0 110.512 178.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.509 ' HB3' ' HB3' ' A' ' 980' ' ' TRP . 61.6 mt -103.96 129.25 51.5 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 167.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.569 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 6.2 m -107.11 141.57 22.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.877 -174.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.549 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 9.9 tpt180 -137.46 106.11 5.87 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.164 170.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 2.0 tmmm? -72.5 135.85 45.77 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.665 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 10.2 ptm180 -131.56 134.43 46.07 Favored 'General case' 0 C--O 1.204 -1.333 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 -172.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.658 ' O ' ' HB3' ' A' ' 974' ' ' GLU . 33.1 ttmt -125.03 137.88 54.22 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 -173.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.616 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.9 ttmt -91.13 -17.74 25.65 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 124.053 1.882 . . . . 0.0 106.978 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . 0.417 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 15.6 t70 60.99 -0.41 0.32 Allowed 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 111.347 -2.66 . . . . 0.0 111.624 -171.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . 0.516 ' H ' ' C ' ' A' 1029 ' ' LYS . 29.6 tp 72.58 -2.68 2.57 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 127.02 2.128 . . . . 0.0 112.56 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 10.3 t -119.62 -1.8 10.56 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -177.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.457 ' NE2' ' HB2' ' A' ' 974' ' ' GLU . 26.5 tt0 -95.21 131.0 41.73 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.438 -178.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . . . . . . . . . 9.2 m -153.18 -26.16 0.15 Allowed 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -141.21 76.82 1.57 Allowed 'General case' 0 N--CA 1.436 -1.142 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.768 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 20.0 m -73.17 -26.17 61.08 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 167.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . 0.407 ' H ' ' HB3' ' A' ' 971' ' ' PRO . 3.4 m -126.49 103.46 7.62 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 105.504 -2.035 . . . . 0.0 105.504 174.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 28.6 m -76.68 -49.86 15.08 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.042 0.449 . . . . 0.0 110.092 -175.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -160.23 -177.65 6.41 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 . . . . . 0 C--N 1.312 -1.031 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.236 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 918' ' ' ILE . . . . . 0.405 ' O ' ' HD3' ' A' ' 920' ' ' PRO . 14.3 pt . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 120.557 0.218 . . . . 0.0 110.72 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 919' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -110.25 97.95 33.3 Favored Pre-proline 0 CA--C 1.515 -0.385 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 175.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 920' ' ' PRO . . . . . 0.416 ' HB2' ' HB2' ' A' ' 923' ' ' ALA . 20.1 Cg_exo -73.69 108.14 2.57 Favored 'Trans proline' 0 N--CA 1.448 -1.15 0 C-N-CA 122.312 2.008 . . . . 0.0 110.797 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 921' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -67.24 -38.54 85.38 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 174.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 922' ' ' THR . . . . . . . . . . . . . 94.9 m -121.69 94.68 4.39 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.267 174.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 923' ' ' ALA . . . . . 0.416 ' HB2' ' HB2' ' A' ' 920' ' ' PRO . . . -88.82 161.44 16.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.176 -179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 924' ' ' ASP . . . . . 0.552 ' HA ' ' CD2' ' A' ' 927' ' ' HIS . 19.3 t70 -135.47 139.23 43.9 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.426 0.631 . . . . 0.0 111.824 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 925' ' ' ALA . . . . . . . . . . . . . . . -138.8 13.68 2.7 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.299 175.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 926' ' ' GLY . . . . . . . . . . . . . . . 123.87 53.97 0.19 Allowed Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.877 -177.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 927' ' ' HIS . . . . . 0.552 ' CD2' ' HA ' ' A' ' 924' ' ' ASP . 3.1 m-70 -127.3 157.46 39.81 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 177.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.48 131.25 55.0 Favored 'General case' 0 N--CA 1.413 -2.291 0 N-CA-C 105.85 -1.908 . . . . 0.0 105.85 160.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 929' ' ' GLU . . . . . 0.563 ' HA ' ' HA ' ' A' 1028 ' ' LYS . 0.9 OUTLIER -143.81 147.56 34.3 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.348 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 930' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -140.89 143.89 34.94 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 176.