data_1kqi_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 1kqi _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.6 pttt . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p -161.32 159.79 28.91 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 123.285 0.365 . . . . 0.0 110.204 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.574 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 75.2 mt -79.18 126.25 30.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.457 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.44 ' O ' ' HB1' ' A' ' 7' ' ' ALA . . . -78.9 -166.9 0.98 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.99 0.424 . . . . 0.0 112.043 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.573 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.6 pm0 -67.56 129.95 41.5 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.502 0.668 . . . . 0.0 111.482 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 66.88 39.01 3.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.947 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.574 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -105.38 133.17 50.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.919 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -60.78 136.93 58.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.112 0.482 . . . . 0.0 111.107 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.6 m -91.07 155.43 18.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.273 0.559 . . . . 0.0 111.074 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 25.1 p -79.12 132.06 64.48 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.616 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -63.3 -41.08 28.65 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 123.035 2.49 . . . . 0.0 113.62 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.3 m-90 -129.57 -43.16 1.27 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.7 t -149.56 141.24 23.54 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.92 -139.38 5.61 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 111.519 -0.632 . . . . 0.0 111.519 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.64 150.43 20.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.116 0.484 . . . . 0.0 111.196 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 m -94.45 150.02 20.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.918 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.508 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 60.2 m -64.34 142.38 58.44 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.609 0.242 . . . . 0.0 111.593 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 70.9 m -68.8 142.34 54.91 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.435 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.14 144.28 62.6 Favored Pre-proline 0 C--N 1.315 -0.934 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.534 -179.575 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.462 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 89.2 Cg_endo -100.89 32.47 9.24 Favored 'Cis proline' 0 N--CA 1.451 -0.997 0 C-N-CA 123.334 -1.527 . . . . 0.0 113.479 1.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.573 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 28.1 m-85 -65.63 148.02 52.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.136 0.493 . . . . 0.0 110.455 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.6 tp -122.39 138.23 54.6 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.865 -178.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 48.8 t -69.04 112.71 5.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.02 0.438 . . . . 0.0 109.986 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.413 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 83.9 p -89.44 121.47 31.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.287 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.0 m -119.97 52.29 1.13 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 12.3 pt -81.78 -170.76 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.658 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -72.98 -59.71 2.58 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -177.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -71.68 -32.24 67.65 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -111.5 124.31 32.86 Favored Pre-proline 0 C--N 1.321 -0.662 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.088 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.01 166.33 29.48 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.848 2.365 . . . . 0.0 111.595 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 24' ' ' SER . 92.0 m -49.48 104.35 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.547 0.689 . . . . 0.0 112.046 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.516 ' O ' ' HD3' ' A' ' 34' ' ' ARG . 6.7 p -153.57 137.9 16.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.33 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.3 m -65.42 119.93 11.9 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.516 ' HD3' ' O ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -118.72 159.22 45.13 Favored Pre-proline 0 C--N 1.324 -0.536 0 O-C-N 124.386 1.053 . . . . 0.0 108.223 179.835 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.555 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 50.0 Cg_exo -52.66 159.81 4.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.5 2.133 . . . . 0.0 112.48 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 20' ' ' PRO . 49.3 tptt -77.48 109.91 11.81 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.65 46.96 5.01 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 -177.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 16.7 p90 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.679 -179.204 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . 0.402 ' HZ2' ' CG ' ' A' ' 15' ' ' ASP . 66.2 tttt . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.0 p -161.3 158.07 26.49 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.714 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 71.0 mt -80.82 122.12 26.79 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.559 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.09 -162.44 0.39 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.155 0.502 . . . . 0.0 111.976 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.558 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 8.8 pm0 -63.75 126.17 26.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.573 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.79 45.54 4.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.467 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.714 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -115.61 120.83 40.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.631 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.527 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.2 m-20 -50.99 129.72 24.24 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.188 0.518 . . . . 0.0 112.282 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.89 147.94 30.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.3 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.4 m -78.99 130.57 69.51 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.19 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.458 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 40.0 Cg_endo -66.16 -52.21 0.94 Allowed 'Trans proline' 0 N--CA 1.472 0.216 0 C-N-CA 123.141 2.561 . . . . 0.0 113.604 -178.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.458 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 12.7 m-90 -79.98 -56.31 4.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.76 0.314 . . . . 0.0 111.396 -178.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.7 m -161.8 140.66 9.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.579 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 175.27 -153.85 16.46 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.506 -0.637 . . . . 0.0 111.506 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.402 ' CG ' ' HZ2' ' A' ' 1' ' ' LYS . 45.3 m-20 -70.16 143.21 52.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.999 0.428 . . . . 0.0 110.678 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.6 m -88.48 147.52 24.62 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.604 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.476 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.1 m -69.3 144.53 53.53 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.27 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 83.3 m -66.53 145.79 55.24 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.65 ' HD2' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.19 139.72 56.58 Favored Pre-proline 0 C--N 1.307 -1.239 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.274 -179.473 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.557 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 74.9 Cg_endo -103.04 36.37 5.63 Favored 'Cis proline' 0 N--CA 1.456 -0.732 0 C-N-CA 124.188 -1.172 . . . . 0.0 114.083 1.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.558 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 62.5 m-85 -66.98 147.5 53.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.324 0.583 . . . . 0.0 110.855 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.5 tp -116.47 135.42 53.85 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.168 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.4 t -70.37 124.63 24.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -132.12 134.67 45.72 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.903 0.382 . . . . 0.0 111.143 -178.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.419 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -113.16 85.54 2.2 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 179.663 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.707 ' H ' HD12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -79.84 -171.47 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.887 -178.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -71.91 -69.84 0.37 Allowed 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -177.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -69.19 -41.28 77.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.959 0.409 . . . . 0.0 111.885 -177.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.441 ' O ' HG12 ' A' ' 26' ' ' ILE . 46.7 m-85 -97.71 135.56 21.55 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.125 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.59 -171.26 0.37 Allowed 'Trans proline' 0 C--O 1.238 0.487 0 C-N-CA 122.474 2.116 . . . . 0.0 112.692 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.419 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 75.7 m -61.14 106.02 0.56 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.135 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.527 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 4.5 p -144.32 138.63 28.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.074 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 12.7 m -66.1 130.23 42.51 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.995 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 24.4 mmt85 -128.38 161.51 56.31 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.25 154.37 8.16 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 122.531 2.154 . . . . 0.0 112.314 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 6.9 tmtm? -78.12 71.54 4.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.58 43.9 0.13 Allowed Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.088 -1.415 . . . . 0.0 109.663 -177.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 13.0 p90 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.972 -178.797 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 81.9 tttt . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.6 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.8 p -76.97 146.23 37.6 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 118.889 -1.125 . . . . 0.0 110.88 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.539 HD11 ' SG ' ' A' ' 33' ' ' CYS . 90.4 mt -78.83 137.78 37.86 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.096 -1.411 . . . . 0.0 110.518 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.78 -178.87 5.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.417 ' HB3' ' CZ ' ' A' ' 21' ' ' TYR . 19.6 pt-20 -69.99 134.84 48.74 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.041 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.491 ' HB3' ' NH1' ' A' ' 34' ' ' ARG . . . 56.48 40.15 29.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.311 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.45 135.8 52.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.151 -179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -57.02 141.57 45.24 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.501 0.501 . . . . 0.0 109.881 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.4 m -79.11 163.76 24.83 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.103 0.478 . . . . 0.0 110.982 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.463 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 28.8 p -78.62 115.31 50.68 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.314 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 5.9 Cg_exo -79.13 -56.57 0.04 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.994 2.463 . . . . 0.0 112.348 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 23.8 m-90 -85.41 -40.49 16.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.12 0.486 . . . . 0.0 110.57 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.0 m -87.9 -163.58 0.97 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.243 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -160.08 129.37 2.17 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.136 -1.03 . . . . 0.0 112.412 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -159.41 152.53 22.13 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.6 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 5.9 m -88.14 147.08 25.08 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.985 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.411 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 8.4 m -74.54 145.12 43.7 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.428 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 58.8 m -60.77 144.29 52.74 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.36 144.18 65.81 Favored Pre-proline 0 C--N 1.312 -1.028 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -99.0 52.31 1.36 Allowed 'Cis proline' 0 N--CA 1.454 -0.821 0 C-N-CA 124.065 -1.223 . . . . 0.0 113.905 1.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.417 ' CZ ' ' HB3' ' A' ' 5' ' ' GLU . 37.8 m-85 -105.15 145.98 29.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.056 0.455 . . . . 0.0 110.316 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.7 tp -127.91 143.31 51.1 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.76 -178.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 41.9 t -66.48 122.07 16.74 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.1 p -126.33 139.92 52.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.324 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.9 t -135.58 96.3 3.42 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.607 HD13 ' HB2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -109.59 -168.02 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.911 -179.251 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -70.73 -59.44 2.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -73.65 -34.55 65.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.847 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.607 ' HB2' HD13 ' A' ' 26' ' ' ILE . 8.1 m-85 -109.18 128.15 25.96 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.943 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.04 177.3 5.21 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.887 2.391 . . . . 0.0 112.036 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 98.4 m -58.53 102.13 0.1 Allowed 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.48 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.3 p -153.56 140.91 19.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.609 -179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 25.2 m -71.17 127.58 33.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.491 ' NH1' ' HB3' ' A' ' 6' ' ' ALA . 23.8 mmt180 -132.71 164.67 42.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -46.47 139.96 12.37 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.139 1.893 . . . . 0.0 111.532 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -76.96 103.21 6.77 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.92 45.09 2.13 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.777 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.8 p90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.437 -179.505 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . 0.488 ' HB3' ' HE2' ' A' ' 1' ' ' LYS . 28.0 mtpt . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.607 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.9 p -160.82 149.71 16.66 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.296 0.569 . . . . 0.0 110.527 178.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.478 HD13 ' SG ' ' A' ' 33' ' ' CYS . 98.3 mt -85.53 136.11 33.55 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.332 -178.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.38 -171.5 2.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.025 0.44 . . . . 0.0 111.609 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.46 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 10.9 pt-20 -74.32 137.56 42.94 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.347 0.594 . . . . 0.0 111.272 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 62.69 38.39 12.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.741 -178.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.78 139.39 44.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.311 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.42 ' O ' HD12 ' A' ' 3' ' ' LEU . 3.2 p30 -60.73 149.59 35.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.928 0.394 . . . . 0.0 110.775 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.0 p -153.25 -170.63 3.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.125 0.488 . . . . 0.0 111.093 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.7 m -154.57 144.35 15.44 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.377 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.77 -36.65 91.26 Favored 'Trans proline' 0 CA--C 1.53 0.308 0 C-N-CA 123.547 2.832 . . . . 0.0 113.732 -178.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 9.3 m-90 -128.41 -54.28 1.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.023 0.439 . . . . 0.0 111.579 -179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 t -80.17 61.59 4.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.622 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -167.88 150.55 16.82 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.232 -0.985 . . . . 0.0 112.788 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.06 156.64 24.26 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.814 0.34 . . . . 0.0 110.429 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.607 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 4.5 m -78.2 143.22 37.36 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.549 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 4.9 m -76.82 141.34 40.73 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.349 -178.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 55.5 m -60.65 146.82 44.13 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.1 mmmt -83.31 150.98 61.82 Favored Pre-proline 0 C--N 1.31 -1.114 0 C-N-CA 120.13 -0.628 . . . . 0.0 109.81 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -95.45 40.06 4.57 Favored 'Cis proline' 0 N--CA 1.45 -1.039 0 C-N-CA 123.205 -1.581 . . . . 0.0 114.085 1.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.463 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 29.6 m-85 -84.36 163.36 19.61 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 121.983 -0.448 . . . . 0.0 110.533 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 48.1 tp -138.37 141.55 39.65 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.502 -178.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.549 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 46.7 t -74.12 84.59 1.83 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.668 0.747 . . . . 0.0 110.118 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.644 ' OG ' ' HG3' ' A' ' 34' ' ' ARG . 33.4 p -81.15 136.82 35.93 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.318 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.9 t -136.84 69.29 1.41 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.28 0.562 . . . . 0.0 109.77 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.717 ' H ' HD12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -84.61 -172.4 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.243 -179.744 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -74.52 -51.83 13.62 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.344 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -73.42 -23.08 60.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.763 -178.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.673 ' HB2' HD11 ' A' ' 26' ' ' ILE . 87.3 m-85 -130.67 120.2 18.56 Favored Pre-proline 0 C--N 1.324 -0.532 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.399 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.73 175.02 3.2 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.988 2.458 . . . . 0.0 112.541 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 84.3 m -51.89 106.75 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.275 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.6 p -155.16 137.12 14.57 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.032 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.478 ' SG ' HD13 ' A' ' 3' ' ' LEU . 14.3 m -74.01 128.71 36.23 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 179.478 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.644 ' HG3' ' OG ' ' A' ' 24' ' ' SER . 5.8 mtp180 -142.73 163.87 35.92 Favored Pre-proline 0 C--N 1.318 -0.768 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.463 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 82.8 Cg_exo -46.59 141.57 10.85 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.502 2.135 . . . . 0.0 111.936 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.421 ' HE3' ' HB3' ' A' ' 36' ' ' LYS . 8.6 ttpp -77.05 106.41 8.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.984 0.421 . . . . 0.0 109.905 -179.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.21 46.16 2.88 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.8 p90 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.386 -0.816 . . . . 0.0 110.59 -179.491 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . 0.533 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 9.1 mtpm? . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p -160.83 156.61 25.39 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.357 0.41 . . . . 0.0 110.194 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.54 HD11 ' SG ' ' A' ' 33' ' ' CYS . 88.3 mt -79.95 130.11 35.02 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.3 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.27 -158.38 0.15 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.357 0.599 . . . . 0.0 111.962 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.602 ' HG3' ' CE2' ' A' ' 21' ' ' TYR . 15.0 mp0 -69.97 132.82 46.53 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.209 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.476 ' HB3' ' NH1' ' A' ' 34' ' ' ARG . . . 58.91 45.22 15.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.367 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -113.76 124.75 53.0 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.656 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.526 ' O ' HD13 ' A' ' 3' ' ' LEU . 1.6 p30 -57.84 140.78 51.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.771 0.32 . . . . 0.0 110.711 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 17.4 p -114.32 -173.42 2.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.61 0.719 . . . . 0.0 112.022 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.513 ' HB2' ' HA3' ' A' ' 14' ' ' GLY . 75.3 m -153.88 143.67 15.3 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.471 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.64 -39.5 87.46 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.249 2.632 . . . . 0.0 113.641 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -137.17 -53.22 0.68 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.875 0.369 . . . . 0.0 111.278 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m -76.7 56.06 1.12 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.95 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.513 ' HA3' ' HB2' ' A' ' 10' ' ' SER . . . -173.56 148.29 10.1 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.508 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.533 ' OD2' ' HB3' ' A' ' 1' ' ' LYS . 69.1 m-20 -62.61 151.47 37.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.014 0.435 . . . . 0.0 110.946 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.3 m -79.69 151.47 30.46 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.496 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 60.5 m -64.19 141.27 58.83 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 121.272 -0.171 . . . . 0.0 110.656 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.1 m -64.87 146.5 54.82 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -78.62 142.27 61.49 Favored Pre-proline 0 C--N 1.309 -1.17 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.879 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.503 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 87.7 Cg_endo -101.97 35.11 6.82 Favored 'Cis proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.95 -1.271 . . . . 0.0 113.55 0.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.602 ' CE2' ' HG3' ' A' ' 5' ' ' GLU . 40.4 m-85 -69.62 155.09 41.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.218 0.532 . . . . 0.0 111.041 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.8 tp -131.64 136.17 47.52 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.716 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 16.4 t -74.03 125.1 27.54 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.7 p -126.34 133.21 51.42 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.051 0.453 . . . . 0.0 110.677 -178.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.7 m -99.54 72.66 1.79 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.352 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.716 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -79.89 -175.39 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.032 0.444 . . . . 0.0 111.16 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -82.05 -48.79 10.97 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.787 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -65.74 -26.09 67.57 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.579 -178.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -143.61 136.81 13.94 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.296 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.72 -175.89 0.39 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.487 2.125 . . . . 0.0 111.787 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 62.9 m -52.65 105.6 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.073 0.463 . . . . 0.0 110.996 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 6.0 p -148.81 141.84 24.86 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.053 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.7 m -64.23 126.61 28.32 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.123 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.567 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 23.5 mmt180 -129.5 165.01 35.85 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.567 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 9.4 Cg_endo -56.65 154.32 31.66 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 121.687 1.591 . . . . 0.0 111.66 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 19.1 tptm -77.61 114.62 16.63 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.66 46.47 7.27 Favored Glycine 0 N--CA 1.448 -0.54 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 -177.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.8 p90 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.652 -179.147 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . 0.503 ' HZ2' ' CG ' ' A' ' 15' ' ' ASP . 1.8 pptp? . . . . . 0 N--CA 1.483 1.181 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.1 p -126.69 155.68 42.27 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.023 0.44 . . . . 0.0 110.443 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.573 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 84.3 mt -86.41 123.77 32.01 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.763 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.32 -164.95 0.61 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.987 0.422 . . . . 0.0 111.236 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.419 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 7.1 pt-20 -74.03 131.97 41.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.393 0.616 . . . . 0.0 110.941 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 70.35 35.52 2.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.156 -1.384 . . . . 0.0 110.242 -177.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.573 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -105.57 131.59 52.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.93 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -62.34 131.64 49.97 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.283 0.364 . . . . 0.0 110.306 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.406 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 8.6 m -88.41 155.13 19.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.316 0.579 . . . . 0.0 110.858 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.2 m -79.55 128.14 75.93 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.856 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.29 -57.04 1.02 Allowed 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 123.258 2.639 . . . . 0.0 113.998 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.9 m-90 -89.97 -56.01 3.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.866 0.365 . . . . 0.0 111.554 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 m -159.69 146.16 16.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.976 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 178.17 -147.01 7.77 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.876 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.503 ' CG ' ' HZ2' ' A' ' 1' ' ' LYS . 3.2 m-20 -79.61 141.47 36.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.941 0.4 . . . . 0.0 110.842 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.8 m -83.89 154.37 23.46 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.899 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.445 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.7 m -66.45 141.68 57.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.578 0.228 . . . . 0.0 111.015 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.4 m -66.4 145.4 55.73 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 177.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -78.87 141.01 58.69 Favored Pre-proline 0 C--N 1.31 -1.144 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.254 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.473 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 73.9 Cg_endo -103.82 37.55 4.75 Favored 'Cis proline' 0 N--CA 1.451 -0.973 0 C-N-CA 123.916 -1.285 . . . . 0.0 113.919 1.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.75 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 50.5 m-85 -70.54 158.87 35.34 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.964 0.412 . . . . 0.0 110.499 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.7 tp -133.33 135.12 44.59 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.148 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.6 t -72.16 129.11 37.69 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.0 p -135.98 127.65 29.0 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.644 -178.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 14.8 m -100.08 72.93 1.69 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.528 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.429 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -82.11 -170.91 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.112 0.482 . . . . 0.0 111.141 -179.934 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -85.55 -48.97 8.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.621 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -65.79 -25.27 67.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.406 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.45 ' HA ' ' HD3' ' A' ' 30' ' ' PRO . 83.5 m-85 -141.42 138.22 17.32 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 17.1 Cg_exo -66.23 -165.12 0.09 OUTLIER 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.394 2.063 . . . . 0.0 111.595 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 80.0 m -62.43 99.17 0.13 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.906 0.384 . . . . 0.0 110.142 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.2 p -135.98 142.06 44.48 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.394 -178.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 22.3 m -73.66 118.49 16.68 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 177.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.8 mmm-85 -122.86 160.14 50.51 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.75 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 51.2 Cg_exo -50.93 148.26 17.19 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.072 1.848 . . . . 0.0 111.198 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.473 ' HE3' ' O ' ' A' ' 20' ' ' PRO . 37.1 ttmt -76.94 116.43 17.6 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.34 45.55 5.83 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -177.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 15.5 p90 . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.731 -179.131 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.0 p -160.65 161.68 32.47 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.365 0.416 . . . . 0.0 110.394 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.508 HD11 ' O ' ' A' ' 8' ' ' ASP . 81.9 mt -79.3 134.39 36.62 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.356 -179.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.41 -166.04 0.79 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.309 0.576 . . . . 0.0 112.011 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.1 134.3 46.91 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.762 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.53 ' HB3' ' NH1' ' A' ' 34' ' ' ARG . . . 61.09 42.5 12.37 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.666 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.16 136.31 48.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.201 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.508 ' O ' HD11 ' A' ' 3' ' ' LEU . 3.1 p30 -58.58 147.41 32.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.88 0.372 . . . . 0.0 111.149 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.7 p -146.07 159.08 43.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.389 0.614 . . . . 0.0 111.682 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 71.6 m -157.42 146.16 14.61 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.468 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.31 -42.98 57.11 Favored 'Trans proline' 0 CA--C 1.529 0.236 0 C-N-CA 123.606 2.871 . . . . 0.0 113.229 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -111.28 -50.85 2.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.131 0.491 . . . . 0.0 110.683 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.0 t -85.9 52.66 2.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.893 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -169.5 145.65 9.5 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.117 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -82.25 -177.84 6.8 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -85.23 141.7 29.94 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.562 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 56.3 m -73.09 141.38 47.56 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.476 0.179 . . . . 0.0 110.551 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.5 m -66.5 140.41 58.0 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 177.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.602 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.8 OUTLIER -78.54 148.53 73.57 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -179.575 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.447 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.5 Cg_endo -98.08 38.67 5.46 Favored 'Cis proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.182 -1.591 . . . . 0.0 113.924 1.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -81.91 147.89 29.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.027 0.441 . . . . 0.0 110.502 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 54.1 tp -118.75 140.97 49.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.245 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.562 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 40.9 t -72.61 104.11 3.78 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 76.8 p -98.4 139.62 33.88 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.449 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.0 t -140.3 63.25 1.48 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.378 0.609 . . . . 0.0 109.489 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.735 HD13 ' HB2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -85.01 -167.05 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.26 -179.678 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -69.52 -59.29 3.07 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -71.41 -35.4 70.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.683 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.735 ' HB2' HD13 ' A' ' 26' ' ' ILE . 15.5 m-85 -109.4 123.57 36.27 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.831 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -71.35 172.89 13.24 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 122.741 2.294 . . . . 0.0 111.414 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.2 m -51.31 103.16 0.05 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.991 0.424 . . . . 0.0 111.148 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.7 p -160.13 137.08 9.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.644 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.9 m -67.01 127.54 32.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.719 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.53 ' NH1' ' HB3' ' A' ' 6' ' ' ALA . 24.5 mmt180 -134.26 162.16 59.38 Favored Pre-proline 0 C--N 1.324 -0.534 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -50.9 147.92 17.8 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.116 1.877 . . . . 0.0 111.58 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 35.4 ttpt -77.16 113.97 15.47 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.66 46.76 4.48 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 28.7 p90 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.559 -179.381 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . 0.425 ' HZ3' ' CG ' ' A' ' 15' ' ' ASP . 22.7 mtmm . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.1 p -150.45 149.54 30.14 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.191 0.519 . . . . 0.0 110.302 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.548 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 80.0 mt -79.89 135.08 36.35 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.386 -178.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.15 -168.62 1.34 Allowed 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.471 ' OE2' ' HG3' ' A' ' 35' ' ' PRO . 40.0 tt0 -70.61 135.01 48.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.007 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.11 43.26 11.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.726 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.54 127.24 53.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.741 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.468 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 5.6 t70 -57.01 132.72 53.73 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.548 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 30.4 p -94.47 170.21 9.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.832 0.825 . . . . 0.0 112.509 -178.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.9 p -78.89 120.27 80.25 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.952 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.45 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 38.0 Cg_endo -66.95 -46.08 3.56 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 122.948 2.432 . . . . 0.0 112.903 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.45 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 11.1 m-90 -91.36 -53.97 4.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.707 0.289 . . . . 0.0 111.268 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.3 t -173.21 148.57 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.233 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.7 -153.25 22.84 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.298 -0.721 . . . . 0.0 111.298 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.425 ' CG ' ' HZ3' ' A' ' 1' ' ' LYS . 4.9 m-20 -74.34 138.49 43.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.126 0.488 . . . . 0.0 110.368 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.501 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.8 m -83.14 156.46 23.25 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.353 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.502 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 31.1 m -63.84 143.94 57.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.81 -0.177 . . . . 0.0 110.695 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.0 m -63.4 145.21 56.07 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt -78.47 145.4 67.68 Favored Pre-proline 0 C--N 1.312 -1.043 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.314 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.665 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 90.0 Cg_endo -99.67 28.6 14.38 Favored 'Cis proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.023 -1.657 . . . . 0.0 113.583 1.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -64.85 153.0 41.45 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.312 0.577 . . . . 0.0 111.57 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 44.7 tp -131.68 140.74 49.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.187 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.636 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 16.6 t -75.3 120.51 20.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.998 0.428 . . . . 0.0 110.028 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.4 p -110.72 126.8 54.94 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.412 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 58.7 m -101.79 68.97 1.18 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.411 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.776 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -80.96 -172.97 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.998 0.428 . . . . 0.0 111.289 -179.962 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -86.17 -49.22 7.9 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.944 -178.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -66.14 -25.28 66.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.618 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.456 ' HB2' HD12 ' A' ' 26' ' ' ILE . 88.5 m-85 -139.11 138.23 20.62 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.935 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.15 -174.59 0.33 Allowed 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.448 2.099 . . . . 0.0 111.857 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 79.6 m -59.38 99.91 0.07 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.109 0.481 . . . . 0.0 110.503 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.468 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 3.9 p -139.1 138.51 37.12 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.202 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.636 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -65.48 127.44 31.84 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.649 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.434 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 25.6 mmt180 -130.37 164.77 38.83 Favored Pre-proline 0 C--N 1.324 -0.542 0 O-C-N 124.622 1.201 . . . . 0.0 107.88 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.471 ' HG3' ' OE2' ' A' ' 5' ' ' GLU . 32.4 Cg_exo -51.03 153.7 8.51 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.316 2.01 . . . . 0.0 112.02 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.665 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 40.3 tttp -77.65 114.52 16.58 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.0 47.84 5.39 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -177.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.3 p90 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.709 -179.335 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . 0.55 ' HE2' ' OD2' ' A' ' 15' ' ' ASP . 9.2 mmmm . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.5 p -161.92 153.57 18.75 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.052 0.453 . . . . 0.0 110.827 178.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.489 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.9 mt -80.99 134.67 35.73 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.891 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.48 -168.56 1.39 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.143 0.497 . . . . 0.0 111.665 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.613 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 9.3 pt-20 -73.13 135.56 44.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.551 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.529 ' HA ' ' HD2' ' A' ' 34' ' ' ARG . . . 62.92 44.56 6.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.906 -178.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -119.51 127.76 53.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.535 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -52.86 135.26 36.38 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.5 p -111.93 -176.38 2.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 122.093 0.949 . . . . 0.0 113.059 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.417 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 58.6 m -157.85 144.49 13.07 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 114.544 -1.207 . . . . 0.0 109.366 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.491 ' HB2' ' CE3' ' A' ' 12' ' ' TRP . 24.1 Cg_exo -62.52 -43.88 20.21 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.799 2.333 . . . . 0.0 112.725 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.491 ' CE3' ' HB2' ' A' ' 11' ' ' PRO . 11.5 m-90 -136.53 -34.2 0.77 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.768 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 p -77.77 44.79 0.47 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.41 160.49 20.08 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.18 -1.009 . . . . 0.0 112.648 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.55 ' OD2' ' HE2' ' A' ' 1' ' ' LYS . 64.7 m-20 -60.96 153.1 25.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.922 0.391 . . . . 0.0 110.827 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.6 m -79.49 149.82 31.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 55.9 m -61.75 140.61 58.2 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.407 0.146 . . . . 0.0 111.219 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.7 m -64.81 144.35 57.31 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.8 pttp -78.14 142.27 63.67 Favored Pre-proline 0 C--N 1.312 -1.045 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.643 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 76.8 Cg_endo -102.74 38.22 4.82 Favored 'Cis proline' 0 N--CA 1.455 -0.774 0 C-N-CA 123.948 -1.271 . . . . 0.0 113.901 1.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.613 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 38.0 m-85 -74.0 143.67 45.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.352 0.596 . . . . 0.0 110.824 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.1 tp -115.04 138.66 50.61 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.008 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.8 t -73.23 103.41 3.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.581 0.705 . . . . 0.0 110.53 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 52.3 p -80.38 132.6 35.79 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.87 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.2 t -143.25 53.92 1.35 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.454 0.645 . . . . 0.0 109.384 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.613 HG12 ' HB2' ' A' ' 29' ' ' TYR . 28.7 pt -85.79 -165.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.622 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.48 -56.48 15.75 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -79.83 -31.9 40.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.98 0.419 . . . . 0.0 112.117 -178.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.613 ' HB2' HG12 ' A' ' 26' ' ' ILE . 3.1 m-85 -102.66 111.06 64.44 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.613 -179.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -65.86 162.57 34.37 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.766 2.311 . . . . 0.0 110.425 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 27.8 m -48.64 97.93 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.119 0.485 . . . . 0.0 111.924 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 p -153.92 139.01 17.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.539 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -65.68 120.37 12.85 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.529 ' HD2' ' HA ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -123.58 158.06 60.33 Favored Pre-proline 0 C--N 1.321 -0.636 0 O-C-N 124.624 1.203 . . . . 0.0 107.877 179.923 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.473 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 50.2 Cg_exo -53.38 154.57 14.56 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.216 1.944 . . . . 0.0 111.644 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 1.6 tmtp? -77.09 108.49 10.2 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.01 46.47 3.35 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.6 p90 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.385 -0.816 . . . . 0.0 110.672 -179.355 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . 0.617 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 7.4 p -160.87 158.15 27.82 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 123.84 0.713 . . . . 0.0 109.306 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.581 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 70.8 mt -79.61 119.33 22.41 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.251 -0.432 . . . . 0.0 109.958 -179.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 7' ' ' ALA . . . -78.31 -163.41 0.44 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.034 0.445 . . . . 0.0 111.575 -179.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.41 ' H ' ' HG2' ' A' ' 5' ' ' GLU . 6.9 pt-20 -72.28 134.08 45.37 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.335 0.588 . . . . 0.0 110.936 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 68.71 37.53 2.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.416 -177.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.581 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -107.19 128.74 54.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.078 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -58.93 133.72 56.31 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.325 0.391 . . . . 0.0 111.104 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 m -93.8 153.46 18.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.317 0.58 . . . . 0.0 110.453 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.4 m -79.52 129.89 70.06 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.916 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.8 -57.31 0.86 Allowed 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 123.277 2.651 . . . . 0.0 113.968 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 19.8 m-90 -82.12 -50.61 8.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.827 0.346 . . . . 0.0 111.296 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.1 t -175.22 150.21 1.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.01 -144.55 5.16 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.948 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.617 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 0.1 OUTLIER -79.13 157.93 27.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.265 0.555 . . . . 0.0 111.671 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.6 m -93.22 150.61 20.37 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.199 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.435 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.1 m -71.27 144.09 50.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.097 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.9 m -64.68 147.92 52.05 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.3 137.8 60.1 Favored Pre-proline 0 C--N 1.314 -0.972 0 CA-C-O 120.796 0.332 . . . . 0.0 110.941 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.621 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 69.1 Cg_endo -104.89 37.09 4.59 Favored 'Cis proline' 0 N--CA 1.454 -0.843 0 C-N-CA 124.346 -1.106 . . . . 0.0 113.72 0.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.672 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 41.7 m-85 -71.14 143.19 50.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.223 0.535 . . . . 0.0 110.649 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 tp -117.26 139.65 50.54 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.795 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.659 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.1 t -74.08 116.09 14.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.038 0.447 . . . . 0.0 109.798 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 84.2 p -107.95 143.47 36.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.656 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -143.3 58.43 1.4 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.409 HG13 ' H ' ' A' ' 29' ' ' TYR . 38.0 pt -84.55 -162.73 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.341 -179.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -67.38 -62.66 1.31 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.709 -178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -72.71 -41.76 64.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.607 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.409 ' H ' HG13 ' A' ' 26' ' ' ILE . 3.2 m-85 -95.99 120.87 62.21 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.747 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.69 172.46 15.74 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.562 2.175 . . . . 0.0 110.98 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.9 m -52.32 99.25 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.0 0.429 . . . . 0.0 111.196 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.8 p -160.07 143.49 13.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.739 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.659 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.0 m -69.43 132.04 45.72 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -133.93 161.49 63.42 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.672 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 50.9 Cg_exo -51.39 153.19 10.52 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.434 2.09 . . . . 0.0 111.918 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.621 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 59.4 tttm -77.32 103.56 7.33 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.74 46.71 2.64 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 -177.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.6 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.819 -179.198 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.5 p -160.14 154.78 24.05 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.002 0.429 . . . . 0.0 110.15 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.503 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 85.8 mt -79.85 132.82 36.19 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.077 -179.036 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.16 -179.55 6.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.697 0.284 . . . . 0.0 110.675 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.417 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 11.5 pt-20 -70.79 141.53 51.39 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.29 0.567 . . . . 0.0 110.807 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 66.45 45.43 2.14 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.389 -177.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -132.09 124.23 28.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.898 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.615 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 36.0 m-20 -56.97 131.09 48.75 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 123.418 0.449 . . . . 0.0 110.835 -179.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.503 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 31.8 p -91.08 169.62 10.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.641 0.734 . . . . 0.0 112.072 -178.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.5 m -81.77 125.05 78.93 Favored Pre-proline 0 C--N 1.319 -0.724 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.276 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.437 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 38.8 Cg_endo -67.61 -51.96 0.63 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.86 2.373 . . . . 0.0 113.575 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.437 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 14.7 m-90 -82.06 -52.38 7.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.712 0.291 . . . . 0.0 111.334 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.3 t -174.18 148.14 1.29 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.117 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 169.34 -151.78 18.26 Favored Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -72.28 141.94 48.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.387 0.613 . . . . 0.0 110.462 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.0 m -85.65 154.51 21.63 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.842 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.474 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 33.4 m -67.79 139.37 56.62 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.7 m -61.69 147.52 45.75 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.649 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -78.77 144.7 65.0 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.135 -179.965 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.433 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 87.0 Cg_endo -101.66 34.95 7.05 Favored 'Cis proline' 0 N--CA 1.45 -1.037 0 C-N-CA 123.438 -1.484 . . . . 0.0 113.507 1.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.545 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 43.0 m-85 -73.35 174.96 7.37 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.112 0.482 . . . . 0.0 111.339 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.553 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 49.6 tp -152.7 142.44 21.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.136 -178.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 18.0 t -75.85 112.03 11.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.349 0.595 . . . . 0.0 110.608 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.4 p -101.68 137.4 40.04 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.01 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.9 t -129.91 71.79 1.46 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.29 0.567 . . . . 0.0 109.906 -179.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.668 HD11 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -90.42 -167.98 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.93 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -75.91 -52.92 9.26 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.245 -178.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -70.8 -25.83 63.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.177 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.581 ' HB2' HD13 ' A' ' 26' ' ' ILE . 32.4 m-85 -128.94 128.34 23.41 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.633 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.92 179.23 2.86 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.756 2.304 . . . . 0.0 111.757 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 87.3 m -57.61 95.52 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.157 0 O-C-N 123.301 0.375 . . . . 0.0 110.492 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.615 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 8.7 p -144.57 142.21 30.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.193 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -70.78 129.67 39.71 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.236 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -139.05 163.9 42.94 Favored Pre-proline 0 C--N 1.318 -0.796 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.545 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 52.6 Cg_exo -49.67 141.73 26.39 Favored 'Trans proline' 0 N--CA 1.464 -0.234 0 C-N-CA 121.99 1.793 . . . . 0.0 111.122 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.553 ' HE2' ' HB2' ' A' ' 22' ' ' LEU . 30.3 ttmt -77.94 123.56 26.93 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.75 43.51 6.79 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -178.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 15.8 p90 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.41 -0.805 . . . . 0.0 110.46 -179.484 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.483 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.3 p -159.3 151.24 20.73 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.463 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.656 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 87.4 mt -86.46 121.59 29.22 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.725 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.79 -162.18 0.35 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.256 0.55 . . . . 0.0 112.216 -178.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.453 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 8.4 pm0 -64.06 125.71 25.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.792 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.74 45.45 5.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.277 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.656 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -111.38 117.75 33.95 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.785 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.528 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 1.2 m-20 -56.68 131.66 49.68 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.379 0.609 . . . . 0.0 111.614 -179.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.432 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 2.7 m -83.1 154.92 24.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.439 -178.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.2 m -79.1 130.56 69.15 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.907 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.431 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 29.2 Cg_endo -63.83 -55.29 0.69 Allowed 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.021 2.481 . . . . 0.0 113.78 -178.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.431 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.0 m-90 -80.26 -52.24 7.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.727 0.299 . . . . 0.0 111.32 -179.023 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.9 p -174.09 149.35 1.44 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.474 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.09 -151.43 10.24 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -79.61 147.35 32.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.295 0.569 . . . . 0.0 111.067 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.483 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.1 m -83.71 156.53 22.55 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.122 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.46 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 45.6 m -64.22 141.01 58.92 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.426 0.155 . . . . 0.0 110.834 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.2 m -63.74 148.19 49.78 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.662 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.02 141.89 59.16 Favored Pre-proline 0 C--N 1.312 -1.058 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.196 -179.888 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -104.64 40.98 3.13 Favored 'Cis proline' 0 N--CA 1.448 -1.179 0 C-N-CA 123.752 -1.353 . . . . 0.0 113.641 1.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.453 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 59.8 m-85 -72.41 179.48 3.44 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.317 0.579 . . . . 0.0 111.417 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.568 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 59.7 tp -151.95 138.92 19.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.783 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.1 t -71.84 111.76 7.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.822 0.344 . . . . 0.0 111.132 -179.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.724 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 72.2 p -84.91 108.0 17.34 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.9 t -118.99 59.04 0.84 Allowed 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.108 -177.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.594 HG13 ' HB2' ' A' ' 29' ' ' TYR . 10.3 pt -90.22 -171.07 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.983 0.42 . . . . 0.0 111.332 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -67.01 -81.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -177.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.54 ' HD1' ' HD1' ' A' ' 29' ' ' TYR . 0.3 OUTLIER -79.86 36.06 0.32 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -177.032 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.594 ' HB2' HG13 ' A' ' 26' ' ' ILE . 11.3 m-85 -148.67 131.52 7.99 Favored Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 177.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -60.98 131.21 35.92 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.553 2.169 . . . . 0.0 111.0 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.724 ' HA ' ' O ' ' A' ' 24' ' ' SER . 69.8 m -61.99 100.56 0.16 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.446 0.641 . . . . 0.0 111.015 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.528 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 5.2 p -145.02 148.25 33.52 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.389 -178.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 14.9 m -67.54 128.84 37.95 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 120.933 0.397 . . . . 0.0 110.242 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.584 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 26.0 mmt85 -132.48 168.07 19.53 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.884 -1.524 . . . . 0.0 106.884 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.584 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 10.0 Cg_endo -55.02 151.15 35.27 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 121.429 1.419 . . . . 0.0 110.48 179.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.568 ' HE2' ' HB2' ' A' ' 22' ' ' LEU . 20.2 ttmt -77.41 118.21 19.65 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.323 -178.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.74 47.01 1.55 Allowed Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.5 -178.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 C--O 1.253 1.243 0 CA-C-O 117.853 -1.07 . . . . 0.0 110.072 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.4 tptp . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p -161.96 159.27 26.35 Favored 'General case' 0 C--N 1.322 -0.628 0 O-C-N 123.596 0.56 . . . . 0.0 109.988 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.538 HD11 ' SG ' ' A' ' 33' ' ' CYS . 82.1 mt -80.03 133.09 36.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.351 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.41 -168.09 1.25 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.202 0.525 . . . . 0.0 112.031 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.493 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 6.4 pt-20 -72.96 132.52 43.54 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.106 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.67 38.74 9.2 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.535 -1.212 . . . . 0.0 110.411 -178.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.86 133.58 52.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.396 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -58.68 145.39 40.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.261 0.553 . . . . 0.0 111.473 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.22 142.72 50.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.826 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.5 m -79.8 128.45 74.24 Favored Pre-proline 0 C--N 1.318 -0.79 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.489 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.478 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 51.8 Cg_endo -67.87 -43.31 5.29 Favored 'Trans proline' 0 N--CA 1.474 0.334 0 C-N-CA 123.434 2.756 . . . . 0.0 113.925 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.478 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 19.4 m-90 -78.99 -44.82 21.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.611 0.243 . . . . 0.0 111.453 -178.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.2 t -175.47 139.09 0.42 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.303 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.71 -147.83 7.01 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -81.29 152.02 27.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.93 0.395 . . . . 0.0 110.24 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 m -85.49 144.3 28.03 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.446 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 54.3 m -72.16 140.58 48.87 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.0 m -64.13 142.39 58.43 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.63 ' HD2' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.64 143.83 63.9 Favored Pre-proline 0 C--N 1.311 -1.101 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.12 -179.555 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -101.0 44.53 2.81 Favored 'Cis proline' 0 N--CA 1.455 -0.768 0 C-N-CA 124.069 -1.221 . . . . 0.0 113.858 1.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.493 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 40.3 m-85 -87.5 147.0 25.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.154 0.502 . . . . 0.0 110.634 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 56.7 tp -121.61 143.66 49.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.759 -179.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 41.9 t -68.02 114.23 6.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.926 0.393 . . . . 0.0 109.951 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.551 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 97.4 p -96.51 126.68 41.87 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.122 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 77.5 m -122.52 59.19 1.04 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.004 0.43 . . . . 0.0 110.407 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.657 HD11 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -84.72 -174.85 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.986 0.422 . . . . 0.0 111.055 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -81.16 -47.98 12.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.53 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -64.97 -25.37 67.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.646 -178.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.524 ' HB2' HD13 ' A' ' 26' ' ' ILE . 96.9 m-85 -141.75 128.93 11.52 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.562 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.03 173.65 5.72 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.869 2.379 . . . . 0.0 112.229 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 24' ' ' SER . 92.6 m -50.33 108.55 0.23 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.522 0.677 . . . . 0.0 111.768 -179.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.4 p -152.46 131.32 12.48 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.969 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.9 m -65.32 128.19 34.85 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.401 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 81.0 mtt-85 -138.16 162.85 51.48 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.401 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 51.5 Cg_exo -48.69 144.1 15.22 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.244 1.962 . . . . 0.0 111.483 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -77.16 119.8 21.36 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.59 44.68 6.05 Favored Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 110.784 -0.926 . . . . 0.0 110.784 -178.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.8 p90 . . . . . 0 C--O 1.252 1.199 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.421 -179.625 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . 0.489 ' HG2' ' N ' ' A' ' 2' ' ' CYS . 19.8 ttpp . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.665 ' HA ' ' O ' ' A' ' 16' ' ' SER . 18.4 p -113.63 157.94 21.49 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.504 178.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.52 HD12 ' SG ' ' A' ' 33' ' ' CYS . 93.0 mt -99.71 130.15 45.9 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.773 -178.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.01 -165.88 0.72 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.095 0.474 . . . . 0.0 111.719 -179.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.591 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 13.2 pt-20 -71.35 131.65 43.71 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.054 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 65.4 38.9 5.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.553 -178.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -106.13 126.9 52.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.457 -179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -51.72 136.75 26.85 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.415 0.447 . . . . 0.0 111.021 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 32' ' ' SER . 1.4 p -129.59 142.54 50.72 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.909 0.861 . . . . 0.0 112.213 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.2 m -79.9 130.49 66.74 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 114.293 -1.322 . . . . 0.0 110.336 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.463 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 58.8 Cg_endo -69.54 -43.58 2.75 Favored 'Trans proline' 0 N--CA 1.474 0.333 0 C-N-CA 123.386 2.724 . . . . 0.0 113.981 -178.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.463 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.3 m-90 -79.07 -45.53 19.93 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.8 t -175.36 143.93 0.68 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.786 0.326 . . . . 0.0 111.106 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.61 -153.16 18.21 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.442 ' OD2' ' HB3' ' A' ' 1' ' ' LYS . 11.5 m-20 -69.8 145.81 51.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.099 0.476 . . . . 0.0 110.332 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.665 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 3.9 m -86.21 146.54 26.51 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.19 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.441 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.3 m -69.66 139.35 53.51 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.805 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 56.4 m -63.47 149.19 46.65 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -78.91 142.33 60.21 Favored Pre-proline 0 C--N 1.311 -1.094 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.17 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -103.16 39.47 4.09 Favored 'Cis proline' 0 N--CA 1.45 -1.046 0 C-N-CA 123.991 -1.254 . . . . 0.0 113.81 1.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.591 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 57.4 m-85 -77.71 -176.37 4.33 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 121.992 -0.442 . . . . 0.0 111.202 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.6 tp -159.21 139.52 12.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.3 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.9 t -69.65 112.57 6.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.842 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.595 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 55.2 p -99.45 108.62 21.12 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.074 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 31' ' ' CYS . 1.8 t -103.96 58.41 0.73 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.062 -178.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.731 ' H ' HD12 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -91.4 -175.41 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.18 -179.612 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -86.67 -56.65 3.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -178.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -61.47 -32.87 72.89 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.827 -178.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.713 ' HB2' HD11 ' A' ' 26' ' ' ILE . 7.8 m-85 -115.7 129.55 25.06 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.801 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.7 142.64 91.3 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.545 2.164 . . . . 0.0 111.409 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.595 ' HA ' ' O ' ' A' ' 24' ' ' SER . 72.4 m -54.84 100.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.816 0.817 . . . . 0.0 111.348 -179.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.404 ' HA ' ' SG ' ' A' ' 9' ' ' CYS . 6.4 p -153.37 149.59 27.98 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.144 -0.934 . . . . 0.0 110.254 -178.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.7 m -67.99 128.71 37.51 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -132.92 164.44 43.85 Favored Pre-proline 0 C--N 1.32 -0.687 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.99 143.38 24.51 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.028 1.818 . . . . 0.0 110.795 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.573 ' HB2' ' HZ3' ' A' ' 36' ' ' LYS . 4.7 ttmp? -77.34 115.89 17.49 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -179.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.53 44.6 3.94 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -177.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.5 p90 . . . . . 0 C--O 1.252 1.196 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.449 -179.258 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . 0.482 ' HG3' ' N ' ' A' ' 2' ' ' CYS . 51.6 tptt . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.4 p -149.41 149.38 30.74 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.516 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 85.3 mt -79.63 137.37 37.08 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.004 -178.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.62 -166.78 0.93 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.224 0.535 . . . . 0.0 112.065 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -72.06 134.37 45.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.906 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.11 46.07 6.63 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.508 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -122.01 122.5 39.45 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.458 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.651 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 37.4 m-20 -57.21 131.17 49.17 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.57 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.516 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 26.2 p -95.88 -173.98 3.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.455 -179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 21.1 t -160.29 138.74 7.54 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.58 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.59 -31.56 87.11 Favored 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 123.127 2.551 . . . . 0.0 113.307 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -137.54 -51.44 0.63 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.869 0.366 . . . . 0.0 111.42 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 m -79.42 50.96 1.16 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.942 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 178.41 141.12 4.16 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.657 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.99 163.83 18.99 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.121 0.486 . . . . 0.0 111.098 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 15.9 m -79.15 153.84 29.77 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.962 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 12.5 m -64.28 142.87 58.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.364 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.9 m -64.64 144.73 57.01 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 177.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.68 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -77.55 143.23 67.71 Favored Pre-proline 0 C--N 1.313 -0.992 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.892 -178.742 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.522 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 84.6 Cg_endo -102.72 35.64 6.18 Favored 'Cis proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.181 -1.591 . . . . 0.0 113.893 1.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.401 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 62.4 m-85 -67.2 150.06 49.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.29 0.567 . . . . 0.0 111.368 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.0 tp -124.89 134.4 52.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.567 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.634 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 11.3 t -74.87 122.42 23.36 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.0 p -126.69 129.3 48.17 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.243 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.1 76.6 1.47 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.309 -179.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.73 ' H ' HD12 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -84.9 -168.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.036 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -84.98 -50.56 7.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.915 -178.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -66.99 -26.45 66.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.513 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.572 ' HB2' HD11 ' A' ' 26' ' ' ILE . 75.6 m-85 -136.99 138.38 25.65 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.47 ' HG2' ' OD1' ' A' ' 8' ' ' ASP . 36.4 Cg_endo -67.17 -158.92 0.04 OUTLIER 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.225 1.95 . . . . 0.0 112.215 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 73.1 m -68.28 77.38 0.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.033 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.651 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 3.5 p -114.65 141.5 47.71 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.634 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 21.2 m -71.95 118.58 14.99 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 24.5 mmm-85 -121.47 162.08 38.04 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.401 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 47.7 Cg_exo -50.99 152.28 10.46 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.28 1.986 . . . . 0.0 112.121 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 21.4 tptm -77.42 108.31 10.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.75 47.51 3.94 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.063 -1.215 . . . . 0.0 110.063 -177.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.5 p90 . . . . . 0 C--O 1.252 1.195 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.897 -179.08 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . 0.554 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 7.6 ptpp? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 16' ' ' SER . 25.7 p -118.59 150.39 39.75 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.649 178.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.541 HD12 ' SG ' ' A' ' 33' ' ' CYS . 82.3 mt -84.91 127.88 34.36 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.607 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.77 -163.48 0.48 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.078 0.466 . . . . 0.0 111.634 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.599 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 5.0 pt-20 -70.93 130.97 42.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.347 0.594 . . . . 0.0 111.341 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 64.52 39.96 6.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.855 -178.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.468 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -106.37 128.55 54.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.473 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.441 ' O ' HD11 ' A' ' 3' ' ' LEU . 3.6 p30 -58.81 138.47 57.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.155 0.502 . . . . 0.0 111.406 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 32' ' ' SER . 4.4 m -97.57 151.66 19.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.125 0.488 . . . . 0.0 110.629 -179.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.1 m -79.57 128.23 75.58 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.973 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.438 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 30.3 Cg_endo -63.96 -54.82 0.78 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 123.041 2.494 . . . . 0.0 113.722 -178.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.438 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.2 m-90 -80.61 -52.55 7.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.797 0.332 . . . . 0.0 111.255 -179.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 t -175.86 150.01 0.98 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.67 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.69 -142.77 6.96 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.878 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.554 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 46.6 m-20 -72.13 144.67 48.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.204 0.526 . . . . 0.0 110.652 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.576 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 7.7 m -95.75 150.72 20.08 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.816 179.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.637 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 60.7 m -63.71 142.98 58.2 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.618 0.247 . . . . 0.0 111.625 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.5 m -68.12 143.66 55.34 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 177.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -78.87 141.73 59.65 Favored Pre-proline 0 C--N 1.311 -1.097 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.417 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.532 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 86.7 Cg_endo -102.91 36.48 5.62 Favored 'Cis proline' 0 N--CA 1.454 -0.827 0 C-N-CA 124.18 -1.175 . . . . 0.0 113.931 1.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.599 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 32.8 m-85 -69.53 150.05 47.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.146 0.498 . . . . 0.0 110.774 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -119.64 134.68 55.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.719 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.66 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.1 t -76.16 113.12 13.34 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.829 0.347 . . . . 0.0 111.013 179.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.672 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 64.8 p -84.88 102.73 13.34 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.497 ' HA ' ' HA ' ' A' ' 31' ' ' CYS . 4.2 t -110.13 54.89 0.65 Allowed 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -178.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.487 HD12 ' CH2' ' A' ' 38' ' ' TRP . 16.0 pt -110.2 -170.56 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.202 -179.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -78.36 -56.53 4.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.228 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -65.15 -33.56 76.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.168 0.508 . . . . 0.0 111.289 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -114.54 112.69 45.69 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.027 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -56.33 141.36 89.02 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.9 2.4 . . . . 0.0 111.4 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.672 ' HA ' ' O ' ' A' ' 24' ' ' SER . 62.8 m -50.92 96.51 0.01 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.766 0.794 . . . . 0.0 112.536 -178.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.408 ' HA ' ' SG ' ' A' ' 9' ' ' CYS . 7.7 p -158.2 145.04 17.7 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.772 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.66 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -67.11 125.65 26.7 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.58 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 25.0 mmt85 -123.23 166.25 19.0 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.58 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 12.2 Cg_endo -57.2 166.25 4.53 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 121.629 1.553 . . . . 0.0 111.398 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 47.7 tttp -77.83 73.91 4.39 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.959 0.885 . . . . 0.0 109.53 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.27 49.39 0.05 OUTLIER Glycine 0 N--CA 1.441 -0.998 0 CA-C-N 113.697 -1.592 . . . . 0.0 109.469 -177.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.487 ' CH2' HD12 ' A' ' 26' ' ' ILE . 23.2 p-90 . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.404 -178.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? . . . . . 0 N--CA 1.482 1.14 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.2 p -162.32 153.83 18.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.109 0.481 . . . . 0.0 110.778 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.554 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 89.1 mt -80.28 128.17 33.22 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.372 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 7' ' ' ALA . . . -78.65 -166.65 0.91 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.991 0.424 . . . . 0.0 111.424 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.595 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 8.1 pt-20 -72.4 130.89 41.78 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.152 0.501 . . . . 0.0 110.791 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 69.69 34.23 2.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.428 -178.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.554 ' HB1' ' HB3' ' A' ' 3' ' ' LEU . . . -104.14 127.03 51.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.815 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -57.16 132.72 53.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.846 0.355 . . . . 0.0 111.31 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.09 137.03 52.55 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.499 0.666 . . . . 0.0 110.952 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.0 m -79.44 128.87 73.81 Favored Pre-proline 0 C--N 1.314 -0.945 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.475 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.495 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 56.5 Cg_endo -68.42 -41.12 6.98 Favored 'Trans proline' 0 N--CA 1.474 0.338 0 C-N-CA 123.557 2.838 . . . . 0.0 113.943 -178.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.495 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 20.8 m-90 -78.7 -43.16 26.51 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.09 -178.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 t -177.79 138.55 0.21 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.474 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.91 -153.74 10.41 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -83.01 152.34 25.45 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.3 m -83.54 144.76 29.29 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.016 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.454 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 12.9 m -70.9 138.16 49.9 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.8 m -61.82 146.68 48.82 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 178.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -82.75 147.79 56.09 Favored Pre-proline 0 C--N 1.311 -1.096 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.152 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.537 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 94.1 Cg_endo -97.82 32.28 10.92 Favored 'Cis proline' 0 N--CA 1.451 -0.997 0 C-N-CA 122.988 -1.672 . . . . 0.0 113.752 1.218 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.595 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 39.1 m-85 -70.6 156.54 39.3 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.199 0.523 . . . . 0.0 111.304 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 tp -131.36 140.7 49.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.316 -178.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.602 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 50.6 t -71.68 125.51 27.29 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.419 ' OG ' ' HG2' ' A' ' 34' ' ' ARG . 63.6 p -132.46 133.99 44.52 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -179.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -118.65 86.37 2.53 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.568 HG23 ' HZ2' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -91.26 -168.76 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.544 -179.425 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -75.32 -64.13 1.13 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.02 -39.58 87.07 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.955 0.407 . . . . 0.0 111.367 -177.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.459 ' HB2' HD11 ' A' ' 26' ' ' ILE . 31.6 m-85 -105.77 129.79 24.07 Favored Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 16.2 Cg_exo -67.2 -167.95 0.15 Allowed 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.34 2.027 . . . . 0.0 111.596 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 90.0 m -62.86 104.61 0.56 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.0 p -144.98 137.53 26.17 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.894 0.378 . . . . 0.0 111.597 -178.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.602 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.9 m -72.53 120.59 18.35 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 177.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.419 ' HG2' ' OG ' ' A' ' 24' ' ' SER . 21.1 mmm-85 -121.45 167.2 13.96 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.572 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 72.7 Cg_exo -47.62 163.95 0.17 Allowed 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 122.726 2.284 . . . . 0.0 112.591 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 22.3 tptm -76.86 73.14 3.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.745 0.783 . . . . 0.0 109.666 -179.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 123.65 23.37 2.09 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.92 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.568 ' HZ2' HG23 ' A' ' 26' ' ' ILE . 1.3 m-90 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.481 -0.771 . . . . 0.0 111.471 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . 0.504 ' HG3' ' OD2' ' A' ' 15' ' ' ASP . 26.2 tptp . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 22.7 p -161.36 159.0 27.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.15 -178.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.834 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 69.3 mt -80.11 120.57 24.43 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.45 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.43 -155.52 0.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.506 0.669 . . . . 0.0 112.693 -178.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.437 ' OE1' ' HD3' ' A' ' 35' ' ' PRO . 12.6 tp10 -65.56 128.46 36.03 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.19 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.453 ' HB1' ' CZ ' ' A' ' 34' ' ' ARG . . . 59.66 43.23 15.93 Favored 'General case' 0 CA--C 1.515 -0.386 0 O-C-N 124.144 0.902 . . . . 0.0 110.615 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.834 ' HB1' ' HB3' ' A' ' 3' ' ' LEU . . . -102.07 129.81 48.49 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 119.897 -0.721 . . . . 0.0 111.803 -178.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -62.73 134.37 56.19 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.221 0.534 . . . . 0.0 110.537 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.432 ' HA ' HD13 ' A' ' 3' ' ' LEU . 4.4 m -92.8 152.81 19.24 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.602 -179.122 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.0 m -79.11 131.93 64.88 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.999 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.403 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 24.8 Cg_endo -62.47 -55.08 1.02 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.142 2.561 . . . . 0.0 113.771 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.403 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 12.8 m-90 -88.42 -58.27 2.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.865 0.364 . . . . 0.0 111.23 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.3 m -161.62 146.36 13.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.967 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.56 -145.47 8.02 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.985 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.504 ' OD2' ' HG3' ' A' ' 1' ' ' LYS . 0.7 OUTLIER -70.0 148.13 49.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.359 0.6 . . . . 0.0 111.447 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.2 m -99.58 150.34 22.34 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.068 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.511 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 61.3 m -63.47 141.43 58.77 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.629 0.252 . . . . 0.0 111.338 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.6 m -67.38 143.65 56.21 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.18 141.88 62.98 Favored Pre-proline 0 C--N 1.31 -1.125 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.438 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.436 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 92.1 Cg_endo -102.66 44.82 2.63 Favored 'Cis proline' 0 N--CA 1.453 -0.895 0 C-N-CA 124.073 -1.219 . . . . 0.0 114.095 1.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -81.76 148.41 28.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.229 0.538 . . . . 0.0 110.457 179.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.0 tp -119.47 139.19 52.47 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.575 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.4 t -71.1 106.19 3.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 110.401 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -88.4 130.83 35.07 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.513 179.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.9 t -136.47 63.77 1.57 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.407 0.623 . . . . 0.0 109.331 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.829 HD13 ' HB2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -81.22 -168.64 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.241 -179.53 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -66.95 -60.58 2.52 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -74.07 -36.49 64.32 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -177.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.829 ' HB2' HD13 ' A' ' 26' ' ' ILE . 23.4 m-85 -103.63 124.96 36.16 Favored Pre-proline 0 C--N 1.322 -0.621 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.079 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.82 172.45 13.65 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.817 2.345 . . . . 0.0 111.966 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 88.2 m -52.41 105.38 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 O-C-N 123.468 0.48 . . . . 0.0 111.175 -179.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 p -152.73 135.23 15.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.39 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.561 ' SG ' HD11 ' A' ' 3' ' ' LEU . 19.3 m -65.86 129.06 38.45 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.538 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.453 ' CZ ' ' HB1' ' A' ' 6' ' ' ALA . 34.4 mmt180 -138.04 162.18 55.45 Favored Pre-proline 0 C--N 1.327 -0.409 0 O-C-N 125.504 1.753 . . . . 0.0 107.649 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.437 ' HD3' ' OE1' ' A' ' 5' ' ' GLU . 44.1 Cg_exo -51.96 147.6 25.63 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.261 1.974 . . . . 0.0 111.728 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 32.6 ttpt -77.64 94.16 4.35 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 112.21 43.88 0.89 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 -178.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.8 p90 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.283 -0.865 . . . . 0.0 110.483 -179.334 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 83.5 tttt . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 16' ' ' SER . 28.9 p -77.7 146.97 35.68 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.469 -0.892 . . . . 0.0 110.739 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.458 HD12 ' SG ' ' A' ' 33' ' ' CYS . 63.2 mt -82.3 127.18 32.96 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.89 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.16 -169.75 1.72 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.89 0.376 . . . . 0.0 111.57 -179.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -75.12 133.24 41.57 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.395 0.616 . . . . 0.0 110.8 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.432 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 69.03 33.74 3.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.157 -1.383 . . . . 0.0 110.207 -177.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -110.48 134.81 52.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.773 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -57.37 147.42 26.03 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.094 0.473 . . . . 0.0 111.538 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.7 p -137.49 149.34 46.74 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.476 0.655 . . . . 0.0 111.288 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.0 m -79.43 125.66 82.55 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.584 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.497 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 60.2 Cg_endo -70.47 -42.21 2.83 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 123.213 2.609 . . . . 0.0 113.437 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.497 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.8 m-90 -79.28 -46.5 17.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.299 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.9 t -176.59 140.67 0.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.844 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 177.69 -160.87 27.73 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -70.04 148.81 48.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.32 0.581 . . . . 0.0 110.787 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.554 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 8.0 m -82.88 149.57 27.03 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.924 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.407 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 5.0 m -74.53 145.14 43.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.22 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.25 146.41 50.97 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -79.18 142.99 59.92 Favored Pre-proline 0 C--N 1.311 -1.102 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.079 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.581 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 82.1 Cg_endo -103.55 43.33 2.8 Favored 'Cis proline' 0 N--CA 1.449 -1.089 0 C-N-CA 124.089 -1.213 . . . . 0.0 113.697 1.191 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.663 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 18.4 m-85 -73.37 -164.33 0.19 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 117.957 0.344 . . . . 0.0 111.223 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.506 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 24.3 tp -168.07 133.32 1.83 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.813 -0.176 . . . . 0.0 111.247 -178.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.8 t -70.21 128.39 36.1 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.485 ' OG ' ' HG2' ' A' ' 34' ' ' ARG . 22.6 p -142.53 132.02 23.74 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.805 0.336 . . . . 0.0 110.623 -178.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.436 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.7 OUTLIER -112.05 77.77 1.07 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.519 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.711 HD11 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -89.16 -169.48 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.643 -179.289 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -84.01 -50.35 8.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.765 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -63.01 -28.92 70.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.303 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.41 ' HA ' ' HD3' ' A' ' 30' ' ' PRO . 67.6 m-85 -140.12 134.29 15.58 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.303 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 21.9 Cg_exo -64.83 -166.99 0.09 OUTLIER 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.49 2.126 . . . . 0.0 111.828 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.436 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 93.7 m -58.32 103.72 0.17 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.999 0.428 . . . . 0.0 110.082 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.6 p -151.2 141.01 21.88 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.027 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 18.8 m -74.97 123.06 24.46 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 177.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.485 ' HG2' ' OG ' ' A' ' 24' ' ' SER . 21.1 mmm-85 -119.04 162.0 33.69 Favored Pre-proline 0 C--N 1.316 -0.869 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.663 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 32.7 Cg_exo -53.35 157.52 8.92 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.37 2.046 . . . . 0.0 111.589 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.581 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 1.3 tppp? -77.72 113.68 15.83 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.46 48.72 5.49 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 -177.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.1 p90 . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.862 -179.074 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . 0.466 ' HZ3' ' CG ' ' A' ' 15' ' ' ASP . 28.2 ttpp . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.5 p -160.52 159.14 30.36 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 123.443 0.464 . . . . 0.0 109.956 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.591 HD12 ' SG ' ' A' ' 33' ' ' CYS . 92.4 mt -79.63 132.13 36.17 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.745 -179.32 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.43 -166.37 0.84 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.081 0.467 . . . . 0.0 111.786 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.558 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 12.3 pt-20 -73.1 132.06 42.83 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.15 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.99 36.85 9.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.48 -178.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.405 ' HB1' ' HB3' ' A' ' 3' ' ' LEU . . . -100.78 137.22 39.46 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.791 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.482 ' O ' HD11 ' A' ' 3' ' ' LEU . 10.7 p-10 -56.59 142.14 40.62 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.969 0.414 . . . . 0.0 111.553 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 22.2 p -153.03 171.77 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.3 0.572 . . . . 0.0 111.37 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.521 ' HB2' ' O ' ' A' ' 13' ' ' SER . 66.9 m -156.51 123.79 2.71 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.507 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 32.3 Cg_exo -63.82 -29.26 68.01 Favored 'Trans proline' 0 N--CA 1.474 0.38 0 C-N-CA 123.493 2.795 . . . . 0.0 113.399 -178.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.9 m-90 -78.85 -19.62 51.58 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.003 -179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.521 ' O ' ' HB2' ' A' ' 10' ' ' SER . 9.4 t -178.17 126.29 0.12 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.372 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 159.32 164.61 14.89 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.92 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.466 ' CG ' ' HZ3' ' A' ' 1' ' ' LYS . 0.2 OUTLIER -65.88 158.01 29.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.062 0.458 . . . . 0.0 110.63 179.508 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.1 m -79.62 141.98 36.02 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.668 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.561 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 19.8 m -74.17 141.68 45.5 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.9 m -64.36 146.02 55.11 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -78.44 141.62 61.44 Favored Pre-proline 0 C--N 1.311 -1.09 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.571 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 79.6 Cg_endo -103.49 37.25 5.0 Favored 'Cis proline' 0 N--CA 1.453 -0.902 0 C-N-CA 123.906 -1.289 . . . . 0.0 113.779 1.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.931 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 58.2 m-85 -69.39 159.51 33.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.902 0.382 . . . . 0.0 110.773 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.445 HD23 ' HE1' ' A' ' 38' ' ' TRP . 36.8 tp -132.85 130.19 39.44 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.6 t -69.79 124.98 25.39 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.3 p -148.31 145.27 28.08 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.745 0.307 . . . . 0.0 110.845 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.427 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -113.17 65.78 0.65 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.873 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.484 ' CD1' ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -82.28 -170.2 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.349 -178.762 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -83.16 -50.47 8.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.017 -178.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -59.96 -32.51 70.88 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.649 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -141.81 134.65 14.05 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.06 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.19 -160.75 0.05 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.293 1.995 . . . . 0.0 111.811 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.427 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 90.1 m -59.14 98.51 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.816 0.341 . . . . 0.0 110.104 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.441 ' O ' ' HG2' ' A' ' 34' ' ' ARG . 6.2 p -155.5 144.42 20.66 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.672 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 32.9 m -70.08 110.05 4.91 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.749 -1.574 . . . . 0.0 106.749 177.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.626 ' HB2' ' CD1' ' A' ' 38' ' ' TRP . 12.2 mmm-85 -101.73 167.15 11.0 Favored Pre-proline 0 C--N 1.313 -1.001 0 O-C-N 124.143 0.902 . . . . 0.0 108.632 -178.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.931 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 17.8 Cg_endo -59.81 166.17 8.86 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 121.822 1.681 . . . . 0.0 111.267 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 20.9 tptm -78.22 75.13 4.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.839 0.828 . . . . 0.0 109.428 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.84 47.55 0.05 OUTLIER Glycine 0 N--CA 1.447 -0.626 0 CA-C-N 114.019 -1.446 . . . . 0.0 109.549 -177.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.626 ' CD1' ' HB2' ' A' ' 34' ' ' ARG . 6.8 p-90 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.056 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.6 pttt . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p -161.32 159.79 28.91 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 123.285 0.365 . . . . 0.0 110.204 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.574 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 75.2 mt -79.18 126.25 30.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.457 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.44 ' O ' ' HB1' ' A' ' 7' ' ' ALA . . . -78.9 -166.9 0.98 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.99 0.424 . . . . 0.0 112.043 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.573 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.6 pm0 -67.56 129.95 41.5 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.502 0.668 . . . . 0.0 111.482 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 66.88 39.01 3.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.947 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.574 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -105.38 133.17 50.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.919 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -60.78 136.93 58.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.112 0.482 . . . . 0.0 111.107 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.6 m -91.07 155.43 18.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.273 0.559 . . . . 0.0 111.074 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 25.1 p -79.12 132.06 64.48 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.616 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -63.3 -41.08 28.65 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 123.035 2.49 . . . . 0.0 113.62 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.3 m-90 -129.57 -43.16 1.27 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.7 t -149.56 141.24 23.54 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.92 -139.38 5.61 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 111.519 -0.632 . . . . 0.0 111.519 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.64 150.43 20.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.116 0.484 . . . . 0.0 111.196 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 m -94.45 150.02 20.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.918 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.508 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 60.2 m -64.34 142.38 58.44 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.609 0.242 . . . . 0.0 111.593 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 70.9 m -68.8 142.34 54.91 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.435 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.14 144.28 62.6 Favored Pre-proline 0 C--N 1.315 -0.934 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.534 -179.575 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.462 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 89.2 Cg_endo -100.89 32.47 9.24 Favored 'Cis proline' 0 N--CA 1.451 -0.997 0 C-N-CA 123.334 -1.527 . . . . 0.0 113.479 1.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.573 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 28.1 m-85 -65.63 148.02 52.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.136 0.493 . . . . 0.0 110.455 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.6 tp -122.39 138.23 54.6 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.865 -178.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 48.8 t -69.04 112.71 5.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.02 0.438 . . . . 0.0 109.986 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.413 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 83.9 p -89.44 121.47 31.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.287 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.0 m -119.97 52.29 1.13 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 12.3 pt -81.78 -170.76 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.658 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -72.98 -59.71 2.58 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -177.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -71.68 -32.24 67.65 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -111.5 124.31 32.86 Favored Pre-proline 0 C--N 1.321 -0.662 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.088 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.01 166.33 29.48 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.848 2.365 . . . . 0.0 111.595 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 24' ' ' SER . 92.0 m -49.48 104.35 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.547 0.689 . . . . 0.0 112.046 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.516 ' O ' ' HD3' ' A' ' 34' ' ' ARG . 6.7 p -153.57 137.9 16.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.33 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.3 m -65.42 119.93 11.9 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.516 ' HD3' ' O ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -118.72 159.22 45.13 Favored Pre-proline 0 C--N 1.324 -0.536 0 O-C-N 124.386 1.053 . . . . 0.0 108.223 179.835 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.555 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 50.0 Cg_exo -52.66 159.81 4.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.5 2.133 . . . . 0.0 112.48 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 20' ' ' PRO . 49.3 tptt -77.48 109.91 11.81 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.65 46.96 5.01 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 -177.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 16.7 p90 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.679 -179.204 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.402 ' HZ2' ' CG ' ' A' ' 15' ' ' ASP . 66.2 tttt . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.0 p -161.3 158.07 26.49 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.714 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 71.0 mt -80.82 122.12 26.79 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.559 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.09 -162.44 0.39 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.155 0.502 . . . . 0.0 111.976 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.558 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 8.8 pm0 -63.75 126.17 26.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.573 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.79 45.54 4.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.467 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.714 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -115.61 120.83 40.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.631 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.527 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.2 m-20 -50.99 129.72 24.24 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.188 0.518 . . . . 0.0 112.282 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.89 147.94 30.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.3 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.4 m -78.99 130.57 69.51 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.19 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.458 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 40.0 Cg_endo -66.16 -52.21 0.94 Allowed 'Trans proline' 0 N--CA 1.472 0.216 0 C-N-CA 123.141 2.561 . . . . 0.0 113.604 -178.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.458 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 12.7 m-90 -79.98 -56.31 4.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.76 0.314 . . . . 0.0 111.396 -178.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.7 m -161.8 140.66 9.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.579 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 175.27 -153.85 16.46 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.506 -0.637 . . . . 0.0 111.506 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.402 ' CG ' ' HZ2' ' A' ' 1' ' ' LYS . 45.3 m-20 -70.16 143.21 52.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.999 0.428 . . . . 0.0 110.678 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.6 m -88.48 147.52 24.62 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.604 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.476 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.1 m -69.3 144.53 53.53 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.27 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 83.3 m -66.53 145.79 55.24 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.65 ' HD2' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.19 139.72 56.58 Favored Pre-proline 0 C--N 1.307 -1.239 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.274 -179.473 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.557 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 74.9 Cg_endo -103.04 36.37 5.63 Favored 'Cis proline' 0 N--CA 1.456 -0.732 0 C-N-CA 124.188 -1.172 . . . . 0.0 114.083 1.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.558 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 62.5 m-85 -66.98 147.5 53.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.324 0.583 . . . . 0.0 110.855 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.5 tp -116.47 135.42 53.85 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.168 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.4 t -70.37 124.63 24.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -132.12 134.67 45.72 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.903 0.382 . . . . 0.0 111.143 -178.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.419 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -113.16 85.54 2.2 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 179.663 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.707 ' H ' HD12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -79.84 -171.47 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.887 -178.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -71.91 -69.84 0.37 Allowed 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -177.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -69.19 -41.28 77.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.959 0.409 . . . . 0.0 111.885 -177.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.441 ' O ' HG12 ' A' ' 26' ' ' ILE . 46.7 m-85 -97.71 135.56 21.55 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.125 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.59 -171.26 0.37 Allowed 'Trans proline' 0 C--O 1.238 0.487 0 C-N-CA 122.474 2.116 . . . . 0.0 112.692 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.419 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 75.7 m -61.14 106.02 0.56 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.135 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.527 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 4.5 p -144.32 138.63 28.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.074 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 12.7 m -66.1 130.23 42.51 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.995 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 24.4 mmt85 -128.38 161.51 56.31 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.25 154.37 8.16 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 122.531 2.154 . . . . 0.0 112.314 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 6.9 tmtm? -78.12 71.54 4.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.58 43.9 0.13 Allowed Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.088 -1.415 . . . . 0.0 109.663 -177.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 13.0 p90 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.972 -178.797 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 81.9 tttt . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.6 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.8 p -76.97 146.23 37.6 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 118.889 -1.125 . . . . 0.0 110.88 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.539 HD11 ' SG ' ' A' ' 33' ' ' CYS . 90.4 mt -78.83 137.78 37.86 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.096 -1.411 . . . . 0.0 110.518 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.78 -178.87 5.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.417 ' HB3' ' CZ ' ' A' ' 21' ' ' TYR . 19.6 pt-20 -69.99 134.84 48.74 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.041 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.491 ' HB3' ' NH1' ' A' ' 34' ' ' ARG . . . 56.48 40.15 29.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.311 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.45 135.8 52.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.151 -179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -57.02 141.57 45.24 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.501 0.501 . . . . 0.0 109.881 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.4 m -79.11 163.76 24.83 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.103 0.478 . . . . 0.0 110.982 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.463 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 28.8 p -78.62 115.31 50.68 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.314 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 5.9 Cg_exo -79.13 -56.57 0.04 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.994 2.463 . . . . 