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 931' ' ' THR . . . . . 0.597 ' HA ' ' HA ' ' A' 1026 ' ' LYS . 24.8 m -75.32 130.53 39.2 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 120.769 0.319 . . . . 0.0 111.068 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 932' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -106.08 158.08 17.07 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 933' ' ' GLU . . . . . 0.933 ' HB2' ' HG3' ' A' 1022 ' ' ARG . 10.6 pt-20 -149.46 156.54 42.16 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 118.54 0.609 . . . . 0.0 110.385 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 934' ' ' VAL . . . . . . . . . . . . . 7.2 p -153.2 130.4 2.16 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-O 121.255 0.55 . . . . 0.0 109.944 170.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 935' ' ' TYR . . . . . 0.633 ' HA ' ' O ' ' A' 1021 ' ' ARG . 62.0 m-85 -80.34 147.09 31.24 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -176.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 936' ' ' GLN . . . . . 0.655 ' O ' ' HA ' ' A' 1020 ' ' ARG . 32.9 tt0 -116.27 111.66 20.47 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 937' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -110.56 142.19 42.72 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.811 0.815 . . . . 0.0 112.328 -172.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 946' ' ' TRP . 49.3 mt-10 -141.78 162.11 36.28 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 113.806 -1.543 . . . . 0.0 107.196 173.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 939' ' ' SER . . . . . 0.676 ' OG ' ' HA ' ' A' ' 949' ' ' ALA . 25.4 p -150.23 157.72 43.39 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 121.7 0.762 . . . . 0.0 111.995 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 940' ' ' ARG . . . . . 0.55 ' HD2' ' O ' ' A' ' 944' ' ' GLY . 30.9 ptt180 -149.95 158.56 44.29 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 113.459 -1.7 . . . . 0.0 108.029 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 941' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -76.56 166.51 44.33 Favored Pre-proline 0 C--N 1.308 -1.212 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 168.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 942' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -65.75 90.74 0.24 Allowed 'Trans proline' 0 N--CA 1.449 -1.104 0 N-CA-C 108.576 -1.356 . . . . 0.0 108.576 168.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 943' ' ' GLY . . . . . . . . . . . . . . . 130.39 -8.45 5.93 Favored Glycine 0 N--CA 1.435 -1.424 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -172.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 944' ' ' GLY . . . . . 0.55 ' O ' ' HD2' ' A' ' 940' ' ' ARG . . . -103.44 -177.8 26.14 Favored Glycine 0 C--N 1.341 0.809 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 -178.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 945' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -118.89 163.21 17.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 120.795 2.297 . . . . 0.0 106.969 172.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 946' ' ' TRP . . . . . 0.602 ' HB3' ' HB3' ' A' ' 938' ' ' GLU . 42.3 m95 -64.45 135.65 56.29 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.955 0.883 . . . . 0.0 112.656 -172.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 947' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -138.84 171.82 7.56 Favored Pre-proline 0 C--N 1.309 -1.173 0 N-CA-C 103.394 -2.817 . . . . 0.0 103.394 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -52.21 124.07 14.06 Favored 'Trans proline' 0 C--O 1.234 0.322 0 CA-C-N 121.806 1.681 . . . . 0.0 110.76 176.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 949' ' ' ALA . . . . . 0.676 ' HA ' ' OG ' ' A' ' 939' ' ' SER . . . -51.88 -68.43 0.17 Allowed 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -174.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.401 ' CG ' ' H ' ' A' ' 951' ' ' ASP . 7.2 pt-20 -168.18 -50.59 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 104.793 -2.299 . . . . 0.0 104.793 -172.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 951' ' ' ASP . . . . . 0.401 ' H ' ' CG ' ' A' ' 950' ' ' GLU . 23.2 m-20 -132.48 125.94 31.82 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 104.216 -2.513 . . . . 0.0 104.216 171.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 952' ' ' THR . . . . . . . . . . . . . 20.0 m -65.7 -58.64 5.23 Favored 'General case' 0 C--N 1.313 -1.002 0 O-C-N 123.329 0.393 . . . . 0.0 111.698 -174.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 953' ' ' TYR . . . . . 0.518 ' HA ' ' O ' ' A' ' 935' ' ' TYR . 76.4 m-85 -102.25 132.21 48.33 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.381 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 954' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' ' 960' ' ' LYS . 69.9 p -142.23 177.78 8.01 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.817 0.817 . . . . 0.0 110.829 -172.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 955' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -100.68 171.47 7.68 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 105.291 -2.115 . . . . 0.0 105.291 174.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 956' ' ' ALA . . . . . . . . . . . . . . . -51.12 -36.18 39.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.468 0.576 . . . . 0.0 111.5 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 957' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -75.81 -39.98 55.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.219 0.533 . . . . 