0.0 112.348 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 23.8 m-90 -85.41 -40.49 16.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.12 0.486 . . . . 0.0 110.57 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.0 m -87.9 -163.58 0.97 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.243 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -160.08 129.37 2.17 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.136 -1.03 . . . . 0.0 112.412 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -159.41 152.53 22.13 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.6 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 5.9 m -88.14 147.08 25.08 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.985 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.411 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 8.4 m -74.54 145.12 43.7 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.428 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 58.8 m -60.77 144.29 52.74 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.36 144.18 65.81 Favored Pre-proline 0 C--N 1.312 -1.028 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -99.0 52.31 1.36 Allowed 'Cis proline' 0 N--CA 1.454 -0.821 0 C-N-CA 124.065 -1.223 . . . . 0.0 113.905 1.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.417 ' CZ ' ' HB3' ' A' ' 5' ' ' GLU . 37.8 m-85 -105.15 145.98 29.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.056 0.455 . . . . 0.0 110.316 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.7 tp -127.91 143.31 51.1 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.76 -178.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 41.9 t -66.48 122.07 16.74 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.1 p -126.33 139.92 52.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.324 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.9 t -135.58 96.3 3.42 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.607 HD13 ' HB2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -109.59 -168.02 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.911 -179.251 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -70.73 -59.44 2.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -73.65 -34.55 65.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.847 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.607 ' HB2' HD13 ' A' ' 26' ' ' ILE . 8.1 m-85 -109.18 128.15 25.96 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.943 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.04 177.3 5.21 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.887 2.391 . . . . 0.0 112.036 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 98.4 m -58.53 102.13 0.1 Allowed 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.48 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.3 p -153.56 140.91 19.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.609 -179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 25.2 m -71.17 127.58 33.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.491 ' NH1' ' HB3' ' A' ' 6' ' ' ALA . 23.8 mmt180 -132.71 164.67 42.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -46.47 139.96 12.37 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.139 1.893 . . . . 0.0 111.532 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -76.96 103.21 6.77 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.92 45.09 2.13 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.777 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.8 p90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.437 -179.505 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.488 ' HB3' ' HE2' ' A' ' 1' ' ' LYS . 28.0 mtpt . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.607 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.9 p -160.82 149.71 16.66 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.296 0.569 . . . . 0.0 110.527 178.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.478 HD13 ' SG ' ' A' ' 33' ' ' CYS . 98.3 mt -85.53 136.11 33.55 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.332 -178.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.38 -171.5 2.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.025 0.44 . . . . 0.0 111.609 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.46 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 10.9 pt-20 -74.32 137.56 42.94 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.347 0.594 . . . . 0.0 111.272 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 62.69 38.39 12.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.741 -178.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.78 139.39 44.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.311 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.42 ' O ' HD12 ' A' ' 3' ' ' LEU . 3.2 p30 -60.73 149.59 35.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.928 0.394 . . . . 0.0 110.775 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.0 p -153.25 -170.63 3.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.125 0.488 . . . . 0.0 111.093 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.7 m -154.57 144.35 15.44 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.377 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.77 -36.65 91.26 Favored 'Trans proline' 0 CA--C 1.53 0.308 0 C-N-CA 123.547 2.832 . . . . 0.0 113.732 -178.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 9.3 m-90 -128.41 -54.28 1.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.023 0.439 . . . . 0.0 111.579 -179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 t -80.17 61.59 4.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.622 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -167.88 150.55 16.82 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.232 -0.985 . . . . 0.0 112.788 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.06 156.64 24.26 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.814 0.34 . . . . 0.0 110.429 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.607 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 4.5 m -78.2 143.22 37.36 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.549 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 4.9 m -76.82 141.34 40.73 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.349 -178.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 55.5 m -60.65 146.82 44.13 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.1 mmmt -83.31 150.98 61.82 Favored Pre-proline 0 C--N 1.31 -1.114 0 C-N-CA 120.13 -0.628 . . . . 0.0 109.81 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -95.45 40.06 4.57 Favored 'Cis proline' 0 N--CA 1.45 -1.039 0 C-N-CA 123.205 -1.581 . . . . 0.0 114.085 1.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.463 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 29.6 m-85 -84.36 163.36 19.61 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 121.983 -0.448 . . . . 0.0 110.533 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 48.1 tp -138.37 141.55 39.65 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.502 -178.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.549 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 46.7 t -74.12 84.59 1.83 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.668 0.747 . . . . 0.0 110.118 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.644 ' OG ' ' HG3' ' A' ' 34' ' ' ARG . 33.4 p -81.15 136.82 35.93 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.318 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.9 t -136.84 69.29 1.41 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.28 0.562 . . . . 0.0 109.77 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.717 ' H ' HD12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -84.61 -172.4 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.243 -179.744 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -74.52 -51.83 13.62 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.344 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -73.42 -23.08 60.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.763 -178.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.673 ' HB2' HD11 ' A' ' 26' ' ' ILE . 87.3 m-85 -130.67 120.2 18.56 Favored Pre-proline 0 C--N 1.324 -0.532 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.399 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.73 175.02 3.2 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.988 2.458 . . . . 0.0 112.541 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 84.3 m -51.89 106.75 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.275 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.6 p -155.16 137.12 14.57 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.032 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.478 ' SG ' HD13 ' A' ' 3' ' ' LEU . 14.3 m -74.01 128.71 36.23 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 179.478 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.644 ' HG3' ' OG ' ' A' ' 24' ' ' SER . 5.8 mtp180 -142.73 163.87 35.92 Favored Pre-proline 0 C--N 1.318 -0.768 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.463 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 82.8 Cg_exo -46.59 141.57 10.85 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.502 2.135 . . . . 0.0 111.936 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.421 ' HE3' ' HB3' ' A' ' 36' ' ' LYS . 8.6 ttpp -77.05 106.41 8.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.984 0.421 . . . . 0.0 109.905 -179.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.21 46.16 2.88 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.8 p90 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.386 -0.816 . . . . 0.0 110.59 -179.491 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.533 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 9.1 mtpm? . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p -160.83 156.61 25.39 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.357 0.41 . . . . 0.0 110.194 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.54 HD11 ' SG ' ' A' ' 33' ' ' CYS . 88.3 mt -79.95 130.11 35.02 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.3 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.27 -158.38 0.15 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.357 0.599 . . . . 0.0 111.962 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.602 ' HG3' ' CE2' ' A' ' 21' ' ' TYR . 15.0 mp0 -69.97 132.82 46.53 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.209 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.476 ' HB3' ' NH1' ' A' ' 34' ' ' ARG . . . 58.91 45.22 15.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.367 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -113.76 124.75 53.0 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.656 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.526 ' O ' HD13 ' A' ' 3' ' ' LEU . 1.6 p30 -57.84 140.78 51.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.771 0.32 . . . . 0.0 110.711 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 17.4 p -114.32 -173.42 2.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.61 0.719 . . . . 0.0 112.022 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.513 ' HB2' ' HA3' ' A' ' 14' ' ' GLY . 75.3 m -153.88 143.67 15.3 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.471 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.64 -39.5 87.46 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.249 2.632 . . . . 0.0 113.641 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -137.17 -53.22 0.68 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.875 0.369 . . . . 0.0 111.278 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m -76.7 56.06 1.12 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.95 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.513 ' HA3' ' HB2' ' A' ' 10' ' ' SER . . . -173.56 148.29 10.1 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.508 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.533 ' OD2' ' HB3' ' A' ' 1' ' ' LYS . 69.1 m-20 -62.61 151.47 37.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.014 0.435 . . . . 0.0 110.946 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.3 m -79.69 151.47 30.46 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.496 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 60.5 m -64.19 141.27 58.83 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 121.272 -0.171 . . . . 0.0 110.656 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.1 m -64.87 146.5 54.82 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -78.62 142.27 61.49 Favored Pre-proline 0 C--N 1.309 -1.17 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.879 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.503 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 87.7 Cg_endo -101.97 35.11 6.82 Favored 'Cis proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.95 -1.271 . . . . 0.0 113.55 0.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.602 ' CE2' ' HG3' ' A' ' 5' ' ' GLU . 40.4 m-85 -69.62 155.09 41.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.218 0.532 . . . . 0.0 111.041 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.8 tp -131.64 136.17 47.52 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.716 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 16.4 t -74.03 125.1 27.54 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.7 p -126.34 133.21 51.42 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.051 0.453 . . . . 0.0 110.677 -178.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.7 m -99.54 72.66 1.79 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.352 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.716 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -79.89 -175.39 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.032 0.444 . . . . 0.0 111.16 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -82.05 -48.79 10.97 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.787 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -65.74 -26.09 67.57 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.579 -178.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -143.61 136.81 13.94 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.296 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.72 -175.89 0.39 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.487 2.125 . . . . 0.0 111.787 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 62.9 m -52.65 105.6 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.073 0.463 . . . . 0.0 110.996 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 6.0 p -148.81 141.84 24.86 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.053 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.7 m -64.23 126.61 28.32 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.123 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.567 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 23.5 mmt180 -129.5 165.01 35.85 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.567 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 9.4 Cg_endo -56.65 154.32 31.66 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 121.687 1.591 . . . . 0.0 111.66 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 19.1 tptm -77.61 114.62 16.63 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.66 46.47 7.27 Favored Glycine 0 N--CA 1.448 -0.54 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 -177.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.8 p90 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.652 -179.147 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.503 ' HZ2' ' CG ' ' A' ' 15' ' ' ASP . 1.8 pptp? . . . . . 0 N--CA 1.483 1.181 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.1 p -126.69 155.68 42.27 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.023 0.44 . . . . 0.0 110.443 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.573 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 84.3 mt -86.41 123.77 32.01 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.763 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.32 -164.95 0.61 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.987 0.422 . . . . 0.0 111.236 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.419 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 7.1 pt-20 -74.03 131.97 41.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.393 0.616 . . . . 0.0 110.941 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 70.35 35.52 2.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.156 -1.384 . . . . 0.0 110.242 -177.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.573 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -105.57 131.59 52.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.93 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -62.34 131.64 49.97 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.283 0.364 . . . . 0.0 110.306 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.406 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 8.6 m -88.41 155.13 19.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.316 0.579 . . . . 0.0 110.858 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.2 m -79.55 128.14 75.93 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.856 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.29 -57.04 1.02 Allowed 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 123.258 2.639 . . . . 0.0 113.998 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.9 m-90 -89.97 -56.01 3.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.866 0.365 . . . . 0.0 111.554 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 m -159.69 146.16 16.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.976 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 178.17 -147.01 7.77 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.876 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.503 ' CG ' ' HZ2' ' A' ' 1' ' ' LYS . 3.2 m-20 -79.61 141.47 36.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.941 0.4 . . . . 0.0 110.842 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.8 m -83.89 154.37 23.46 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.899 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.445 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.7 m -66.45 141.68 57.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.578 0.228 . . . . 0.0 111.015 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.4 m -66.4 145.4 55.73 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 177.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -78.87 141.01 58.69 Favored Pre-proline 0 C--N 1.31 -1.144 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.254 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.473 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 73.9 Cg_endo -103.82 37.55 4.75 Favored 'Cis proline' 0 N--CA 1.451 -0.973 0 C-N-CA 123.916 -1.285 . . . . 0.0 113.919 1.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.75 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 50.5 m-85 -70.54 158.87 35.34 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.964 0.412 . . . . 0.0 110.499 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.7 tp -133.33 135.12 44.59 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.148 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.6 t -72.16 129.11 37.69 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.0 p -135.98 127.65 29.0 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.644 -178.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 14.8 m -100.08 72.93 1.69 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.528 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.429 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -82.11 -170.91 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.112 0.482 . . . . 0.0 111.141 -179.934 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -85.55 -48.97 8.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.621 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -65.79 -25.27 67.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.406 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.45 ' HA ' ' HD3' ' A' ' 30' ' ' PRO . 83.5 m-85 -141.42 138.22 17.32 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 17.1 Cg_exo -66.23 -165.12 0.09 OUTLIER 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.394 2.063 . . . . 0.0 111.595 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 80.0 m -62.43 99.17 0.13 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.906 0.384 . . . . 0.0 110.142 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.2 p -135.98 142.06 44.48 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.394 -178.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 22.3 m -73.66 118.49 16.68 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 177.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.8 mmm-85 -122.86 160.14 50.51 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.75 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 51.2 Cg_exo -50.93 148.26 17.19 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.072 1.848 . . . . 0.0 111.198 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.473 ' HE3' ' O ' ' A' ' 20' ' ' PRO . 37.1 ttmt -76.94 116.43 17.6 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.34 45.55 5.83 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -177.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 15.5 p90 . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.731 -179.131 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.0 p -160.65 161.68 32.47 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.365 0.416 . . . . 0.0 110.394 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.508 HD11 ' O ' ' A' ' 8' ' ' ASP . 81.9 mt -79.3 134.39 36.62 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.356 -179.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.41 -166.04 0.79 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.309 0.576 . . . . 0.0 112.011 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.1 134.3 46.91 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.762 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.53 ' HB3' ' NH1' ' A' ' 34' ' ' ARG . . . 61.09 42.5 12.37 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.666 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.16 136.31 48.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.201 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.508 ' O ' HD11 ' A' ' 3' ' ' LEU . 3.1 p30 -58.58 147.41 32.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.88 0.372 . . . . 0.0 111.149 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.7 p -146.07 159.08 43.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.389 0.614 . . . . 0.0 111.682 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 71.6 m -157.42 146.16 14.61 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.468 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.31 -42.98 57.11 Favored 'Trans proline' 0 CA--C 1.529 0.236 0 C-N-CA 123.606 2.871 . . . . 0.0 113.229 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -111.28 -50.85 2.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.131 0.491 . . . . 0.0 110.683 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.0 t -85.9 52.66 2.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.893 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -169.5 145.65 9.5 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.117 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -82.25 -177.84 6.8 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -85.23 141.7 29.94 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.562 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 56.3 m -73.09 141.38 47.56 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.476 0.179 . . . . 0.0 110.551 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.5 m -66.5 140.41 58.0 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 177.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.602 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.8 OUTLIER -78.54 148.53 73.57 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -179.575 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.447 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.5 Cg_endo -98.08 38.67 5.46 Favored 'Cis proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.182 -1.591 . . . . 0.0 113.924 1.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -81.91 147.89 29.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.027 0.441 . . . . 0.0 110.502 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 54.1 tp -118.75 140.97 49.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.245 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.562 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 40.9 t -72.61 104.11 3.78 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 76.8 p -98.4 139.62 33.88 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.449 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.0 t -140.3 63.25 1.48 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.378 0.609 . . . . 0.0 109.489 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.735 HD13 ' HB2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -85.01 -167.05 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.26 -179.678 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -69.52 -59.29 3.07 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -71.41 -35.4 70.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.683 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.735 ' HB2' HD13 ' A' ' 26' ' ' ILE . 15.5 m-85 -109.4 123.57 36.27 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.831 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -71.35 172.89 13.24 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 122.741 2.294 . . . . 0.0 111.414 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.2 m -51.31 103.16 0.05 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.991 0.424 . . . . 0.0 111.148 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.7 p -160.13 137.08 9.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.644 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.9 m -67.01 127.54 32.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.719 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.53 ' NH1' ' HB3' ' A' ' 6' ' ' ALA . 24.5 mmt180 -134.26 162.16 59.38 Favored Pre-proline 0 C--N 1.324 -0.534 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -50.9 147.92 17.8 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.116 1.877 . . . . 0.0 111.58 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 35.4 ttpt -77.16 113.97 15.47 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.66 46.76 4.48 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 28.7 p90 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.559 -179.381 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.425 ' HZ3' ' CG ' ' A' ' 15' ' ' ASP . 22.7 mtmm . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.1 p -150.45 149.54 30.14 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.191 0.519 . . . . 0.0 110.302 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.548 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 80.0 mt -79.89 135.08 36.35 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.386 -178.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.15 -168.62 1.34 Allowed 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.471 ' OE2' ' HG3' ' A' ' 35' ' ' PRO . 40.0 tt0 -70.61 135.01 48.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.007 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.11 43.26 11.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.726 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.54 127.24 53.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.741 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.468 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 5.6 t70 -57.01 132.72 53.73 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.548 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 30.4 p -94.47 170.21 9.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.832 0.825 . . . . 0.0 112.509 -178.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.9 p -78.89 120.27 80.25 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.952 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.45 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 38.0 Cg_endo -66.95 -46.08 3.56 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 122.948 2.432 . . . . 0.0 112.903 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.45 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 11.1 m-90 -91.36 -53.97 4.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.707 0.289 . . . . 0.0 111.268 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.3 t -173.21 148.57 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.233 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.7 -153.25 22.84 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.298 -0.721 . . . . 0.0 111.298 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.425 ' CG ' ' HZ3' ' A' ' 1' ' ' LYS . 4.9 m-20 -74.34 138.49 43.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.126 0.488 . . . . 0.0 110.368 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.501 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.8 m -83.14 156.46 23.25 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.353 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.502 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 31.1 m -63.84 143.94 57.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.81 -0.177 . . . . 0.0 110.695 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.0 m -63.4 145.21 56.07 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt -78.47 145.4 67.68 Favored Pre-proline 0 C--N 1.312 -1.043 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.314 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.665 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 90.0 Cg_endo -99.67 28.6 14.38 Favored 'Cis proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.023 -1.657 . . . . 0.0 113.583 1.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -64.85 153.0 41.45 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.312 0.577 . . . . 0.0 111.57 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 44.7 tp -131.68 140.74 49.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.187 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.636 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 16.6 t -75.3 120.51 20.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.998 0.428 . . . . 0.0 110.028 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.4 p -110.72 126.8 54.94 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.412 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 58.7 m -101.79 68.97 1.18 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.411 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.776 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -80.96 -172.97 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.998 0.428 . . . . 0.0 111.289 -179.962 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -86.17 -49.22 7.9 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.944 -178.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -66.14 -25.28 66.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.618 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.456 ' HB2' HD12 ' A' ' 26' ' ' ILE . 88.5 m-85 -139.11 138.23 20.62 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.935 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.15 -174.59 0.33 Allowed 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.448 2.099 . . . . 0.0 111.857 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 79.6 m -59.38 99.91 0.07 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.109 0.481 . . . . 0.0 110.503 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.468 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 3.9 p -139.1 138.51 37.12 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.202 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.636 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -65.48 127.44 31.84 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.649 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.434 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 25.6 mmt180 -130.37 164.77 38.83 Favored Pre-proline 0 C--N 1.324 -0.542 0 O-C-N 124.622 1.201 . . . . 0.0 107.88 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.471 ' HG3' ' OE2' ' A' ' 5' ' ' GLU . 32.4 Cg_exo -51.03 153.7 8.51 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.316 2.01 . . . . 0.0 112.02 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.665 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 40.3 tttp -77.65 114.52 16.58 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.0 47.84 5.39 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -177.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.3 p90 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.709 -179.335 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.55 ' HE2' ' OD2' ' A' ' 15' ' ' ASP . 9.2 mmmm . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.5 p -161.92 153.57 18.75 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.052 0.453 . . . . 0.0 110.827 178.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.489 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.9 mt -80.99 134.67 35.73 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.891 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.48 -168.56 1.39 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.143 0.497 . . . . 0.0 111.665 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.613 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 9.3 pt-20 -73.13 135.56 44.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.551 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.529 ' HA ' ' HD2' ' A' ' 34' ' ' ARG . . . 62.92 44.56 6.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.906 -178.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -119.51 127.76 53.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.535 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -52.86 135.26 36.38 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.5 p -111.93 -176.38 2.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 122.093 0.949 . . . . 0.0 113.059 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.417 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 58.6 m -157.85 144.49 13.07 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 114.544 -1.207 . . . . 0.0 109.366 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.491 ' HB2' ' CE3' ' A' ' 12' ' ' TRP . 24.1 Cg_exo -62.52 -43.88 20.21 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.799 2.333 . . . . 0.0 112.725 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.491 ' CE3' ' HB2' ' A' ' 11' ' ' PRO . 11.5 m-90 -136.53 -34.2 0.77 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.768 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 p -77.77 44.79 0.47 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.41 160.49 20.08 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.18 -1.009 . . . . 0.0 112.648 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.55 ' OD2' ' HE2' ' A' ' 1' ' ' LYS . 64.7 m-20 -60.96 153.1 25.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.922 0.391 . . . . 0.0 110.827 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.419 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.6 m -79.49 149.82 31.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 55.9 m -61.75 140.61 58.2 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.407 0.146 . . . . 0.0 111.219 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.7 m -64.81 144.35 57.31 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.8 pttp -78.14 142.27 63.67 Favored Pre-proline 0 C--N 1.312 -1.045 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.643 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 76.8 Cg_endo -102.74 38.22 4.82 Favored 'Cis proline' 0 N--CA 1.455 -0.774 0 C-N-CA 123.948 -1.271 . . . . 0.0 113.901 1.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.613 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 38.0 m-85 -74.0 143.67 45.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.352 0.596 . . . . 0.0 110.824 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.1 tp -115.04 138.66 50.61 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.008 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.8 t -73.23 103.41 3.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.581 0.705 . . . . 0.0 110.53 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 52.3 p -80.38 132.6 35.79 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.87 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.2 t -143.25 53.92 1.35 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.454 0.645 . . . . 0.0 109.384 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.613 HG12 ' HB2' ' A' ' 29' ' ' TYR . 28.7 pt -85.79 -165.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.622 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.48 -56.48 15.75 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -79.83 -31.9 40.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.98 0.419 . . . . 0.0 112.117 -178.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.613 ' HB2' HG12 ' A' ' 26' ' ' ILE . 3.1 m-85 -102.66 111.06 64.44 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.613 -179.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -65.86 162.57 34.37 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.766 2.311 . . . . 0.0 110.425 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 27.8 m -48.64 97.93 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.119 0.485 . . . . 0.0 111.924 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 p -153.92 139.01 17.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.539 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -65.68 120.37 12.85 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.529 ' HD2' ' HA ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -123.58 158.06 60.33 Favored Pre-proline 0 C--N 1.321 -0.636 0 O-C-N 124.624 1.203 . . . . 0.0 107.877 179.923 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.473 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 50.2 Cg_exo -53.38 154.57 14.56 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.216 1.944 . . . . 0.0 111.644 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 1.6 tmtp? -77.09 108.49 10.2 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.01 46.47 3.35 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.6 p90 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.385 -0.816 . . . . 0.0 110.672 -179.355 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.617 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 7.4 p -160.87 158.15 27.82 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 123.84 0.713 . . . . 0.0 109.306 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.581 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 70.8 mt -79.61 119.33 22.41 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.251 -0.432 . . . . 0.0 109.958 -179.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 7' ' ' ALA . . . -78.31 -163.41 0.44 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.034 0.445 . . . . 0.0 111.575 -179.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.41 ' H ' ' HG2' ' A' ' 5' ' ' GLU . 6.9 pt-20 -72.28 134.08 45.37 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.335 0.588 . . . . 0.0 110.936 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 68.71 37.53 2.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.416 -177.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.581 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -107.19 128.74 54.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.078 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -58.93 133.72 56.31 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.325 0.391 . . . . 0.0 111.104 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 m -93.8 153.46 18.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.317 0.58 . . . . 0.0 110.453 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.4 m -79.52 129.89 70.06 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.916 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.8 -57.31 0.86 Allowed 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 123.277 2.651 . . . . 0.0 113.968 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 19.8 m-90 -82.12 -50.61 8.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.827 0.346 . . . . 0.0 111.296 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.1 t -175.22 150.21 1.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.01 -144.55 5.16 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.948 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.617 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 0.1 OUTLIER -79.13 157.93 27.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.265 0.555 . . . . 0.0 111.671 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.6 m -93.22 150.61 20.37 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.199 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.435 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.1 m -71.27 144.09 50.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.097 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.9 m -64.68 147.92 52.05 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.3 137.8 60.1 Favored Pre-proline 0 C--N 1.314 -0.972 0 CA-C-O 120.796 0.332 . . . . 0.0 110.941 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.621 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 69.1 Cg_endo -104.89 37.09 4.59 Favored 'Cis proline' 0 N--CA 1.454 -0.843 0 C-N-CA 124.346 -1.106 . . . . 0.0 113.72 0.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.672 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 41.7 m-85 -71.14 143.19 50.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.223 0.535 . . . . 0.0 110.649 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 tp -117.26 139.65 50.54 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.795 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.659 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.1 t -74.08 116.09 14.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.038 0.447 . . . . 0.0 109.798 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 84.2 p -107.95 143.47 36.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.656 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -143.3 58.43 1.4 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.409 HG13 ' H ' ' A' ' 29' ' ' TYR . 38.0 pt -84.55 -162.73 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.341 -179.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -67.38 -62.66 1.31 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.709 -178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -72.71 -41.76 64.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.607 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.409 ' H ' HG13 ' A' ' 26' ' ' ILE . 3.2 m-85 -95.99 120.87 62.21 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.747 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.69 172.46 15.74 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.562 2.175 . . . . 0.0 110.98 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.9 m -52.32 99.25 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.0 0.429 . . . . 0.0 111.196 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.8 p -160.07 143.49 13.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.739 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.659 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.0 m -69.43 132.04 45.72 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -133.93 161.49 63.42 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.672 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 50.9 Cg_exo -51.39 153.19 10.52 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.434 2.09 . . . . 