0.0 110.66 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 958' ' ' GLY . . . . . . . . . . . . . . . 133.51 -6.79 4.94 Favored Glycine 0 CA--C 1.493 -1.287 0 C-N-CA 120.499 -0.857 . . . . 0.0 112.053 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 959' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -58.37 105.28 0.27 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 176.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 960' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 953' ' ' TYR . 7.0 ttpm? -50.84 128.24 20.5 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.718 0.771 . . . . 0.0 111.525 176.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -115.39 -172.4 2.14 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.361 -1.29 . . . . 0.0 108.089 -177.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 962' ' ' ALA . . . . . . . . . . . . . . . -82.0 159.05 23.61 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 963' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.62 152.24 72.35 Favored Pre-proline 0 N--CA 1.433 -1.286 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 177.262 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 964' ' ' PRO . . . . . 0.557 ' HB3' ' CG ' ' A' ' 980' ' ' TRP . 6.1 Cg_exo -45.5 -35.41 12.24 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 124.441 3.427 . . . . 0.0 114.917 -178.353 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 965' ' ' SER . . . . . . . . . . . . . 19.5 m -75.26 -46.87 30.9 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 966' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -69.0 -5.09 19.6 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.905 0.882 . . . . 0.0 112.414 174.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 967' ' ' LEU . . . . . 0.461 HD13 ' CH2' ' A' ' 980' ' ' TRP . 13.9 mt -90.85 114.7 27.18 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.947 0.403 . . . . 0.0 110.271 -178.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 34.5 p -117.26 172.95 6.96 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.21 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 969' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 973' ' ' TRP . 6.2 p -95.6 141.43 23.18 Favored Pre-proline 0 C--N 1.319 -0.719 0 CA-C-O 120.938 0.399 . . . . 0.0 111.375 -178.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 970' ' ' PRO . . . . . 0.582 ' HD2' ' HB2' ' A' ' 973' ' ' TRP . 42.0 Cg_endo -84.55 170.34 10.4 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.368 2.712 . . . . 0.0 112.716 -178.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 971' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -64.36 102.7 0.4 Allowed 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 122.05 1.833 . . . . 0.0 110.415 174.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 972' ' ' GLY . . . . . 0.651 ' O ' ' HG3' ' A' 1029 ' ' LYS . . . 126.13 -7.12 7.67 Favored Glycine 0 N--CA 1.433 -1.507 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 973' ' ' TRP . . . . . 0.582 ' HB2' ' HD2' ' A' ' 970' ' ' PRO . 95.2 m95 -135.62 138.19 42.66 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 122.246 1.022 . . . . 0.0 111.395 -177.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 974' ' ' GLU . . . . . 0.515 ' HB2' HE21 ' A' 1033 ' ' GLN . 9.4 tp10 -129.53 145.6 51.44 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 126.55 1.94 . . . . 0.0 108.932 -171.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 975' ' ' TRP . . . . . 0.678 ' CZ3' ' HB3' ' A' 1027 ' ' ARG . 89.2 m95 -84.73 153.85 22.79 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.826 0.822 . . . . 0.0 112.03 174.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 976' ' ' GLU . . . . . 0.745 ' HB2' ' HD2' ' A' 1028 ' ' LYS . 40.3 tt0 -129.01 -37.27 1.71 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.75 -1.114 . . . . 0.0 108.215 177.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 977' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -74.54 151.99 39.4 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.022 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.24 -30.2 18.68 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 979' ' ' ALA . . . . . . . . . . . . . . . -165.4 141.34 5.32 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.524 0.602 . . . . 0.0 111.749 -173.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 980' ' ' TRP . . . . . 0.6 ' HB3' ' HB3' ' A' 1023 ' ' LEU . 36.2 m95 -63.21 123.88 19.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.055 -0.975 . . . . 0.0 108.537 -178.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 981' ' ' SER . . . . . 0.761 ' O ' ' HA ' ' A' 1023 ' ' LEU . 15.0 m -116.29 -165.51 1.06 Allowed 'General case' 0 C--O 1.203 -1.36 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 -175.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 982' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -119.69 148.22 43.65 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 120.604 1.547 . . . . 0.0 110.624 177.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 983' ' ' ASP . . . . . 0.401 ' CB ' ' HD2' ' A' 1022 ' ' ARG . 15.6 t0 -96.19 116.14 28.53 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.078 0.466 . . . . 0.0 109.83 -174.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.586 ' HA ' HG21 ' A' ' 988' ' ' VAL . 26.9 pt -106.26 15.83 6.98 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.07 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.452 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 985' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -96.7 38.41 1.22 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.259 1.028 . . . . 