0.0 111.918 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.621 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 59.4 tttm -77.32 103.56 7.33 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.74 46.71 2.64 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 -177.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.6 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.819 -179.198 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.5 p -160.14 154.78 24.05 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.002 0.429 . . . . 0.0 110.15 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.503 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 85.8 mt -79.85 132.82 36.19 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.077 -179.036 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.16 -179.55 6.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.697 0.284 . . . . 0.0 110.675 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.417 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 11.5 pt-20 -70.79 141.53 51.39 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.29 0.567 . . . . 0.0 110.807 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 66.45 45.43 2.14 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.389 -177.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -132.09 124.23 28.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.898 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.615 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 36.0 m-20 -56.97 131.09 48.75 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 123.418 0.449 . . . . 0.0 110.835 -179.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.503 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 31.8 p -91.08 169.62 10.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.641 0.734 . . . . 0.0 112.072 -178.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.5 m -81.77 125.05 78.93 Favored Pre-proline 0 C--N 1.319 -0.724 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.276 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.437 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 38.8 Cg_endo -67.61 -51.96 0.63 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.86 2.373 . . . . 0.0 113.575 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.437 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 14.7 m-90 -82.06 -52.38 7.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.712 0.291 . . . . 0.0 111.334 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.3 t -174.18 148.14 1.29 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.117 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 169.34 -151.78 18.26 Favored Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -72.28 141.94 48.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.387 0.613 . . . . 0.0 110.462 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.0 m -85.65 154.51 21.63 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.842 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.474 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 33.4 m -67.79 139.37 56.62 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.7 m -61.69 147.52 45.75 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.649 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -78.77 144.7 65.0 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.135 -179.965 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.433 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 87.0 Cg_endo -101.66 34.95 7.05 Favored 'Cis proline' 0 N--CA 1.45 -1.037 0 C-N-CA 123.438 -1.484 . . . . 0.0 113.507 1.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.545 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 43.0 m-85 -73.35 174.96 7.37 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.112 0.482 . . . . 0.0 111.339 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.553 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 49.6 tp -152.7 142.44 21.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.136 -178.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 18.0 t -75.85 112.03 11.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.349 0.595 . . . . 0.0 110.608 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.4 p -101.68 137.4 40.04 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.01 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.9 t -129.91 71.79 1.46 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.29 0.567 . . . . 0.0 109.906 -179.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.668 HD11 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -90.42 -167.98 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.93 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -75.91 -52.92 9.26 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.245 -178.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -70.8 -25.83 63.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.177 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.581 ' HB2' HD13 ' A' ' 26' ' ' ILE . 32.4 m-85 -128.94 128.34 23.41 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.633 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.92 179.23 2.86 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.756 2.304 . . . . 0.0 111.757 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 87.3 m -57.61 95.52 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.157 0 O-C-N 123.301 0.375 . . . . 0.0 110.492 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.615 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 8.7 p -144.57 142.21 30.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.193 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -70.78 129.67 39.71 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.236 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -139.05 163.9 42.94 Favored Pre-proline 0 C--N 1.318 -0.796 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.545 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 52.6 Cg_exo -49.67 141.73 26.39 Favored 'Trans proline' 0 N--CA 1.464 -0.234 0 C-N-CA 121.99 1.793 . . . . 0.0 111.122 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.553 ' HE2' ' HB2' ' A' ' 22' ' ' LEU . 30.3 ttmt -77.94 123.56 26.93 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.75 43.51 6.79 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -178.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 15.8 p90 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.41 -0.805 . . . . 0.0 110.46 -179.484 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.483 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.3 p -159.3 151.24 20.73 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.463 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.656 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 87.4 mt -86.46 121.59 29.22 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.725 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.79 -162.18 0.35 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.256 0.55 . . . . 0.0 112.216 -178.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.453 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 8.4 pm0 -64.06 125.71 25.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.792 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.74 45.45 5.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.277 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.656 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -111.38 117.75 33.95 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.785 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.528 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 1.2 m-20 -56.68 131.66 49.68 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.379 0.609 . . . . 0.0 111.614 -179.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.432 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 2.7 m -83.1 154.92 24.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.439 -178.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.2 m -79.1 130.56 69.15 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.907 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.431 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 29.2 Cg_endo -63.83 -55.29 0.69 Allowed 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.021 2.481 . . . . 0.0 113.78 -178.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.431 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.0 m-90 -80.26 -52.24 7.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.727 0.299 . . . . 0.0 111.32 -179.023 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.9 p -174.09 149.35 1.44 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.474 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.09 -151.43 10.24 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -79.61 147.35 32.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.295 0.569 . . . . 0.0 111.067 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.483 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.1 m -83.71 156.53 22.55 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.122 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.46 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 45.6 m -64.22 141.01 58.92 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.426 0.155 . . . . 0.0 110.834 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.2 m -63.74 148.19 49.78 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.662 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.02 141.89 59.16 Favored Pre-proline 0 C--N 1.312 -1.058 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.196 -179.888 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -104.64 40.98 3.13 Favored 'Cis proline' 0 N--CA 1.448 -1.179 0 C-N-CA 123.752 -1.353 . . . . 0.0 113.641 1.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.453 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 59.8 m-85 -72.41 179.48 3.44 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.317 0.579 . . . . 0.0 111.417 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.568 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 59.7 tp -151.95 138.92 19.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.783 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.1 t -71.84 111.76 7.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.822 0.344 . . . . 0.0 111.132 -179.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.724 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 72.2 p -84.91 108.0 17.34 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.9 t -118.99 59.04 0.84 Allowed 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.108 -177.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.594 HG13 ' HB2' ' A' ' 29' ' ' TYR . 10.3 pt -90.22 -171.07 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.983 0.42 . . . . 0.0 111.332 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -67.01 -81.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -177.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.54 ' HD1' ' HD1' ' A' ' 29' ' ' TYR . 0.3 OUTLIER -79.86 36.06 0.32 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -177.032 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.594 ' HB2' HG13 ' A' ' 26' ' ' ILE . 11.3 m-85 -148.67 131.52 7.99 Favored Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 177.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -60.98 131.21 35.92 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.553 2.169 . . . . 0.0 111.0 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.724 ' HA ' ' O ' ' A' ' 24' ' ' SER . 69.8 m -61.99 100.56 0.16 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.446 0.641 . . . . 0.0 111.015 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.528 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 5.2 p -145.02 148.25 33.52 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.389 -178.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 14.9 m -67.54 128.84 37.95 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 120.933 0.397 . . . . 0.0 110.242 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.584 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 26.0 mmt85 -132.48 168.07 19.53 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.884 -1.524 . . . . 0.0 106.884 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.584 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 10.0 Cg_endo -55.02 151.15 35.27 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 121.429 1.419 . . . . 0.0 110.48 179.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.568 ' HE2' ' HB2' ' A' ' 22' ' ' LEU . 20.2 ttmt -77.41 118.21 19.65 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.323 -178.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.74 47.01 1.55 Allowed Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.5 -178.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 C--O 1.253 1.243 0 CA-C-O 117.853 -1.07 . . . . 0.0 110.072 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.4 tptp . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p -161.96 159.27 26.35 Favored 'General case' 0 C--N 1.322 -0.628 0 O-C-N 123.596 0.56 . . . . 0.0 109.988 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.538 HD11 ' SG ' ' A' ' 33' ' ' CYS . 82.1 mt -80.03 133.09 36.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.351 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.41 -168.09 1.25 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.202 0.525 . . . . 0.0 112.031 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.493 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 6.4 pt-20 -72.96 132.52 43.54 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.106 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.67 38.74 9.2 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.535 -1.212 . . . . 0.0 110.411 -178.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.86 133.58 52.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.396 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -58.68 145.39 40.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.261 0.553 . . . . 0.0 111.473 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.22 142.72 50.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.826 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.5 m -79.8 128.45 74.24 Favored Pre-proline 0 C--N 1.318 -0.79 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.489 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.478 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 51.8 Cg_endo -67.87 -43.31 5.29 Favored 'Trans proline' 0 N--CA 1.474 0.334 0 C-N-CA 123.434 2.756 . . . . 0.0 113.925 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.478 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 19.4 m-90 -78.99 -44.82 21.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.611 0.243 . . . . 0.0 111.453 -178.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.2 t -175.47 139.09 0.42 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.303 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.71 -147.83 7.01 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -81.29 152.02 27.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.93 0.395 . . . . 0.0 110.24 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 m -85.49 144.3 28.03 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.446 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 54.3 m -72.16 140.58 48.87 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.0 m -64.13 142.39 58.43 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.63 ' HD2' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.64 143.83 63.9 Favored Pre-proline 0 C--N 1.311 -1.101 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.12 -179.555 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -101.0 44.53 2.81 Favored 'Cis proline' 0 N--CA 1.455 -0.768 0 C-N-CA 124.069 -1.221 . . . . 0.0 113.858 1.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.493 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 40.3 m-85 -87.5 147.0 25.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.154 0.502 . . . . 0.0 110.634 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 56.7 tp -121.61 143.66 49.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.759 -179.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 41.9 t -68.02 114.23 6.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.926 0.393 . . . . 0.0 109.951 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.551 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 97.4 p -96.51 126.68 41.87 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.122 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 77.5 m -122.52 59.19 1.04 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.004 0.43 . . . . 0.0 110.407 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.657 HD11 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -84.72 -174.85 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.986 0.422 . . . . 0.0 111.055 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -81.16 -47.98 12.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.53 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -64.97 -25.37 67.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.646 -178.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.524 ' HB2' HD13 ' A' ' 26' ' ' ILE . 96.9 m-85 -141.75 128.93 11.52 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.562 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.03 173.65 5.72 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.869 2.379 . . . . 0.0 112.229 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 24' ' ' SER . 92.6 m -50.33 108.55 0.23 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.522 0.677 . . . . 0.0 111.768 -179.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.4 p -152.46 131.32 12.48 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.969 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.9 m -65.32 128.19 34.85 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.401 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 81.0 mtt-85 -138.16 162.85 51.48 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.401 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 51.5 Cg_exo -48.69 144.1 15.22 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.244 1.962 . . . . 0.0 111.483 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -77.16 119.8 21.36 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.59 44.68 6.05 Favored Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 110.784 -0.926 . . . . 0.0 110.784 -178.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.8 p90 . . . . . 0 C--O 1.252 1.199 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.421 -179.625 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.489 ' HG2' ' N ' ' A' ' 2' ' ' CYS . 19.8 ttpp . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.665 ' HA ' ' O ' ' A' ' 16' ' ' SER . 18.4 p -113.63 157.94 21.49 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.504 178.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.52 HD12 ' SG ' ' A' ' 33' ' ' CYS . 93.0 mt -99.71 130.15 45.9 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.773 -178.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.01 -165.88 0.72 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.095 0.474 . . . . 0.0 111.719 -179.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.591 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 13.2 pt-20 -71.35 131.65 43.71 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.054 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 65.4 38.9 5.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.553 -178.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -106.13 126.9 52.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.457 -179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -51.72 136.75 26.85 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.415 0.447 . . . . 0.0 111.021 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 32' ' ' SER . 1.4 p -129.59 142.54 50.72 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.909 0.861 . . . . 0.0 112.213 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.2 m -79.9 130.49 66.74 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 114.293 -1.322 . . . . 0.0 110.336 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.463 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 58.8 Cg_endo -69.54 -43.58 2.75 Favored 'Trans proline' 0 N--CA 1.474 0.333 0 C-N-CA 123.386 2.724 . . . . 0.0 113.981 -178.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.463 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.3 m-90 -79.07 -45.53 19.93 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.8 t -175.36 143.93 0.68 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.786 0.326 . . . . 0.0 111.106 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.61 -153.16 18.21 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.442 ' OD2' ' HB3' ' A' ' 1' ' ' LYS . 11.5 m-20 -69.8 145.81 51.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.099 0.476 . . . . 0.0 110.332 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.665 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 3.9 m -86.21 146.54 26.51 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.19 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.441 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.3 m -69.66 139.35 53.51 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.805 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 56.4 m -63.47 149.19 46.65 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -78.91 142.33 60.21 Favored Pre-proline 0 C--N 1.311 -1.094 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.17 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -103.16 39.47 4.09 Favored 'Cis proline' 0 N--CA 1.45 -1.046 0 C-N-CA 123.991 -1.254 . . . . 0.0 113.81 1.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.591 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 57.4 m-85 -77.71 -176.37 4.33 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 121.992 -0.442 . . . . 0.0 111.202 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.6 tp -159.21 139.52 12.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.3 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.9 t -69.65 112.57 6.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.842 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.595 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 55.2 p -99.45 108.62 21.12 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.074 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 31' ' ' CYS . 1.8 t -103.96 58.41 0.73 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.062 -178.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.731 ' H ' HD12 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -91.4 -175.41 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.18 -179.612 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -86.67 -56.65 3.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -178.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -61.47 -32.87 72.89 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.827 -178.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.713 ' HB2' HD11 ' A' ' 26' ' ' ILE . 7.8 m-85 -115.7 129.55 25.06 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.801 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.7 142.64 91.3 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.545 2.164 . . . . 0.0 111.409 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.595 ' HA ' ' O ' ' A' ' 24' ' ' SER . 72.4 m -54.84 100.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.816 0.817 . . . . 0.0 111.348 -179.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.404 ' HA ' ' SG ' ' A' ' 9' ' ' CYS . 6.4 p -153.37 149.59 27.98 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.144 -0.934 . . . . 0.0 110.254 -178.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.7 m -67.99 128.71 37.51 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -132.92 164.44 43.85 Favored Pre-proline 0 C--N 1.32 -0.687 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.99 143.38 24.51 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.028 1.818 . . . . 0.0 110.795 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.573 ' HB2' ' HZ3' ' A' ' 36' ' ' LYS . 4.7 ttmp? -77.34 115.89 17.49 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -179.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.53 44.6 3.94 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -177.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.5 p90 . . . . . 0 C--O 1.252 1.196 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.449 -179.258 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.482 ' HG3' ' N ' ' A' ' 2' ' ' CYS . 51.6 tptt . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.4 p -149.41 149.38 30.74 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.516 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 85.3 mt -79.63 137.37 37.08 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.004 -178.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.62 -166.78 0.93 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.224 0.535 . . . . 0.0 112.065 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -72.06 134.37 45.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.906 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.11 46.07 6.63 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.508 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -122.01 122.5 39.45 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.458 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.651 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 37.4 m-20 -57.21 131.17 49.17 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.57 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.516 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 26.2 p -95.88 -173.98 3.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.455 -179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 21.1 t -160.29 138.74 7.54 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.58 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.59 -31.56 87.11 Favored 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 123.127 2.551 . . . . 0.0 113.307 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -137.54 -51.44 0.63 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.869 0.366 . . . . 0.0 111.42 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 m -79.42 50.96 1.16 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.942 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 178.41 141.12 4.16 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.657 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.99 163.83 18.99 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.121 0.486 . . . . 0.0 111.098 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 15.9 m -79.15 153.84 29.77 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.962 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 12.5 m -64.28 142.87 58.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.364 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.9 m -64.64 144.73 57.01 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 177.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.68 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -77.55 143.23 67.71 Favored Pre-proline 0 C--N 1.313 -0.992 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.892 -178.742 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.522 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 84.6 Cg_endo -102.72 35.64 6.18 Favored 'Cis proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.181 -1.591 . . . . 0.0 113.893 1.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.401 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 62.4 m-85 -67.2 150.06 49.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.29 0.567 . . . . 0.0 111.368 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.0 tp -124.89 134.4 52.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.567 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.634 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 11.3 t -74.87 122.42 23.36 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.0 p -126.69 129.3 48.17 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.243 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.1 76.6 1.47 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.309 -179.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.73 ' H ' HD12 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -84.9 -168.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.036 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -84.98 -50.56 7.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.915 -178.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -66.99 -26.45 66.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.513 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.572 ' HB2' HD11 ' A' ' 26' ' ' ILE . 75.6 m-85 -136.99 138.38 25.65 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.47 ' HG2' ' OD1' ' A' ' 8' ' ' ASP . 36.4 Cg_endo -67.17 -158.92 0.04 OUTLIER 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.225 1.95 . . . . 0.0 112.215 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 73.1 m -68.28 77.38 0.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.033 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.651 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 3.5 p -114.65 141.5 47.71 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.634 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 21.2 m -71.95 118.58 14.99 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 24.5 mmm-85 -121.47 162.08 38.04 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.401 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 47.7 Cg_exo -50.99 152.28 10.46 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.28 1.986 . . . . 0.0 112.121 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 21.4 tptm -77.42 108.31 10.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.75 47.51 3.94 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.063 -1.215 . . . . 0.0 110.063 -177.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.5 p90 . . . . . 0 C--O 1.252 1.195 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.897 -179.08 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.554 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 7.6 ptpp? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 16' ' ' SER . 25.7 p -118.59 150.39 39.75 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.649 178.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.541 HD12 ' SG ' ' A' ' 33' ' ' CYS . 82.3 mt -84.91 127.88 34.36 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.607 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.77 -163.48 0.48 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.078 0.466 . . . . 0.0 111.634 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.599 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 5.0 pt-20 -70.93 130.97 42.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.347 0.594 . . . . 0.0 111.341 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 64.52 39.96 6.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.855 -178.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.468 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -106.37 128.55 54.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.473 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.441 ' O ' HD11 ' A' ' 3' ' ' LEU . 3.6 p30 -58.81 138.47 57.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.155 0.502 . . . . 0.0 111.406 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 32' ' ' SER . 4.4 m -97.57 151.66 19.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.125 0.488 . . . . 0.0 110.629 -179.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.1 m -79.57 128.23 75.58 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.973 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.438 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 30.3 Cg_endo -63.96 -54.82 0.78 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 123.041 2.494 . . . . 0.0 113.722 -178.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.438 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.2 m-90 -80.61 -52.55 7.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.797 0.332 . . . . 0.0 111.255 -179.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 t -175.86 150.01 0.98 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.67 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.69 -142.77 6.96 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.878 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.554 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 46.6 m-20 -72.13 144.67 48.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.204 0.526 . . . . 0.0 110.652 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.576 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 7.7 m -95.75 150.72 20.08 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.816 179.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.637 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 60.7 m -63.71 142.98 58.2 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.618 0.247 . . . . 0.0 111.625 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.5 m -68.12 143.66 55.34 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 177.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -78.87 141.73 59.65 Favored Pre-proline 0 C--N 1.311 -1.097 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.417 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.532 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 86.7 Cg_endo -102.91 36.48 5.62 Favored 'Cis proline' 0 N--CA 1.454 -0.827 0 C-N-CA 124.18 -1.175 . . . . 0.0 113.931 1.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.599 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 32.8 m-85 -69.53 150.05 47.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.146 0.498 . . . . 0.0 110.774 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -119.64 134.68 55.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.719 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.66 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.1 t -76.16 113.12 13.34 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.829 0.347 . . . . 0.0 111.013 179.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.672 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 64.8 p -84.88 102.73 13.34 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.497 ' HA ' ' HA ' ' A' ' 31' ' ' CYS . 4.2 t -110.13 54.89 0.65 Allowed 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -178.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.487 HD12 ' CH2' ' A' ' 38' ' ' TRP . 16.0 pt -110.2 -170.56 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.202 -179.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -78.36 -56.53 4.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.228 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -65.15 -33.56 76.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.168 0.508 . . . . 0.0 111.289 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -114.54 112.69 45.69 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.027 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -56.33 141.36 89.02 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.9 2.4 . . . . 0.0 111.4 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.672 ' HA ' ' O ' ' A' ' 24' ' ' SER . 62.8 m -50.92 96.51 0.01 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.766 0.794 . . . . 0.0 112.536 -178.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.408 ' HA ' ' SG ' ' A' ' 9' ' ' CYS . 7.7 p -158.2 145.04 17.7 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.772 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.66 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -67.11 125.65 26.7 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.58 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 25.0 mmt85 -123.23 166.25 19.0 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.58 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 12.2 Cg_endo -57.2 166.25 4.53 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 121.629 1.553 . . . . 0.0 111.398 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 47.7 tttp -77.83 73.91 4.39 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.959 0.885 . . . . 0.0 109.53 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.27 49.39 0.05 OUTLIER Glycine 0 N--CA 1.441 -0.998 0 CA-C-N 113.697 -1.592 . . . . 0.0 109.469 -177.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.487 ' CH2' HD12 ' A' ' 26' ' ' ILE . 23.2 p-90 . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.404 -178.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? . . . . . 0 N--CA 1.482 1.14 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.2 p -162.32 153.83 18.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.109 0.481 . . . . 0.0 110.778 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.554 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 89.1 mt -80.28 128.17 33.22 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.372 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 7' ' ' ALA . . . -78.65 -166.65 0.91 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.991 0.424 . . . . 0.0 111.424 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.595 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 8.1 pt-20 -72.4 130.89 41.78 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.152 0.501 . . . . 0.0 110.791 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 69.69 34.23 2.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.428 -178.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.554 ' HB1' ' HB3' ' A' ' 3' ' ' LEU . . . -104.14 127.03 51.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.815 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -57.16 132.72 53.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.846 0.355 . . . . 0.0 111.31 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.09 137.03 52.55 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.499 0.666 . . . . 0.0 110.952 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.0 m -79.44 128.87 73.81 Favored Pre-proline 0 C--N 1.314 -0.945 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.475 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.495 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 56.5 Cg_endo -68.42 -41.12 6.98 Favored 'Trans proline' 0 N--CA 1.474 0.338 0 C-N-CA 123.557 2.838 . . . . 0.0 113.943 -178.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.495 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 20.8 m-90 -78.7 -43.16 26.51 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.09 -178.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 t -177.79 138.55 0.21 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.474 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.91 -153.74 10.41 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -83.01 152.34 25.45 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.3 m -83.54 144.76 29.29 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.016 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.454 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 12.9 m -70.9 138.16 49.9 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.8 m -61.82 146.68 48.82 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 178.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -82.75 147.79 56.09 Favored Pre-proline 0 C--N 1.311 -1.096 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.152 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.537 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 94.1 Cg_endo -97.82 32.28 10.92 Favored 'Cis proline' 0 N--CA 1.451 -0.997 0 C-N-CA 122.988 -1.672 . . . . 0.0 113.752 1.218 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.595 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 39.1 m-85 -70.6 156.54 39.3 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.199 0.523 . . . . 0.0 111.304 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 tp -131.36 140.7 49.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.316 -178.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.602 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 50.6 t -71.68 125.51 27.29 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.419 ' OG ' ' HG2' ' A' ' 34' ' ' ARG . 63.6 p -132.46 133.99 44.52 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -179.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -118.65 86.37 2.53 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.568 HG23 ' HZ2' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -91.26 -168.76 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.544 -179.425 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -75.32 -64.13 1.13 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.02 -39.58 87.07 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.955 0.407 . . . . 0.0 111.367 -177.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.459 ' HB2' HD11 ' A' ' 26' ' ' ILE . 31.6 m-85 -105.77 129.79 24.07 Favored Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 16.2 Cg_exo -67.2 -167.95 0.15 Allowed 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.34 2.027 . . . . 0.0 111.596 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 90.0 m -62.86 104.61 0.56 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.0 p -144.98 137.53 26.17 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.894 0.378 . . . . 0.0 111.597 -178.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.602 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.9 m -72.53 120.59 18.35 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 177.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.419 ' HG2' ' OG ' ' A' ' 24' ' ' SER . 21.1 mmm-85 -121.45 167.2 13.96 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.572 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 72.7 Cg_exo -47.62 163.95 0.17 Allowed 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 122.726 2.284 . . . . 0.0 112.591 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 22.3 tptm -76.86 73.14 3.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.745 0.783 . . . . 0.0 109.666 -179.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 123.65 23.37 2.09 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.92 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.568 ' HZ2' HG23 ' A' ' 26' ' ' ILE . 1.3 m-90 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.481 -0.771 . . . . 0.0 111.471 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.504 ' HG3' ' OD2' ' A' ' 15' ' ' ASP . 26.2 tptp . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 22.7 p -161.36 159.0 27.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.15 -178.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.834 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 69.3 mt -80.11 120.57 24.43 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.45 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.43 -155.52 0.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.506 0.669 . . . . 0.0 112.693 -178.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.437 ' OE1' ' HD3' ' A' ' 35' ' ' PRO . 12.6 tp10 -65.56 128.46 36.03 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.19 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.453 ' HB1' ' CZ ' ' A' ' 34' ' ' ARG . . . 59.66 43.23 15.93 Favored 'General case' 0 CA--C 1.515 -0.386 0 O-C-N 124.144 0.902 . . . . 0.0 110.615 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.834 ' HB1' ' HB3' ' A' ' 3' ' ' LEU . . . -102.07 129.81 48.49 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 119.897 -0.721 . . . . 0.0 111.803 -178.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -62.73 134.37 56.19 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.221 0.534 . . . . 0.0 110.537 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.432 ' HA ' HD13 ' A' ' 3' ' ' LEU . 4.4 m -92.8 152.81 19.24 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.602 -179.122 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.0 m -79.11 131.93 64.88 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.999 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.403 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 24.8 Cg_endo -62.47 -55.08 1.02 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.142 2.561 . . . . 0.0 113.771 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.403 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 12.8 m-90 -88.42 -58.27 2.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.865 0.364 . . . . 0.0 111.23 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.3 m -161.62 146.36 13.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.967 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.56 -145.47 8.02 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.985 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.504 ' OD2' ' HG3' ' A' ' 1' ' ' LYS . 0.7 OUTLIER -70.0 148.13 49.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.359 0.6 . . . . 0.0 111.447 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.2 m -99.58 150.34 22.34 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.068 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.511 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 61.3 m -63.47 141.43 58.77 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.629 0.252 . . . . 0.0 111.338 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.6 m -67.38 143.65 56.21 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.18 141.88 62.98 Favored Pre-proline 0 C--N 1.31 -1.125 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.438 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.436 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 92.1 Cg_endo -102.66 44.82 2.63 Favored 'Cis proline' 0 N--CA 1.453 -0.895 0 C-N-CA 124.073 -1.219 . . . . 0.0 114.095 1.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -81.76 148.41 28.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.229 0.538 . . . . 0.0 110.457 179.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.0 tp -119.47 139.19 52.47 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.575 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.4 t -71.1 106.19 3.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 110.401 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -88.4 130.83 35.07 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.513 179.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.9 t -136.47 63.77 1.57 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.407 0.623 . . . . 0.0 109.331 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.829 HD13 ' HB2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -81.22 -168.64 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.241 -179.53 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -66.95 -60.58 2.52 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -74.07 -36.49 64.32 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -177.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.829 ' HB2' HD13 ' A' ' 26' ' ' ILE . 23.4 m-85 -103.63 124.96 36.16 Favored Pre-proline 0 C--N 1.322 -0.621 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.079 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.82 172.45 13.65 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.817 2.345 . . . . 0.0 111.966 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 88.2 m -52.41 105.38 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 O-C-N 123.468 0.48 . . . . 0.0 111.175 -179.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 p -152.73 135.23 15.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.39 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.561 ' SG ' HD11 ' A' ' 3' ' ' LEU . 19.3 m -65.86 129.06 38.45 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.538 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.453 ' CZ ' ' HB1' ' A' ' 6' ' ' ALA . 34.4 mmt180 -138.04 162.18 55.45 Favored Pre-proline 0 C--N 1.327 -0.409 0 O-C-N 125.504 1.753 . . . . 0.0 107.649 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.437 ' HD3' ' OE1' ' A' ' 5' ' ' GLU . 44.1 Cg_exo -51.96 147.6 25.63 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.261 1.974 . . . . 0.0 111.728 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 32.6 ttpt -77.64 94.16 4.35 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 112.21 43.88 0.89 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 -178.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.8 p90 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.283 -0.865 . . . . 0.0 110.483 -179.334 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 83.5 tttt . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 16' ' ' SER . 28.9 p -77.7 146.97 35.68 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.469 -0.892 . . . . 0.0 110.739 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.458 HD12 ' SG ' ' A' ' 33' ' ' CYS . 63.2 mt -82.3 127.18 32.96 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.89 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.16 -169.75 1.72 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.89 0.376 . . . . 0.0 111.57 -179.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -75.12 133.24 41.57 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.395 0.616 . . . . 0.0 110.8 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.432 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 69.03 33.74 3.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.157 -1.383 . . . . 0.0 110.207 -177.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -110.48 134.81 52.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.773 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -57.37 147.42 26.03 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.094 0.473 . . . . 0.0 111.538 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.7 p -137.49 149.34 46.74 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.476 0.655 . . . . 0.0 111.288 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.0 m -79.43 125.66 82.55 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.584 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.497 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 60.2 Cg_endo -70.47 -42.21 2.83 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 123.213 2.609 . . . . 0.0 113.437 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.497 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.8 m-90 -79.28 -46.5 17.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.299 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.9 t -176.59 140.67 0.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.844 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 177.69 -160.87 27.73 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -70.04 148.81 48.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.32 0.581 . . . . 0.0 110.787 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.554 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 8.0 m -82.88 149.57 27.03 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.924 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.407 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 5.0 m -74.53 145.14 43.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.22 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.25 146.41 50.97 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -79.18 142.99 59.92 Favored Pre-proline 0 C--N 1.311 -1.102 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.079 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.581 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 82.1 Cg_endo -103.55 43.33 2.8 Favored 'Cis proline' 0 N--CA 1.449 -1.089 0 C-N-CA 124.089 -1.213 . . . . 0.0 113.697 1.191 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.663 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 18.4 m-85 -73.37 -164.33 0.19 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 117.957 0.344 . . . . 0.0 111.223 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.506 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 24.3 tp -168.07 133.32 1.83 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.813 -0.176 . . . . 0.0 111.247 -178.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.8 t -70.21 128.39 36.1 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.485 ' OG ' ' HG2' ' A' ' 34' ' ' ARG . 22.6 p -142.53 132.02 23.74 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.805 0.336 . . . . 0.0 110.623 -178.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.436 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.7 OUTLIER -112.05 77.77 1.07 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.519 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.711 HD11 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -89.16 -169.48 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.643 -179.289 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -84.01 -50.35 8.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.765 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -63.01 -28.92 70.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.303 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.41 ' HA ' ' HD3' ' A' ' 30' ' ' PRO . 67.6 m-85 -140.12 134.29 15.58 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.303 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 21.9 Cg_exo -64.83 -166.99 0.09 OUTLIER 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.49 2.126 . . . . 0.0 111.828 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.436 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 93.7 m -58.32 103.72 0.17 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.999 0.428 . . . . 0.0 110.082 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.6 p -151.2 141.01 21.88 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.027 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 18.8 m -74.97 123.06 24.46 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 177.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.485 ' HG2' ' OG ' ' A' ' 24' ' ' SER . 21.1 mmm-85 -119.04 162.0 33.69 Favored Pre-proline 0 C--N 1.316 -0.869 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.663 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 32.7 Cg_exo -53.35 157.52 8.92 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.37 2.046 . . . . 0.0 111.589 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.581 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 1.3 tppp? -77.72 113.68 15.83 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.46 48.72 5.49 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 -177.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.1 p90 . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.862 -179.074 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.466 ' HZ3' ' CG ' ' A' ' 15' ' ' ASP . 28.2 ttpp . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.5 p -160.52 159.14 30.36 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 123.443 0.464 . . . . 0.0 109.956 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.591 HD12 ' SG ' ' A' ' 33' ' ' CYS . 92.4 mt -79.63 132.13 36.17 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.745 -179.32 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.43 -166.37 0.84 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.081 0.467 . . . . 0.0 111.786 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.558 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 12.3 pt-20 -73.1 132.06 42.83 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.15 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.99 36.85 9.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.48 -178.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.405 ' HB1' ' HB3' ' A' ' 3' ' ' LEU . . . -100.78 137.22 39.46 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.791 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.482 ' O ' HD11 ' A' ' 3' ' ' LEU . 10.7 p-10 -56.59 142.14 40.62 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.969 0.414 . . . . 0.0 111.553 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 22.2 p -153.03 171.77 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.3 0.572 . . . . 0.0 111.37 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.521 ' HB2' ' O ' ' A' ' 13' ' ' SER . 66.9 m -156.51 123.79 2.71 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.507 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 32.3 Cg_exo -63.82 -29.26 68.01 Favored 'Trans proline' 0 N--CA 1.474 0.38 0 C-N-CA 123.493 2.795 . . . . 0.0 113.399 -178.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.9 m-90 -78.85 -19.62 51.58 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.003 -179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.521 ' O ' ' HB2' ' A' ' 10' ' ' SER . 9.4 t -178.17 126.29 0.12 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.372 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 159.32 164.61 14.89 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.92 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.466 ' CG ' ' HZ3' ' A' ' 1' ' ' LYS . 0.2 OUTLIER -65.88 158.01 29.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.062 0.458 . . . . 0.0 110.63 179.508 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.1 m -79.62 141.98 36.02 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.668 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.561 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 19.8 m -74.17 141.68 45.5 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.9 m -64.36 146.02 55.11 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -78.44 141.62 61.44 Favored Pre-proline 0 C--N 1.311 -1.09 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.571 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 79.6 Cg_endo -103.49 37.25 5.0 Favored 'Cis proline' 0 N--CA 1.453 -0.902 0 C-N-CA 123.906 -1.289 . . . . 0.0 113.779 1.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.931 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 58.2 m-85 -69.39 159.51 33.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.902 0.382 . . . . 0.0 110.773 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.445 HD23 ' HE1' ' A' ' 38' ' ' TRP . 36.8 tp -132.85 130.19 39.44 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.6 t -69.79 124.98 25.39 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.3 p -148.31 145.27 28.08 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.745 0.307 . . . . 0.0 110.845 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.427 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -113.17 65.78 0.65 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.873 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.484 ' CD1' ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -82.28 -170.2 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.349 -178.762 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -83.16 -50.47 8.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.017 -178.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -59.96 -32.51 70.88 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.649 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -141.81 134.65 14.05 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.06 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.19 -160.75 0.05 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.293 1.995 . . . . 0.0 111.811 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.427 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 90.1 m -59.14 98.51 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.816 0.341 . . . . 0.0 110.104 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.441 ' O ' ' HG2' ' A' ' 34' ' ' ARG . 6.2 p -155.5 144.42 20.66 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.672 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 32.9 m -70.08 110.05 4.91 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.749 -1.574 . . . . 0.0 106.749 177.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.626 ' HB2' ' CD1' ' A' ' 38' ' ' TRP . 12.2 mmm-85 -101.73 167.15 11.0 Favored Pre-proline 0 C--N 1.313 -1.001 0 O-C-N 124.143 0.902 . . . . 0.0 108.632 -178.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.931 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 17.8 Cg_endo -59.81 166.17 8.86 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 121.822 1.681 . . . . 0.0 111.267 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 20.9 tptm -78.22 75.13 4.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.839 0.828 . . . . 0.0 109.428 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.84 47.55 0.05 OUTLIER Glycine 0 N--CA 1.447 -0.626 0 CA-C-N 114.019 -1.446 . . . . 0.0 109.549 -177.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.626 ' CD1' ' HB2' ' A' ' 34' ' ' ARG . 6.8 p-90 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.056 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.6 pttt . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p -161.32 159.79 28.91 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 123.285 0.365 . . . . 0.0 110.204 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 75.2 mt -79.18 126.25 30.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.457 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.403 ' HB1' ' OE1' ' A' ' 5' ' ' GLU . . . -78.9 -166.9 0.98 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.99 0.424 . . . . 0.0 112.043 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.582 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.6 pm0 -67.56 129.95 41.5 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.502 0.668 . . . . 0.0 111.482 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 66.88 39.01 3.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.947 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.466 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -105.38 133.17 50.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.919 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -60.78 136.93 58.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.112 0.482 . . . . 0.0 111.107 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.6 m -91.07 155.43 18.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.273 0.559 . . . . 0.0 111.074 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 25.1 p -79.12 132.06 64.48 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.616 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -63.3 -41.08 28.65 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 123.035 2.49 . . . . 0.0 113.62 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.3 m-90 -129.57 -43.16 1.27 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.7 t -149.56 141.24 23.54 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.92 -139.38 5.61 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 111.519 -0.632 . . . . 0.0 111.519 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.64 150.43 20.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.116 0.484 . . . . 0.0 111.196 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 m -94.45 150.02 20.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.918 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.509 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 60.2 m -64.34 142.38 58.44 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.609 0.242 . . . . 0.0 111.593 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 70.9 m -68.8 142.34 54.91 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.521 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.14 144.28 62.6 Favored Pre-proline 0 C--N 1.315 -0.934 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.534 -179.575 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.472 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 89.2 Cg_endo -100.89 32.47 9.24 Favored 'Cis proline' 0 N--CA 1.451 -0.997 0 C-N-CA 123.334 -1.527 . . . . 0.0 113.479 1.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.582 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 28.1 m-85 -65.63 148.02 52.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.136 0.493 . . . . 0.0 110.455 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.6 tp -122.39 138.23 54.6 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.865 -178.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 48.8 t -69.04 112.71 5.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.02 0.438 . . . . 0.0 109.986 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.431 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 83.9 p -89.44 121.47 31.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.287 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.0 m -119.97 52.29 1.13 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.493 HG13 ' H ' ' A' ' 29' ' ' TYR . 12.3 pt -81.78 -170.76 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.658 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -72.98 -59.71 2.58 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -177.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -71.68 -32.24 67.65 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.493 ' H ' HG13 ' A' ' 26' ' ' ILE . 53.2 m-85 -111.5 124.31 32.86 Favored Pre-proline 0 C--N 1.321 -0.662 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.088 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.01 166.33 29.48 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.848 2.365 . . . . 0.0 111.595 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 24' ' ' SER . 92.0 m -49.48 104.35 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.547 0.689 . . . . 0.0 112.046 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.526 ' O ' ' HD3' ' A' ' 34' ' ' ARG . 6.7 p -153.57 137.9 16.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.33 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.3 m -65.42 119.93 11.9 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.526 ' HD3' ' O ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -118.72 159.22 45.13 Favored Pre-proline 0 C--N 1.324 -0.536 0 O-C-N 124.386 1.053 . . . . 0.0 108.223 179.835 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.548 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 50.0 Cg_exo -52.66 159.81 4.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.5 2.133 . . . . 0.0 112.48 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.472 ' HD3' ' O ' ' A' ' 20' ' ' PRO . 49.3 tptt -77.48 109.91 11.81 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.65 46.96 5.01 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 -177.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 16.7 p90 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.679 -179.204 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.2 tttt . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.0 p -161.3 158.07 26.49 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.484 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 71.0 mt -80.82 122.12 26.79 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.559 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.09 -162.44 0.39 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.155 0.502 . . . . 0.0 111.976 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.568 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 8.8 pm0 -63.75 126.17 26.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.573 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.79 45.54 4.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.467 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.461 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -115.61 120.83 40.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.631 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.538 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.2 m-20 -50.99 129.72 24.24 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.188 0.518 . . . . 0.0 112.282 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.89 147.94 30.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.3 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.4 m -78.99 130.57 69.51 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.19 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.478 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 40.0 Cg_endo -66.16 -52.21 0.94 Allowed 'Trans proline' 0 N--CA 1.472 0.216 0 C-N-CA 123.141 2.561 . . . . 0.0 113.604 -178.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.478 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 12.7 m-90 -79.98 -56.31 4.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.76 0.314 . . . . 0.0 111.396 -178.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.7 m -161.8 140.66 9.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.579 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 175.27 -153.85 16.46 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.506 -0.637 . . . . 0.0 111.506 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -70.16 143.21 52.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.999 0.428 . . . . 0.0 110.678 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.6 m -88.48 147.52 24.62 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.604 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.1 m -69.3 144.53 53.53 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.27 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 83.3 m -66.53 145.79 55.24 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.711 ' HD2' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.19 139.72 56.58 Favored Pre-proline 0 C--N 1.307 -1.239 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.274 -179.473 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.549 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 74.9 Cg_endo -103.04 36.37 5.63 Favored 'Cis proline' 0 N--CA 1.456 -0.732 0 C-N-CA 124.188 -1.172 . . . . 0.0 114.083 1.452 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.568 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 62.5 m-85 -66.98 147.5 53.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.324 0.583 . . . . 0.0 110.855 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.5 tp -116.47 135.42 53.85 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.168 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.4 t -70.37 124.63 24.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -132.12 134.67 45.72 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.903 0.382 . . . . 0.0 111.143 -178.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.419 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -113.16 85.54 2.2 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 179.663 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.82 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -79.84 -171.47 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.887 -178.999 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -71.91 -69.84 0.37 Allowed 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -177.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -69.19 -41.28 77.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.959 0.409 . . . . 0.0 111.885 -177.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.438 ' O ' HG12 ' A' ' 26' ' ' ILE . 46.7 m-85 -97.71 135.56 21.55 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.125 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.59 -171.26 0.37 Allowed 'Trans proline' 0 C--O 1.238 0.487 0 C-N-CA 122.474 2.116 . . . . 0.0 112.692 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.419 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 75.7 m -61.14 106.02 0.56 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.135 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 4.5 p -144.32 138.63 28.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.074 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 12.7 m -66.1 130.23 42.51 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.995 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.402 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 24.4 mmt85 -128.38 161.51 56.31 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 52.0 Cg_exo -51.25 154.37 8.16 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 122.531 2.154 . . . . 0.0 112.314 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 6.9 tmtm? -78.12 71.54 4.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.58 43.9 0.13 Allowed Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.088 -1.415 . . . . 0.0 109.663 -177.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 13.0 p90 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.972 -178.797 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 81.9 tttt . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.8 p -76.97 146.23 37.6 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 118.889 -1.125 . . . . 0.0 110.88 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 9' ' ' CYS . 90.4 mt -78.83 137.78 37.86 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.096 -1.411 . . . . 0.0 110.518 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.78 -178.87 5.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.43 ' HB3' ' CZ ' ' A' ' 21' ' ' TYR . 19.6 pt-20 -69.99 134.84 48.74 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.041 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . . . 56.48 40.15 29.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.311 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.45 135.8 52.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.151 -179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -57.02 141.57 45.24 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.501 0.501 . . . . 0.0 109.881 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.548 ' HA ' HD13 ' A' ' 3' ' ' LEU . 32.4 m -79.11 163.76 24.83 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.103 0.478 . . . . 0.0 110.982 -178.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.484 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 28.8 p -78.62 115.31 50.68 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.314 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 5.9 Cg_exo -79.13 -56.57 0.04 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.994 2.463 . . . . 0.0 112.348 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 23.8 m-90 -85.41 -40.49 16.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.12 0.486 . . . . 0.0 110.57 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.0 m -87.9 -163.58 0.97 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.243 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -160.08 129.37 2.17 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.136 -1.03 . . . . 0.0 112.412 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -159.41 152.53 22.13 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.615 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 5.9 m -88.14 147.08 25.08 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.985 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.411 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 8.4 m -74.54 145.12 43.7 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.426 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 58.8 m -60.77 144.29 52.74 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.36 144.18 65.81 Favored Pre-proline 0 C--N 1.312 -1.028 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -99.0 52.31 1.36 Allowed 'Cis proline' 0 N--CA 1.454 -0.821 0 C-N-CA 124.065 -1.223 . . . . 0.0 113.905 1.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 5' ' ' GLU . 37.8 m-85 -105.15 145.98 29.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.056 0.455 . . . . 0.0 110.316 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.7 tp -127.91 143.31 51.1 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.76 -178.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 41.9 t -66.48 122.07 16.74 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.1 p -126.33 139.92 52.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.324 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.9 t -135.58 96.3 3.42 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.641 HD11 ' HB2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -109.59 -168.02 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.911 -179.251 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -70.73 -59.44 2.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -73.65 -34.55 65.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.847 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.641 ' HB2' HD11 ' A' ' 26' ' ' ILE . 8.1 m-85 -109.18 128.15 25.96 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.943 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.04 177.3 5.21 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.887 2.391 . . . . 0.0 112.036 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 98.4 m -58.53 102.13 0.1 Allowed 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.48 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.3 p -153.56 140.91 19.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.609 -179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 25.2 m -71.17 127.58 33.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 6' ' ' ALA . 23.8 mmt180 -132.71 164.67 42.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 72.6 Cg_exo -46.47 139.96 12.37 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.139 1.893 . . . . 0.0 111.532 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -76.96 103.21 6.77 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.92 45.09 2.13 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.777 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.8 p90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.437 -179.505 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' LYS . . . . . 0.486 ' HB3' ' HE2' ' A' ' 1' ' ' LYS . 28.0 mtpt . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.621 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.9 p -160.82 149.71 16.66 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.296 0.569 . . . . 0.0 110.527 178.166 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 98.3 mt -85.53 136.11 33.55 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.332 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.38 -171.5 2.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.025 0.44 . . . . 0.0 111.609 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.474 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 10.9 pt-20 -74.32 137.56 42.94 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.347 0.594 . . . . 0.0 111.272 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 62.69 38.39 12.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.741 -178.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.78 139.39 44.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.311 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -60.73 149.59 35.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.928 0.394 . . . . 0.0 110.775 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.0 p -153.25 -170.63 3.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.125 0.488 . . . . 0.0 111.093 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.7 m -154.57 144.35 15.44 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.377 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.77 -36.65 91.26 Favored 'Trans proline' 0 CA--C 1.53 0.308 0 C-N-CA 123.547 2.832 . . . . 0.0 113.732 -178.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 9.3 m-90 -128.41 -54.28 1.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.023 0.439 . . . . 0.0 111.579 -179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 t -80.17 61.59 4.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.622 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -167.88 150.55 16.82 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.232 -0.985 . . . . 0.0 112.788 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.06 156.64 24.26 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.814 0.34 . . . . 0.0 110.429 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.621 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 4.5 m -78.2 143.22 37.36 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 4.9 m -76.82 141.34 40.73 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.349 -178.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 55.5 m -60.65 146.82 44.13 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 24.1 mmmt -83.31 150.98 61.82 Favored Pre-proline 0 C--N 1.31 -1.114 0 C-N-CA 120.13 -0.628 . . . . 0.0 109.81 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.409 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 96.1 Cg_endo -95.45 40.06 4.57 Favored 'Cis proline' 0 N--CA 1.45 -1.039 0 C-N-CA 123.205 -1.581 . . . . 0.0 114.085 1.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.474 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 29.6 m-85 -84.36 163.36 19.61 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 121.983 -0.448 . . . . 0.0 110.533 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 48.1 tp -138.37 141.55 39.65 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.502 -178.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 46.7 t -74.12 84.59 1.83 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.668 0.747 . . . . 0.0 110.118 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.649 ' OG ' ' HG3' ' A' ' 34' ' ' ARG . 33.4 p -81.15 136.82 35.93 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.318 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.9 t -136.84 69.29 1.41 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.28 0.562 . . . . 0.0 109.77 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.807 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -84.61 -172.4 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.243 -179.744 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -74.52 -51.83 13.62 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.344 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -73.42 -23.08 60.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.763 -178.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.589 ' HB2' HD11 ' A' ' 26' ' ' ILE . 87.3 m-85 -130.67 120.2 18.56 Favored Pre-proline 0 C--N 1.324 -0.532 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.399 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.73 175.02 3.2 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.988 2.458 . . . . 0.0 112.541 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 84.3 m -51.89 106.75 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.275 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.6 p -155.16 137.12 14.57 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.032 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 14.3 m -74.01 128.71 36.23 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 179.478 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.649 ' HG3' ' OG ' ' A' ' 24' ' ' SER . 5.8 mtp180 -142.73 163.87 35.92 Favored Pre-proline 0 C--N 1.318 -0.768 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.436 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 82.8 Cg_exo -46.59 141.57 10.85 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.502 2.135 . . . . 0.0 111.936 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.405 ' HE3' ' HB3' ' A' ' 36' ' ' LYS . 8.6 ttpp -77.05 106.41 8.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.984 0.421 . . . . 0.0 109.905 -179.021 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.21 46.16 2.88 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.8 p90 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.386 -0.816 . . . . 0.0 110.59 -179.491 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' LYS . . . . . 0.548 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 9.1 mtpm? . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p -160.83 156.61 25.39 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.357 0.41 . . . . 0.0 110.194 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.501 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 88.3 mt -79.95 130.11 35.02 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.3 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.27 -158.38 0.15 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.357 0.599 . . . . 0.0 111.962 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.615 ' HG3' ' CE2' ' A' ' 21' ' ' TYR . 15.0 mp0 -69.97 132.82 46.53 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.209 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 58.91 45.22 15.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.367 179.049 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.462 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -113.76 124.75 53.0 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.656 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.6 p30 -57.84 140.78 51.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.771 0.32 . . . . 0.0 110.711 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 17.4 p -114.32 -173.42 2.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.61 0.719 . . . . 0.0 112.022 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.517 ' HB2' ' HA3' ' A' ' 14' ' ' GLY . 75.3 m -153.88 143.67 15.3 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.471 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.64 -39.5 87.46 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.249 2.632 . . . . 0.0 113.641 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -137.17 -53.22 0.68 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.875 0.369 . . . . 0.0 111.278 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m -76.7 56.06 1.12 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.95 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.517 ' HA3' ' HB2' ' A' ' 10' ' ' SER . . . -173.56 148.29 10.1 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.508 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.548 ' OD2' ' HB3' ' A' ' 1' ' ' LYS . 69.1 m-20 -62.61 151.47 37.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.014 0.435 . . . . 0.0 110.946 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.3 m -79.69 151.47 30.46 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.501 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 60.5 m -64.19 141.27 58.83 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 121.272 -0.171 . . . . 0.0 110.656 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.1 m -64.87 146.5 54.82 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.8 ptmt -78.62 142.27 61.49 Favored Pre-proline 0 C--N 1.309 -1.17 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.879 -178.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.506 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 87.7 Cg_endo -101.97 35.11 6.82 Favored 'Cis proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.95 -1.271 . . . . 0.0 113.55 0.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.615 ' CE2' ' HG3' ' A' ' 5' ' ' GLU . 40.4 m-85 -69.62 155.09 41.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.218 0.532 . . . . 0.0 111.041 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.8 tp -131.64 136.17 47.52 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.716 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 16.4 t -74.03 125.1 27.54 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.7 p -126.34 133.21 51.42 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.051 0.453 . . . . 0.0 110.677 -178.