0.0 108.8 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 40.4 mtt180 -140.82 -176.74 4.78 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 -175.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . . . . . . . . . . . -82.01 85.73 6.68 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 171.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 988' ' ' VAL . . . . . 0.586 HG21 ' HA ' ' A' ' 984' ' ' ILE . 23.0 m -135.83 150.79 28.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.967 -176.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 989' ' ' ASP . . . . . 0.449 ' HB2' ' HB3' ' A' 1011 ' ' ALA . 21.2 t70 -52.81 169.09 0.1 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.823 171.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 990' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -55.32 -34.08 63.89 Favored 'General case' 0 CA--C 1.507 -0.701 0 C-N-CA 123.369 0.668 . . . . 0.0 111.869 178.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 991' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -95.97 11.73 32.92 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.51 -177.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 992' ' ' GLY . . . . . 0.414 ' O ' ' HB3' ' A' 1021 ' ' ARG . . . 69.62 77.72 0.41 Allowed Glycine 0 N--CA 1.432 -1.581 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.687 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 993' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -147.0 129.11 15.58 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 994' ' ' GLU . . . . . 0.534 ' HB2' ' HB3' ' A' 1008 ' ' TRP . 3.7 pt-20 -103.24 154.02 19.78 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 177.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 995' ' ' TYR . . . . . 0.839 ' HB3' ' HA ' ' A' 1011 ' ' ALA . 0.5 OUTLIER -110.02 127.8 55.03 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.502 -172.47 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 996' ' ' GLY . . . . . 0.487 ' HA2' ' O ' ' A' 1007 ' ' SER . . . -127.29 141.21 12.45 Favored Glycine 0 N--CA 1.422 -2.297 0 CA-C-N 113.95 -1.477 . . . . 0.0 109.731 176.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.716 HG22 ' HA ' ' A' 1016 ' ' HIS . 1.0 OUTLIER -121.41 138.7 50.91 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 C-N-CA 122.387 0.275 . . . . 0.0 110.507 -179.808 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 998' ' ' THR . . . . . . . . . . . . . 14.1 t -145.01 150.26 36.57 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 3.4 mp -108.11 100.64 37.66 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 176.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1000 ' ' PRO . . . . . 0.493 ' HA ' ' HA ' ' A' 1001 ' ' PRO . 48.9 Cg_endo -70.5 134.27 26.05 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.343 2.028 . . . . 0.0 113.42 -175.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1001 ' ' PRO . . . . . 0.493 ' HA ' ' HA ' ' A' 1000 ' ' PRO . 10.7 Cg_endo -94.81 150.04 10.41 Favored 'Cis proline' 0 N--CA 1.445 -1.339 0 C-N-CA 122.919 -1.701 . . . . 0.0 113.572 -1.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1002 ' ' ASP . . . . . . . . . . . . . 27.9 t70 -149.43 -86.49 0.08 Allowed 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 112.964 -1.925 . . . . 0.0 107.164 176.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1003 ' ' HIS . . . . . 0.524 ' HB2' ' H ' ' A' 1004 ' ' LYS . 31.9 m-70 -158.87 -82.81 0.05 OUTLIER 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 170.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1004 ' ' LYS . . . . . 0.524 ' H ' ' HB2' ' A' 1003 ' ' HIS . 63.6 mttp -150.92 160.76 31.64 Favored Pre-proline 0 N--CA 1.439 -1.015 0 CA-C-N 113.937 -1.483 . . . . 0.0 109.073 177.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1005 ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -56.28 143.61 85.02 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.801 2.334 . . . . 0.0 111.052 168.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1006 ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -124.75 12.21 8.51 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 122.321 1.058 . . . . 0.0 108.174 -175.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1007 ' ' SER . . . . . 0.487 ' O ' ' HA2' ' A' ' 996' ' ' GLY . 33.2 t -135.96 126.28 26.58 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 114.173 -1.376 . . . . 0.0 107.755 -173.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1008 ' ' TRP . . . . . 0.603 ' HA ' ' O ' ' A' ' 995' ' ' TYR . 55.2 m95 -136.74 132.54 34.97 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 124.211 0.944 . . . . 0.0 108.489 -178.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.648 HG12 ' H ' ' A' 1010 ' ' ALA . 3.8 t -151.18 -178.08 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 -171.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1010 ' ' ALA . . . . . 0.648 ' H ' HG12 ' A' 1009 ' ' VAL . . . -65.53 109.71 2.45 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 119.016 0.825 . . . . 0.0 109.64 175.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1011 ' ' ALA . . . . . 0.839 ' HA ' ' HB3' ' A' ' 995' ' ' TYR . . . -52.73 108.53 0.32 Allowed 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 124.069 0.948 . . . . 0.0 112.234 -178.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1012 ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' 1013 ' ' LYS . 13.1 pt-20 -128.6 -48.29 1.27 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 178.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1013 ' ' LYS . . . . . 