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.7 m -99.54 72.66 1.79 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.352 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.806 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -79.89 -175.39 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.032 0.444 . . . . 0.0 111.16 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -82.05 -48.79 10.97 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.787 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -65.74 -26.09 67.57 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.579 -178.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.423 ' H ' HG12 ' A' ' 26' ' ' ILE . 96.4 m-85 -143.61 136.81 13.94 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.296 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.72 -175.89 0.39 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.487 2.125 . . . . 0.0 111.787 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 62.9 m -52.65 105.6 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.073 0.463 . . . . 0.0 110.996 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 6.0 p -148.81 141.84 24.86 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.053 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.7 m -64.23 126.61 28.32 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.123 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.576 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 23.5 mmt180 -129.5 165.01 35.85 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.576 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 9.4 Cg_endo -56.65 154.32 31.66 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 121.687 1.591 . . . . 0.0 111.66 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 19.1 tptm -77.61 114.62 16.63 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.66 46.47 7.27 Favored Glycine 0 N--CA 1.448 -0.54 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 -177.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.8 p90 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.652 -179.147 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.8 pptp? . . . . . 0 N--CA 1.483 1.181 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.1 p -126.69 155.68 42.27 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.023 0.44 . . . . 0.0 110.443 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.3 mt -86.41 123.77 32.01 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.763 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.32 -164.95 0.61 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.987 0.422 . . . . 0.0 111.236 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.422 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 7.1 pt-20 -74.03 131.97 41.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.393 0.616 . . . . 0.0 110.941 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 70.35 35.52 2.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.156 -1.384 . . . . 0.0 110.242 -177.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.419 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -105.57 131.59 52.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.93 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -62.34 131.64 49.97 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.283 0.364 . . . . 0.0 110.306 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.42 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 8.6 m -88.41 155.13 19.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.316 0.579 . . . . 0.0 110.858 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.2 m -79.55 128.14 75.93 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.856 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.29 -57.04 1.02 Allowed 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 123.258 2.639 . . . . 0.0 113.998 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.9 m-90 -89.97 -56.01 3.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.866 0.365 . . . . 0.0 111.554 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 m -159.69 146.16 16.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.976 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 178.17 -147.01 7.77 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.876 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -79.61 141.47 36.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.941 0.4 . . . . 0.0 110.842 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.8 m -83.89 154.37 23.46 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.899 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.447 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.7 m -66.45 141.68 57.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.578 0.228 . . . . 0.0 111.015 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.4 m -66.4 145.4 55.73 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 177.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.433 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 25.3 pttm -78.87 141.01 58.69 Favored Pre-proline 0 C--N 1.31 -1.144 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.254 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.475 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 73.9 Cg_endo -103.82 37.55 4.75 Favored 'Cis proline' 0 N--CA 1.451 -0.973 0 C-N-CA 123.916 -1.285 . . . . 0.0 113.919 1.307 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.747 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 50.5 m-85 -70.54 158.87 35.34 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.964 0.412 . . . . 0.0 110.499 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.7 tp -133.33 135.12 44.59 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.148 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.626 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.6 t -72.16 129.11 37.69 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.0 p -135.98 127.65 29.0 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.644 -178.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 14.8 m -100.08 72.93 1.69 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.528 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.811 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -82.11 -170.91 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.112 0.482 . . . . 0.0 111.141 -179.934 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -85.55 -48.97 8.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.621 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -65.79 -25.27 67.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.406 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.461 ' HB2' HD11 ' A' ' 26' ' ' ILE . 83.5 m-85 -141.42 138.22 17.32 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 17.1 Cg_exo -66.23 -165.12 0.09 OUTLIER 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.394 2.063 . . . . 0.0 111.595 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 80.0 m -62.43 99.17 0.13 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.906 0.384 . . . . 0.0 110.142 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.408 ' OG ' ' HD3' ' A' ' 34' ' ' ARG . 3.2 p -135.98 142.06 44.48 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.394 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.626 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 22.3 m -73.66 118.49 16.68 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 177.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.408 ' HD3' ' OG ' ' A' ' 32' ' ' SER . 18.8 mmm-85 -122.86 160.14 50.51 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.747 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 51.2 Cg_exo -50.93 148.26 17.19 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.072 1.848 . . . . 0.0 111.198 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.475 ' HE3' ' O ' ' A' ' 20' ' ' PRO . 37.1 ttmt -76.94 116.43 17.6 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.34 45.55 5.83 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -177.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 15.5 p90 . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.731 -179.131 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.0 p -160.65 161.68 32.47 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.365 0.416 . . . . 0.0 110.394 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.478 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 81.9 mt -79.3 134.39 36.62 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.356 -179.488 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.41 -166.04 0.79 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.309 0.576 . . . . 0.0 112.011 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.404 ' OE2' ' HG3' ' A' ' 35' ' ' PRO . 42.6 tt0 -71.1 134.3 46.91 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.762 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.09 42.5 12.37 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.666 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.16 136.31 48.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.201 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.401 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.1 p30 -58.58 147.41 32.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.88 0.372 . . . . 0.0 111.149 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.7 p -146.07 159.08 43.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.389 0.614 . . . . 0.0 111.682 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 71.6 m -157.42 146.16 14.61 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.468 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.31 -42.98 57.11 Favored 'Trans proline' 0 CA--C 1.529 0.236 0 C-N-CA 123.606 2.871 . . . . 0.0 113.229 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -111.28 -50.85 2.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.131 0.491 . . . . 0.0 110.683 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.0 t -85.9 52.66 2.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.893 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -169.5 145.65 9.5 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.117 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -82.25 -177.84 6.8 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -85.23 141.7 29.94 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.573 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 56.3 m -73.09 141.38 47.56 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.476 0.179 . . . . 0.0 110.551 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.5 m -66.5 140.41 58.0 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 177.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.669 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.8 OUTLIER -78.54 148.53 73.57 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -179.575 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.468 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.5 Cg_endo -98.08 38.67 5.46 Favored 'Cis proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.182 -1.591 . . . . 0.0 113.924 1.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -81.91 147.89 29.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.027 0.441 . . . . 0.0 110.502 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 54.1 tp -118.75 140.97 49.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.245 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.573 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 40.9 t -72.61 104.11 3.78 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 76.8 p -98.4 139.62 33.88 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.449 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.0 t -140.3 63.25 1.48 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.378 0.609 . . . . 0.0 109.489 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.793 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -85.01 -167.05 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.26 -179.678 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -69.52 -59.29 3.07 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -71.41 -35.4 70.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.683 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.711 ' HB2' HD11 ' A' ' 26' ' ' ILE . 15.5 m-85 -109.4 123.57 36.27 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.831 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -71.35 172.89 13.24 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 122.741 2.294 . . . . 0.0 111.414 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.2 m -51.31 103.16 0.05 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.991 0.424 . . . . 0.0 111.148 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.7 p -160.13 137.08 9.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.644 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.9 m -67.01 127.54 32.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.719 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -134.26 162.16 59.38 Favored Pre-proline 0 C--N 1.324 -0.534 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.404 ' HG3' ' OE2' ' A' ' 5' ' ' GLU . 49.9 Cg_exo -50.9 147.92 17.8 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.116 1.877 . . . . 0.0 111.58 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 35.4 ttpt -77.16 113.97 15.47 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.66 46.76 4.48 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 28.7 p90 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.559 -179.381 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.7 mtmm . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.526 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.1 p -150.45 149.54 30.14 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.191 0.519 . . . . 0.0 110.302 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.553 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 80.0 mt -79.89 135.08 36.35 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.386 -178.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.15 -168.62 1.34 Allowed 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.482 ' OE2' ' HG3' ' A' ' 35' ' ' PRO . 40.0 tt0 -70.61 135.01 48.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.007 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.11 43.26 11.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.726 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.54 127.24 53.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.741 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.451 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 5.6 t70 -57.01 132.72 53.73 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.553 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 30.4 p -94.47 170.21 9.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.832 0.825 . . . . 0.0 112.509 -178.3 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.9 p -78.89 120.27 80.25 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.952 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.471 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 38.0 Cg_endo -66.95 -46.08 3.56 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 122.948 2.432 . . . . 0.0 112.903 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.471 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 11.1 m-90 -91.36 -53.97 4.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.707 0.289 . . . . 0.0 111.268 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.3 t -173.21 148.57 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.233 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.7 -153.25 22.84 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.298 -0.721 . . . . 0.0 111.298 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -74.34 138.49 43.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.126 0.488 . . . . 0.0 110.368 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.526 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.8 m -83.14 156.46 23.25 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.353 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.502 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 31.1 m -63.84 143.94 57.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.81 -0.177 . . . . 0.0 110.695 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.0 m -63.4 145.21 56.07 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt -78.47 145.4 67.68 Favored Pre-proline 0 C--N 1.312 -1.043 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.314 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.696 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 90.0 Cg_endo -99.67 28.6 14.38 Favored 'Cis proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.023 -1.657 . . . . 0.0 113.583 1.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -64.85 153.0 41.45 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.312 0.577 . . . . 0.0 111.57 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 44.7 tp -131.68 140.74 49.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.187 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.66 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 16.6 t -75.3 120.51 20.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.998 0.428 . . . . 0.0 110.028 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.4 p -110.72 126.8 54.94 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.412 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 58.7 m -101.79 68.97 1.18 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.411 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.847 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -80.96 -172.97 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.998 0.428 . . . . 0.0 111.289 -179.962 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -86.17 -49.22 7.9 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.944 -178.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -66.14 -25.28 66.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.618 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.464 ' HB2' HD11 ' A' ' 26' ' ' ILE . 88.5 m-85 -139.11 138.23 20.62 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.935 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.15 -174.59 0.33 Allowed 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.448 2.099 . . . . 0.0 111.857 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 79.6 m -59.38 99.91 0.07 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.109 0.481 . . . . 0.0 110.503 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.451 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 3.9 p -139.1 138.51 37.12 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.202 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.66 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -65.48 127.44 31.84 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.649 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.462 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 25.6 mmt180 -130.37 164.77 38.83 Favored Pre-proline 0 C--N 1.324 -0.542 0 O-C-N 124.622 1.201 . . . . 0.0 107.88 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.482 ' HG3' ' OE2' ' A' ' 5' ' ' GLU . 32.4 Cg_exo -51.03 153.7 8.51 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.316 2.01 . . . . 0.0 112.02 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.696 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 40.3 tttp -77.65 114.52 16.58 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.0 47.84 5.39 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -177.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.3 p90 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.709 -179.335 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' LYS . . . . . 0.551 ' HE2' ' OD2' ' A' ' 15' ' ' ASP . 9.2 mmmm . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.5 p -161.92 153.57 18.75 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.052 0.453 . . . . 0.0 110.827 178.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.9 mt -80.99 134.67 35.73 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.891 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.48 -168.56 1.39 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.143 0.497 . . . . 0.0 111.665 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.627 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 9.3 pt-20 -73.13 135.56 44.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.551 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.534 ' HA ' ' HD2' ' A' ' 34' ' ' ARG . . . 62.92 44.56 6.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.906 -178.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -119.51 127.76 53.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.535 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -52.86 135.26 36.38 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.5 p -111.93 -176.38 2.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 122.093 0.949 . . . . 0.0 113.059 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.433 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 58.6 m -157.85 144.49 13.07 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 114.544 -1.207 . . . . 0.0 109.366 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.508 ' HB2' ' CE3' ' A' ' 12' ' ' TRP . 24.1 Cg_exo -62.52 -43.88 20.21 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.799 2.333 . . . . 0.0 112.725 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.508 ' CE3' ' HB2' ' A' ' 11' ' ' PRO . 11.5 m-90 -136.53 -34.2 0.77 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.768 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 p -77.77 44.79 0.47 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.41 160.49 20.08 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.18 -1.009 . . . . 0.0 112.648 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.551 ' OD2' ' HE2' ' A' ' 1' ' ' LYS . 64.7 m-20 -60.96 153.1 25.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.922 0.391 . . . . 0.0 110.827 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.429 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.6 m -79.49 149.82 31.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 55.9 m -61.75 140.61 58.2 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.407 0.146 . . . . 0.0 111.219 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.7 m -64.81 144.35 57.31 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.8 pttp -78.14 142.27 63.67 Favored Pre-proline 0 C--N 1.312 -1.045 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.643 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.509 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 76.8 Cg_endo -102.74 38.22 4.82 Favored 'Cis proline' 0 N--CA 1.455 -0.774 0 C-N-CA 123.948 -1.271 . . . . 0.0 113.901 1.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.627 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 38.0 m-85 -74.0 143.67 45.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.352 0.596 . . . . 0.0 110.824 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.1 tp -115.04 138.66 50.61 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.008 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.682 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.8 t -73.23 103.41 3.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.581 0.705 . . . . 0.0 110.53 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 52.3 p -80.38 132.6 35.79 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.87 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.2 t -143.25 53.92 1.35 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.454 0.645 . . . . 0.0 109.384 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.636 HG12 ' HB2' ' A' ' 29' ' ' TYR . 28.7 pt -85.79 -165.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.622 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.48 -56.48 15.75 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -79.83 -31.9 40.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.98 0.419 . . . . 0.0 112.117 -178.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.636 ' HB2' HG12 ' A' ' 26' ' ' ILE . 3.1 m-85 -102.66 111.06 64.44 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.613 -179.07 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -65.86 162.57 34.37 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.766 2.311 . . . . 0.0 110.425 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 27.8 m -48.64 97.93 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.119 0.485 . . . . 0.0 111.924 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 p -153.92 139.01 17.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.539 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.682 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -65.68 120.37 12.85 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.534 ' HD2' ' HA ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -123.58 158.06 60.33 Favored Pre-proline 0 C--N 1.321 -0.636 0 O-C-N 124.624 1.203 . . . . 0.0 107.877 179.923 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.446 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 50.2 Cg_exo -53.38 154.57 14.56 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.216 1.944 . . . . 0.0 111.644 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 1.6 tmtp? -77.09 108.49 10.2 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.01 46.47 3.35 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.6 p90 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.385 -0.816 . . . . 0.0 110.672 -179.355 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' LYS . . . . . 0.633 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 7.4 p -160.87 158.15 27.82 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 123.84 0.713 . . . . 0.0 109.306 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 70.8 mt -79.61 119.33 22.41 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.251 -0.432 . . . . 0.0 109.958 -179.692 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.31 -163.41 0.44 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.034 0.445 . . . . 0.0 111.575 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.407 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 6.9 pt-20 -72.28 134.08 45.37 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.335 0.588 . . . . 0.0 110.936 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 68.71 37.53 2.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.416 -177.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -107.19 128.74 54.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.078 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -58.93 133.72 56.31 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.325 0.391 . . . . 0.0 111.104 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 m -93.8 153.46 18.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.317 0.58 . . . . 0.0 110.453 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.4 m -79.52 129.89 70.06 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.916 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.406 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 19.3 Cg_endo -59.8 -57.31 0.86 Allowed 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 123.277 2.651 . . . . 0.0 113.968 -178.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.406 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 19.8 m-90 -82.12 -50.61 8.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.827 0.346 . . . . 0.0 111.296 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.1 t -175.22 150.21 1.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.01 -144.55 5.16 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.948 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.633 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 0.1 OUTLIER -79.13 157.93 27.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.265 0.555 . . . . 0.0 111.671 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.6 m -93.22 150.61 20.37 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.199 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.443 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.1 m -71.27 144.09 50.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.097 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.9 m -64.68 147.92 52.05 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.3 137.8 60.1 Favored Pre-proline 0 C--N 1.314 -0.972 0 CA-C-O 120.796 0.332 . . . . 0.0 110.941 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.631 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 69.1 Cg_endo -104.89 37.09 4.59 Favored 'Cis proline' 0 N--CA 1.454 -0.843 0 C-N-CA 124.346 -1.106 . . . . 0.0 113.72 0.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.657 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 41.7 m-85 -71.14 143.19 50.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.223 0.535 . . . . 0.0 110.649 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 tp -117.26 139.65 50.54 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.795 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.685 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.1 t -74.08 116.09 14.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.038 0.447 . . . . 0.0 109.798 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 84.2 p -107.95 143.47 36.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.656 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -143.3 58.43 1.4 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.481 HG13 ' H ' ' A' ' 29' ' ' TYR . 38.0 pt -84.55 -162.73 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.341 -179.219 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -67.38 -62.66 1.31 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.709 -178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -72.71 -41.76 64.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.607 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.481 ' H ' HG13 ' A' ' 26' ' ' ILE . 3.2 m-85 -95.99 120.87 62.21 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.747 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.69 172.46 15.74 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.562 2.175 . . . . 0.0 110.98 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.9 m -52.32 99.25 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.0 0.429 . . . . 0.0 111.196 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.8 p -160.07 143.49 13.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.739 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.685 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.0 m -69.43 132.04 45.72 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -133.93 161.49 63.42 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.657 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 50.9 Cg_exo -51.39 153.19 10.52 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.434 2.09 . . . . 0.0 111.918 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.631 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 59.4 tttm -77.32 103.56 7.33 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.74 46.71 2.64 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 -177.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.6 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.819 -179.198 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.5 p -160.14 154.78 24.05 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.002 0.429 . . . . 0.0 110.15 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 85.8 mt -79.85 132.82 36.19 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.077 -179.036 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.16 -179.55 6.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.697 0.284 . . . . 0.0 110.675 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.429 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 11.5 pt-20 -70.79 141.53 51.39 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.29 0.567 . . . . 0.0 110.807 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 66.45 45.43 2.14 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.389 -177.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -132.09 124.23 28.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.898 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.617 ' OD1' ' HB3' ' A' ' 32' ' ' SER . 36.0 m-20 -56.97 131.09 48.75 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 123.418 0.449 . . . . 0.0 110.835 -179.498 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.509 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 31.8 p -91.08 169.62 10.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.641 0.734 . . . . 0.0 112.072 -178.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.5 m -81.77 125.05 78.93 Favored Pre-proline 0 C--N 1.319 -0.724 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.276 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.455 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 38.8 Cg_endo -67.61 -51.96 0.63 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.86 2.373 . . . . 0.0 113.575 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.455 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 14.7 m-90 -82.06 -52.38 7.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.712 0.291 . . . . 0.0 111.334 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.3 t -174.18 148.14 1.29 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.117 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 169.34 -151.78 18.26 Favored Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -72.28 141.94 48.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.387 0.613 . . . . 0.0 110.462 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.0 m -85.65 154.51 21.63 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.842 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 33.4 m -67.79 139.37 56.62 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.7 m -61.69 147.52 45.75 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.726 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -78.77 144.7 65.0 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.135 -179.965 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 87.0 Cg_endo -101.66 34.95 7.05 Favored 'Cis proline' 0 N--CA 1.45 -1.037 0 C-N-CA 123.438 -1.484 . . . . 0.0 113.507 1.22 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.52 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 43.0 m-85 -73.35 174.96 7.37 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.112 0.482 . . . . 0.0 111.339 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.589 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 49.6 tp -152.7 142.44 21.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.136 -178.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.675 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 18.0 t -75.85 112.03 11.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.349 0.595 . . . . 0.0 110.608 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.4 p -101.68 137.4 40.04 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.01 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.9 t -129.91 71.79 1.46 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.29 0.567 . . . . 0.0 109.906 -179.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.743 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -90.42 -167.98 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.93 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -75.91 -52.92 9.26 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.245 -178.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -70.8 -25.83 63.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.177 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HB2' HD11 ' A' ' 26' ' ' ILE . 32.4 m-85 -128.94 128.34 23.41 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.633 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.92 179.23 2.86 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.756 2.304 . . . . 0.0 111.757 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 87.3 m -57.61 95.52 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.157 0 O-C-N 123.301 0.375 . . . . 0.0 110.492 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.617 ' HB3' ' OD1' ' A' ' 8' ' ' ASP . 8.7 p -144.57 142.21 30.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.193 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.675 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -70.78 129.67 39.71 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.236 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -139.05 163.9 42.94 Favored Pre-proline 0 C--N 1.318 -0.796 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.52 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 52.6 Cg_exo -49.67 141.73 26.39 Favored 'Trans proline' 0 N--CA 1.464 -0.234 0 C-N-CA 121.99 1.793 . . . . 0.0 111.122 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.589 ' HE2' ' HB2' ' A' ' 22' ' ' LEU . 30.3 ttmt -77.94 123.56 26.93 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.75 43.51 6.79 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -178.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 15.8 p90 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.41 -0.805 . . . . 0.0 110.46 -179.484 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.3 p -159.3 151.24 20.73 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.463 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.492 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 87.4 mt -86.46 121.59 29.22 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.725 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.79 -162.18 0.35 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.256 0.55 . . . . 0.0 112.216 -178.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.468 ' H ' ' CD ' ' A' ' 5' ' ' GLU . 8.4 pm0 -64.06 125.71 25.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.792 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.74 45.45 5.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.277 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.469 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -111.38 117.75 33.95 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.785 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.551 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 1.2 m-20 -56.68 131.66 49.68 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.379 0.609 . . . . 0.0 111.614 -179.036 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.434 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 2.7 m -83.1 154.92 24.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.439 -178.767 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.2 m -79.1 130.56 69.15 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.907 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.45 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 29.2 Cg_endo -63.83 -55.29 0.69 Allowed 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.021 2.481 . . . . 0.0 113.78 -178.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.45 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.0 m-90 -80.26 -52.24 7.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.727 0.299 . . . . 0.0 111.32 -179.023 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.9 p -174.09 149.35 1.44 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.474 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.09 -151.43 10.24 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -79.61 147.35 32.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.295 0.569 . . . . 0.0 111.067 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.1 m -83.71 156.53 22.55 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.122 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.456 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 45.6 m -64.22 141.01 58.92 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.426 0.155 . . . . 0.0 110.834 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.2 m -63.74 148.19 49.78 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.743 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.02 141.89 59.16 Favored Pre-proline 0 C--N 1.312 -1.058 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.196 -179.888 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -104.64 40.98 3.13 Favored 'Cis proline' 0 N--CA 1.448 -1.179 0 C-N-CA 123.752 -1.353 . . . . 0.0 113.641 1.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.463 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 59.8 m-85 -72.41 179.48 3.44 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.317 0.579 . . . . 0.0 111.417 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.603 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 59.7 tp -151.95 138.92 19.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.783 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.592 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.1 t -71.84 111.76 7.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.822 0.344 . . . . 0.0 111.132 -179.415 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.739 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 72.2 p -84.91 108.0 17.34 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.9 t -118.99 59.04 0.84 Allowed 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.108 -177.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.611 HG13 ' HB2' ' A' ' 29' ' ' TYR . 10.3 pt -90.22 -171.07 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.983 0.42 . . . . 0.0 111.332 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -67.01 -81.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -177.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.543 ' HD1' ' HD1' ' A' ' 29' ' ' TYR . 0.3 OUTLIER -79.86 36.06 0.32 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -177.032 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.611 ' HB2' HG13 ' A' ' 26' ' ' ILE . 11.3 m-85 -148.67 131.52 7.99 Favored Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 177.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -60.98 131.21 35.92 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.553 2.169 . . . . 0.0 111.0 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.739 ' HA ' ' O ' ' A' ' 24' ' ' SER . 69.8 m -61.99 100.56 0.16 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.446 0.641 . . . . 0.0 111.015 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.551 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 5.2 p -145.02 148.25 33.52 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.389 -178.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.592 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 14.9 m -67.54 128.84 37.95 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 120.933 0.397 . . . . 0.0 110.242 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.61 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 26.0 mmt85 -132.48 168.07 19.53 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.884 -1.524 . . . . 0.0 106.884 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.61 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 10.0 Cg_endo -55.02 151.15 35.27 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 121.429 1.419 . . . . 0.0 110.48 179.202 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.603 ' HE2' ' HB2' ' A' ' 22' ' ' LEU . 20.2 ttmt -77.41 118.21 19.65 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.323 -178.23 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.74 47.01 1.55 Allowed Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.5 -178.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 C--O 1.253 1.243 0 CA-C-O 117.853 -1.07 . . . . 0.0 110.072 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.4 tptp . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p -161.96 159.27 26.35 Favored 'General case' 0 C--N 1.322 -0.628 0 O-C-N 123.596 0.56 . . . . 0.0 109.988 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.452 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.1 mt -80.03 133.09 36.