0.451 ' N ' ' HG3' ' A' 1012 ' ' GLU . 15.4 ptmt -78.06 147.56 34.68 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -168.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1014 ' ' MET . . . . . . . . . . . . . 24.7 ttt -62.49 -40.72 97.6 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 175.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1015 ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -68.62 2.92 2.11 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -175.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1016 ' ' HIS . . . . . 0.716 ' HA ' HG22 ' A' ' 997' ' ' ILE 0.315 14.2 p-80 -82.84 128.13 34.12 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 116.0 -2.28 . . . . 0.0 111.202 174.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 1017 ' ' THR . . . . . . . . . . . . . 73.7 p -101.42 -11.51 19.31 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.245 -166.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1018 ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -139.95 143.69 36.68 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -176.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1019 ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -142.5 152.58 42.82 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 175.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1020 ' ' ARG . . . . . 0.655 ' HA ' ' O ' ' A' ' 936' ' ' GLN . 2.2 ptp180 -155.32 167.51 30.13 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 175.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1021 ' ' ARG . . . . . 0.633 ' O ' ' HA ' ' A' ' 935' ' ' TYR . 27.7 ptt180 -150.15 153.56 36.55 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.061 175.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1022 ' ' ARG . . . . . 0.933 ' HG3' ' HB2' ' A' ' 933' ' ' GLU . 26.7 ttm180 -86.65 115.19 23.95 Favored 'General case' 0 N--CA 1.427 -1.596 0 O-C-N 123.864 0.727 . . . . 0.0 109.479 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1023 ' ' LEU . . . . . 0.761 ' HA ' ' O ' ' A' ' 981' ' ' SER . 76.1 mt -85.94 127.32 34.59 Favored 'General case' 0 N--CA 1.421 -1.88 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 169.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1024 ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' A' ' 980' ' ' TRP . 10.2 m -104.08 133.36 48.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.491 -173.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1025 ' ' ARG . . . . . 0.549 ' HB2' ' CD2' ' A' ' 980' ' ' TRP . 12.9 tpt180 -141.04 102.52 4.27 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.247 171.296 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1026 ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 931' ' ' THR . 0.5 OUTLIER -76.23 145.54 39.67 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 -179.043 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 1027 ' ' ARG . . . . . 0.678 ' HB3' ' CZ3' ' A' ' 975' ' ' TRP . 5.9 ptm180 -136.39 157.84 45.85 Favored 'General case' 0 C--O 1.208 -1.092 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 -171.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1028 ' ' LYS . . . . . 0.745 ' HD2' ' HB2' ' A' ' 976' ' ' GLU . 21.2 ptmt -141.91 151.34 42.55 Favored 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -174.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1029 ' ' LYS . . . . . 0.651 ' HG3' ' O ' ' A' ' 972' ' ' GLY . 37.6 ttmt -89.49 -20.33 23.98 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-O 123.304 1.526 . . . . 0.0 106.955 177.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1030 ' ' ASP . . . . . 0.448 ' HA ' ' HB3' ' A' ' 927' ' ' HIS . 33.9 t70 54.93 -0.49 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 111.402 -2.635 . . . . 0.0 113.101 -172.29 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1031 ' ' LEU . . . . . 0.543 ' H ' ' C ' ' A' 1029 ' ' LYS . 12.2 tp 66.35 6.11 4.11 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 126.489 1.916 . . . . 0.0 110.582 -178.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1032 ' ' THR . . . . . . . . . . . . . 18.1 p -105.83 -8.19 17.87 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-O 121.947 0.879 . . . . 0.0 109.42 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1033 ' ' GLN . . . . . 0.515 HE21 ' HB2' ' A' ' 974' ' ' GLU . 0.8 OUTLIER -105.87 0.95 26.38 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.265 -179.512 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 1034 ' ' THR . . . . . 0.544 ' HB ' ' HD3' ' A' 1029 ' ' LYS . 33.2 m -151.57 89.08 1.46 Allowed 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 177.153 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1035 ' ' ALA . . . . . . . . . . . . . . . -101.57 -176.34 3.11 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.081 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1036 ' ' SER . . . . . . . . . . . . . 48.2 t -74.34 108.01 6.85 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1037 ' ' SER . . . . . . . . . . . . . 13.5 t -76.23 123.17 25.46 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 175.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1038 ' ' THR . . . . . . . . . . . . . 17.0 p -73.61 148.69 42.65 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -173.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1039 ' ' ALA . . . . . . . . . . . . . . . -80.69 -36.62 32.04 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 175.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1040 ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 . . . . . 0 C--O 1.248 0.991 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 177.636 . . . . . . . . 0 0 . 1 stop_ save_