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.351 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.41 -168.09 1.25 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.202 0.525 . . . . 0.0 112.031 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.51 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 6.4 pt-20 -72.96 132.52 43.54 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.106 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.67 38.74 9.2 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.535 -1.212 . . . . 0.0 110.411 -178.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.86 133.58 52.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.396 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -58.68 145.39 40.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.261 0.553 . . . . 0.0 111.473 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.22 142.72 50.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.826 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.5 m -79.8 128.45 74.24 Favored Pre-proline 0 C--N 1.318 -0.79 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.489 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.5 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 51.8 Cg_endo -67.87 -43.31 5.29 Favored 'Trans proline' 0 N--CA 1.474 0.334 0 C-N-CA 123.434 2.756 . . . . 0.0 113.925 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.5 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 19.4 m-90 -78.99 -44.82 21.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.611 0.243 . . . . 0.0 111.453 -178.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.2 t -175.47 139.09 0.42 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.303 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.71 -147.83 7.01 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -81.29 152.02 27.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.93 0.395 . . . . 0.0 110.24 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 m -85.49 144.3 28.03 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 54.3 m -72.16 140.58 48.87 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.0 m -64.13 142.39 58.43 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.697 ' HD2' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.64 143.83 63.9 Favored Pre-proline 0 C--N 1.311 -1.101 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.12 -179.555 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -101.0 44.53 2.81 Favored 'Cis proline' 0 N--CA 1.455 -0.768 0 C-N-CA 124.069 -1.221 . . . . 0.0 113.858 1.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.51 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 40.3 m-85 -87.5 147.0 25.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.154 0.502 . . . . 0.0 110.634 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 56.7 tp -121.61 143.66 49.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.759 -179.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 41.9 t -68.02 114.23 6.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.926 0.393 . . . . 0.0 109.951 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.567 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 97.4 p -96.51 126.68 41.87 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.122 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 77.5 m -122.52 59.19 1.04 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.004 0.43 . . . . 0.0 110.407 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.771 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -84.72 -174.85 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.986 0.422 . . . . 0.0 111.055 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -81.16 -47.98 12.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.53 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -64.97 -25.37 67.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.646 -178.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.481 ' H ' HG12 ' A' ' 26' ' ' ILE . 96.9 m-85 -141.75 128.93 11.52 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.562 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.03 173.65 5.72 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.869 2.379 . . . . 0.0 112.229 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.567 ' HA ' ' O ' ' A' ' 24' ' ' SER . 92.6 m -50.33 108.55 0.23 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.522 0.677 . . . . 0.0 111.768 -179.383 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.4 p -152.46 131.32 12.48 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.969 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.9 m -65.32 128.19 34.85 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.423 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 81.0 mtt-85 -138.16 162.85 51.48 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.423 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 51.5 Cg_exo -48.69 144.1 15.22 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.244 1.962 . . . . 0.0 111.483 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -77.16 119.8 21.36 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.166 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.59 44.68 6.05 Favored Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 110.784 -0.926 . . . . 0.0 110.784 -178.208 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.8 p90 . . . . . 0 C--O 1.252 1.199 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.421 -179.625 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' LYS . . . . . 0.509 ' HG2' ' N ' ' A' ' 2' ' ' CYS . 19.8 ttpp . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.68 ' HA ' ' O ' ' A' ' 16' ' ' SER . 18.4 p -113.63 157.94 21.49 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.504 178.818 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 93.0 mt -99.71 130.15 45.9 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.773 -178.566 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.01 -165.88 0.72 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.095 0.474 . . . . 0.0 111.719 -179.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.603 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 13.2 pt-20 -71.35 131.65 43.71 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.054 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 65.4 38.9 5.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.553 -178.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.436 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -106.13 126.9 52.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.457 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -51.72 136.75 26.85 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.415 0.447 . . . . 0.0 111.021 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 32' ' ' SER . 1.4 p -129.59 142.54 50.72 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.909 0.861 . . . . 0.0 112.213 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.2 m -79.9 130.49 66.74 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 114.293 -1.322 . . . . 0.0 110.336 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.488 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 58.8 Cg_endo -69.54 -43.58 2.75 Favored 'Trans proline' 0 N--CA 1.474 0.333 0 C-N-CA 123.386 2.724 . . . . 0.0 113.981 -178.572 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.488 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.3 m-90 -79.07 -45.53 19.93 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.8 t -175.36 143.93 0.68 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.786 0.326 . . . . 0.0 111.106 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.61 -153.16 18.21 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.446 ' OD2' ' HB3' ' A' ' 1' ' ' LYS . 11.5 m-20 -69.8 145.81 51.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.099 0.476 . . . . 0.0 110.332 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.68 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 3.9 m -86.21 146.54 26.51 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.19 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 34.3 m -69.66 139.35 53.51 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.805 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 56.4 m -63.47 149.19 46.65 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 61.2 pttt -78.91 142.33 60.21 Favored Pre-proline 0 C--N 1.311 -1.094 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.17 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 83.0 Cg_endo -103.16 39.47 4.09 Favored 'Cis proline' 0 N--CA 1.45 -1.046 0 C-N-CA 123.991 -1.254 . . . . 0.0 113.81 1.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.603 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 57.4 m-85 -77.71 -176.37 4.33 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 121.992 -0.442 . . . . 0.0 111.202 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.6 tp -159.21 139.52 12.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.3 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.9 t -69.65 112.57 6.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.842 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.61 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 55.2 p -99.45 108.62 21.12 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.074 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 31' ' ' CYS . 1.8 t -103.96 58.41 0.73 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.062 -178.743 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.822 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -91.4 -175.41 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.18 -179.612 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -86.67 -56.65 3.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -178.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -61.47 -32.87 72.89 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.827 -178.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.75 ' HB2' HD11 ' A' ' 26' ' ' ILE . 7.8 m-85 -115.7 129.55 25.06 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.801 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.7 142.64 91.3 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.545 2.164 . . . . 0.0 111.409 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.61 ' HA ' ' O ' ' A' ' 24' ' ' SER . 72.4 m -54.84 100.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.816 0.817 . . . . 0.0 111.348 -179.143 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.406 ' HA ' ' SG ' ' A' ' 9' ' ' CYS . 6.4 p -153.37 149.59 27.98 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.144 -0.934 . . . . 0.0 110.254 -178.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.7 m -67.99 128.71 37.51 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.418 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 22.7 mmt180 -132.92 164.44 43.85 Favored Pre-proline 0 C--N 1.32 -0.687 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.418 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 52.7 Cg_exo -49.99 143.38 24.51 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.028 1.818 . . . . 0.0 110.795 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -77.34 115.89 17.49 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -179.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.53 44.6 3.94 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -177.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.5 p90 . . . . . 0 C--O 1.252 1.196 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.449 -179.258 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' LYS . . . . . 0.467 ' HG3' ' N ' ' A' ' 2' ' ' CYS . 51.6 tptt . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.4 p -149.41 149.38 30.74 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.523 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 85.3 mt -79.63 137.37 37.08 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.004 -178.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.62 -166.78 0.93 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.224 0.535 . . . . 0.0 112.065 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.4 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 38.7 tt0 -72.06 134.37 45.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.906 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.11 46.07 6.63 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.508 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -122.01 122.5 39.45 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.458 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.667 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 37.4 m-20 -57.21 131.17 49.17 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.57 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.523 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 26.2 p -95.88 -173.98 3.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.455 -179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 21.1 t -160.29 138.74 7.54 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.58 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.59 -31.56 87.11 Favored 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 123.127 2.551 . . . . 0.0 113.307 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -137.54 -51.44 0.63 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.869 0.366 . . . . 0.0 111.42 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 m -79.42 50.96 1.16 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.942 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 178.41 141.12 4.16 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.657 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.99 163.83 18.99 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.121 0.486 . . . . 0.0 111.098 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.53 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 15.9 m -79.15 153.84 29.77 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.962 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 12.5 m -64.28 142.87 58.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.364 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.9 m -64.64 144.73 57.01 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 177.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.766 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -77.55 143.23 67.71 Favored Pre-proline 0 C--N 1.313 -0.992 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.892 -178.742 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.526 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 84.6 Cg_endo -102.72 35.64 6.18 Favored 'Cis proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.181 -1.591 . . . . 0.0 113.893 1.078 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -67.2 150.06 49.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.29 0.567 . . . . 0.0 111.368 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.0 tp -124.89 134.4 52.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.567 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.668 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 11.3 t -74.87 122.42 23.36 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.0 p -126.69 129.3 48.17 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.243 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.1 76.6 1.47 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.309 -179.008 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.81 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -84.9 -168.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.036 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -84.98 -50.56 7.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.915 -178.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -66.99 -26.45 66.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.513 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.528 ' HB2' HD11 ' A' ' 26' ' ' ILE . 75.6 m-85 -136.99 138.38 25.65 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.474 ' HG2' ' OD1' ' A' ' 8' ' ' ASP . 36.4 Cg_endo -67.17 -158.92 0.04 OUTLIER 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.225 1.95 . . . . 0.0 112.215 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 73.1 m -68.28 77.38 0.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.033 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.667 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 3.5 p -114.65 141.5 47.71 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.668 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 21.2 m -71.95 118.58 14.99 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 24.5 mmm-85 -121.47 162.08 38.04 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.4 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 47.7 Cg_exo -50.99 152.28 10.46 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.28 1.986 . . . . 0.0 112.121 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 21.4 tptm -77.42 108.31 10.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.75 47.51 3.94 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.063 -1.215 . . . . 0.0 110.063 -177.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.5 p90 . . . . . 0 C--O 1.252 1.195 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.897 -179.08 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' LYS . . . . . 0.571 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 7.6 ptpp? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 16' ' ' SER . 25.7 p -118.59 150.39 39.75 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.649 178.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.503 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 82.3 mt -84.91 127.88 34.36 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.607 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.77 -163.48 0.48 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.078 0.466 . . . . 0.0 111.634 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.606 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 5.0 pt-20 -70.93 130.97 42.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.347 0.594 . . . . 0.0 111.341 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 64.52 39.96 6.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.855 -178.608 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.48 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -106.37 128.55 54.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.473 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.414 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 3.6 p30 -58.81 138.47 57.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.155 0.502 . . . . 0.0 111.406 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.4 m -97.57 151.66 19.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.125 0.488 . . . . 0.0 110.629 -179.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.1 m -79.57 128.23 75.58 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.973 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.456 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 30.3 Cg_endo -63.96 -54.82 0.78 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 123.041 2.494 . . . . 0.0 113.722 -178.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.456 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.2 m-90 -80.61 -52.55 7.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.797 0.332 . . . . 0.0 111.255 -179.192 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 t -175.86 150.01 0.98 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.67 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.69 -142.77 6.96 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.878 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.571 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 46.6 m-20 -72.13 144.67 48.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.204 0.526 . . . . 0.0 110.652 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.582 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 7.7 m -95.75 150.72 20.08 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.816 179.497 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.649 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 60.7 m -63.71 142.98 58.2 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.618 0.247 . . . . 0.0 111.625 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.5 m -68.12 143.66 55.34 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 177.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 8.7 ptpp? -78.87 141.73 59.65 Favored Pre-proline 0 C--N 1.311 -1.097 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.417 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.564 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 86.7 Cg_endo -102.91 36.48 5.62 Favored 'Cis proline' 0 N--CA 1.454 -0.827 0 C-N-CA 124.18 -1.175 . . . . 0.0 113.931 1.376 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.606 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 32.8 m-85 -69.53 150.05 47.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.146 0.498 . . . . 0.0 110.774 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -119.64 134.68 55.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.719 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.1 t -76.16 113.12 13.34 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.829 0.347 . . . . 0.0 111.013 179.727 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 64.8 p -84.88 102.73 13.34 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 31' ' ' CYS . 4.2 t -110.13 54.89 0.65 Allowed 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -178.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.468 HG13 ' H ' ' A' ' 29' ' ' TYR . 16.0 pt -110.2 -170.56 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.202 -179.324 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -78.36 -56.53 4.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.228 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -65.15 -33.56 76.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.168 0.508 . . . . 0.0 111.289 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.468 ' H ' HG13 ' A' ' 26' ' ' ILE . 4.3 m-85 -114.54 112.69 45.69 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.027 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -56.33 141.36 89.02 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.9 2.4 . . . . 0.0 111.4 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.689 ' HA ' ' O ' ' A' ' 24' ' ' SER . 62.8 m -50.92 96.51 0.01 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.766 0.794 . . . . 0.0 112.536 -178.394 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.414 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 7.7 p -158.2 145.04 17.7 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.772 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -67.11 125.65 26.7 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.607 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 25.0 mmt85 -123.23 166.25 19.0 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.607 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 12.2 Cg_endo -57.2 166.25 4.53 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 121.629 1.553 . . . . 0.0 111.398 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.564 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 47.7 tttp -77.83 73.91 4.39 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.959 0.885 . . . . 0.0 109.53 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.27 49.39 0.05 OUTLIER Glycine 0 N--CA 1.441 -0.998 0 CA-C-N 113.697 -1.592 . . . . 0.0 109.469 -177.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.2 p-90 . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.404 -178.846 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? . . . . . 0 N--CA 1.482 1.14 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 16' ' ' SER . 27.2 p -162.32 153.83 18.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.109 0.481 . . . . 0.0 110.778 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 89.1 mt -80.28 128.17 33.22 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.372 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.65 -166.65 0.91 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.991 0.424 . . . . 0.0 111.424 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.606 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 8.1 pt-20 -72.4 130.89 41.78 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.152 0.501 . . . . 0.0 110.791 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 69.69 34.23 2.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.428 -178.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.459 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -104.14 127.03 51.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.815 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -57.16 132.72 53.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.846 0.355 . . . . 0.0 111.31 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.09 137.03 52.55 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.499 0.666 . . . . 0.0 110.952 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.0 m -79.44 128.87 73.81 Favored Pre-proline 0 C--N 1.314 -0.945 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.475 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.516 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 56.5 Cg_endo -68.42 -41.12 6.98 Favored 'Trans proline' 0 N--CA 1.474 0.338 0 C-N-CA 123.557 2.838 . . . . 0.0 113.943 -178.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.516 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 20.8 m-90 -78.7 -43.16 26.51 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.09 -178.621 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 t -177.79 138.55 0.21 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.474 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.91 -153.74 10.41 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -83.01 152.34 25.45 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.402 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 13.3 m -83.54 144.76 29.29 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.016 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 12.9 m -70.9 138.16 49.9 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.8 m -61.82 146.68 48.82 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 178.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -82.75 147.79 56.09 Favored Pre-proline 0 C--N 1.311 -1.096 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.152 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.536 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 94.1 Cg_endo -97.82 32.28 10.92 Favored 'Cis proline' 0 N--CA 1.451 -0.997 0 C-N-CA 122.988 -1.672 . . . . 0.0 113.752 1.218 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.606 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 39.1 m-85 -70.6 156.54 39.3 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.199 0.523 . . . . 0.0 111.304 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 tp -131.36 140.7 49.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.316 -178.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 50.6 t -71.68 125.51 27.29 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.443 ' OG ' ' HG2' ' A' ' 34' ' ' ARG . 63.6 p -132.46 133.99 44.52 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -179.348 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -118.65 86.37 2.53 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.727 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -91.26 -168.76 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.544 -179.425 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -75.32 -64.13 1.13 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.02 -39.58 87.07 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.955 0.407 . . . . 0.0 111.367 -177.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.478 ' HB2' HD11 ' A' ' 26' ' ' ILE . 31.6 m-85 -105.77 129.79 24.07 Favored Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 16.2 Cg_exo -67.2 -167.95 0.15 Allowed 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.34 2.027 . . . . 0.0 111.596 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 90.0 m -62.86 104.61 0.56 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.0 p -144.98 137.53 26.17 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.894 0.378 . . . . 0.0 111.597 -178.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.9 m -72.53 120.59 18.35 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 177.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.443 ' HG2' ' OG ' ' A' ' 24' ' ' SER . 21.1 mmm-85 -121.45 167.2 13.96 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.559 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 72.7 Cg_exo -47.62 163.95 0.17 Allowed 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 122.726 2.284 . . . . 0.0 112.591 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.536 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 22.3 tptm -76.86 73.14 3.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.745 0.783 . . . . 0.0 109.666 -179.545 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 123.65 23.37 2.09 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.92 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.459 ' O ' ' HB2' ' A' ' 35' ' ' PRO . 1.3 m-90 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.481 -0.771 . . . . 0.0 111.471 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' LYS . . . . . 0.507 ' HG3' ' OD2' ' A' ' 15' ' ' ASP . 26.2 tptp . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 22.7 p -161.36 159.0 27.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.15 -178.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.577 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 69.3 mt -80.11 120.57 24.43 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.45 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.43 -155.52 0.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.506 0.669 . . . . 0.0 112.693 -178.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.431 ' OE1' ' HD3' ' A' ' 35' ' ' PRO . 12.6 tp10 -65.56 128.46 36.03 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.19 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.534 ' HB2' ' NH1' ' A' ' 34' ' ' ARG . . . 59.66 43.23 15.93 Favored 'General case' 0 CA--C 1.515 -0.386 0 O-C-N 124.144 0.902 . . . . 0.0 110.615 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -102.07 129.81 48.49 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 119.897 -0.721 . . . . 0.0 111.803 -178.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -62.73 134.37 56.19 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.221 0.534 . . . . 0.0 110.537 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.4 m -92.8 152.81 19.24 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.602 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.0 m -79.11 131.93 64.88 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.999 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.421 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 24.8 Cg_endo -62.47 -55.08 1.02 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.142 2.561 . . . . 0.0 113.771 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.421 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 12.8 m-90 -88.42 -58.27 2.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.865 0.364 . . . . 0.0 111.23 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.3 m -161.62 146.36 13.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.967 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.56 -145.47 8.02 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.985 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.507 ' OD2' ' HG3' ' A' ' 1' ' ' LYS . 0.7 OUTLIER -70.0 148.13 49.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.359 0.6 . . . . 0.0 111.447 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.2 m -99.58 150.34 22.34 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.068 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.518 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 61.3 m -63.47 141.43 58.77 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.629 0.252 . . . . 0.0 111.338 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.6 m -67.38 143.65 56.21 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.18 141.88 62.98 Favored Pre-proline 0 C--N 1.31 -1.125 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.438 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.455 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 92.1 Cg_endo -102.66 44.82 2.63 Favored 'Cis proline' 0 N--CA 1.453 -0.895 0 C-N-CA 124.073 -1.219 . . . . 0.0 114.095 1.334 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -81.76 148.41 28.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.229 0.538 . . . . 0.0 110.457 179.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.0 tp -119.47 139.19 52.47 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.575 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.566 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.4 t -71.1 106.19 3.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 110.401 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -88.4 130.83 35.07 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.513 179.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.9 t -136.47 63.77 1.57 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.407 0.623 . . . . 0.0 109.331 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.79 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -81.22 -168.64 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.241 -179.53 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -66.95 -60.58 2.52 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -74.07 -36.49 64.32 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -177.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.693 ' HB2' HD11 ' A' ' 26' ' ' ILE . 23.4 m-85 -103.63 124.96 36.16 Favored Pre-proline 0 C--N 1.322 -0.621 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.079 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.82 172.45 13.65 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.817 2.345 . . . . 0.0 111.966 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 88.2 m -52.41 105.38 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 O-C-N 123.468 0.48 . . . . 0.0 111.175 -179.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 p -152.73 135.23 15.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.39 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.566 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.3 m -65.86 129.06 38.45 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.538 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.534 ' NH1' ' HB2' ' A' ' 6' ' ' ALA . 34.4 mmt180 -138.04 162.18 55.45 Favored Pre-proline 0 C--N 1.327 -0.409 0 O-C-N 125.504 1.753 . . . . 0.0 107.649 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.431 ' HD3' ' OE1' ' A' ' 5' ' ' GLU . 44.1 Cg_exo -51.96 147.6 25.63 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.261 1.974 . . . . 0.0 111.728 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 32.6 ttpt -77.64 94.16 4.35 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 112.21 43.88 0.89 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 -178.117 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.8 p90 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.283 -0.865 . . . . 0.0 110.483 -179.334 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 83.5 tttt . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.563 ' HA ' ' O ' ' A' ' 16' ' ' SER . 28.9 p -77.7 146.97 35.68 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.469 -0.892 . . . . 0.0 110.739 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 63.2 mt -82.3 127.18 32.96 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.89 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.16 -169.75 1.72 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.89 0.376 . . . . 0.0 111.57 -179.15 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' A' ' 5' ' ' GLU . 10.4 pt-20 -75.12 133.24 41.57 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.395 0.616 . . . . 0.0 110.8 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.432 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 69.03 33.74 3.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.157 -1.383 . . . . 0.0 110.207 -177.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -110.48 134.81 52.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.773 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -57.37 147.42 26.03 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.094 0.473 . . . . 0.0 111.538 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.7 p -137.49 149.34 46.74 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.476 0.655 . . . . 0.0 111.288 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.0 m -79.43 125.66 82.55 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.584 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.518 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 60.2 Cg_endo -70.47 -42.21 2.83 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 123.213 2.609 . . . . 0.0 113.437 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.518 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.8 m-90 -79.28 -46.5 17.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.299 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.9 t -176.59 140.67 0.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.844 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 177.69 -160.87 27.73 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -70.04 148.81 48.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.32 0.581 . . . . 0.0 110.787 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.563 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 8.0 m -82.88 149.57 27.03 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.924 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 5.0 m -74.53 145.14 43.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.22 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.25 146.41 50.97 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.468 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.7 ptmt -79.18 142.99 59.92 Favored Pre-proline 0 C--N 1.311 -1.102 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.079 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.59 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 82.1 Cg_endo -103.55 43.33 2.8 Favored 'Cis proline' 0 N--CA 1.449 -1.089 0 C-N-CA 124.089 -1.213 . . . . 0.0 113.697 1.191 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.674 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 18.4 m-85 -73.37 -164.33 0.19 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 117.957 0.344 . . . . 0.0 111.223 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 24.3 tp -168.07 133.32 1.83 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.813 -0.176 . . . . 0.0 111.247 -178.564 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.8 t -70.21 128.39 36.1 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.432 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.508 ' OG ' ' HG2' ' A' ' 34' ' ' ARG . 22.6 p -142.53 132.02 23.74 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.805 0.336 . . . . 0.0 110.623 -178.66 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.436 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.7 OUTLIER -112.05 77.77 1.07 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.519 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.782 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -89.16 -169.48 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.643 -179.289 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -84.01 -50.35 8.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.765 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -63.01 -28.92 70.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.303 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.448 ' H ' HG12 ' A' ' 26' ' ' ILE . 67.6 m-85 -140.12 134.29 15.58 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.303 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 21.9 Cg_exo -64.83 -166.99 0.09 OUTLIER 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.49 2.126 . . . . 0.0 111.828 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.436 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 93.7 m -58.32 103.72 0.17 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.999 0.428 . . . . 0.0 110.082 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.6 p -151.2 141.01 21.88 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.027 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 18.8 m -74.97 123.06 24.46 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 177.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.508 ' HG2' ' OG ' ' A' ' 24' ' ' SER . 21.1 mmm-85 -119.04 162.0 33.69 Favored Pre-proline 0 C--N 1.316 -0.869 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.674 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 32.7 Cg_exo -53.35 157.52 8.92 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.37 2.046 . . . . 0.0 111.589 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 1.3 tppp? -77.72 113.68 15.83 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.46 48.72 5.49 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 -177.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.1 p90 . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.862 -179.074 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.5 p -160.52 159.14 30.36 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 123.443 0.464 . . . . 0.0 109.956 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 92.4 mt -79.63 132.13 36.17 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.745 -179.32 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.43 -166.37 0.84 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.081 0.467 . . . . 0.0 111.786 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.572 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 12.3 pt-20 -73.1 132.06 42.83 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.15 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.99 36.85 9.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.48 -178.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -100.78 137.22 39.46 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.791 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -56.59 142.14 40.62 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.969 0.414 . . . . 0.0 111.553 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 22.2 p -153.03 171.77 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.3 0.572 . . . . 0.0 111.37 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.537 ' HB2' ' O ' ' A' ' 13' ' ' SER . 66.9 m -156.51 123.79 2.71 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.507 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 32.3 Cg_exo -63.82 -29.26 68.01 Favored 'Trans proline' 0 N--CA 1.474 0.38 0 C-N-CA 123.493 2.795 . . . . 0.0 113.399 -178.473 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.9 m-90 -78.85 -19.62 51.58 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.003 -179.385 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.537 ' O ' ' HB2' ' A' ' 10' ' ' SER . 9.4 t -178.17 126.29 0.12 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.372 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 159.32 164.61 14.89 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.92 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.88 158.01 29.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.062 0.458 . . . . 0.0 110.63 179.508 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.1 m -79.62 141.98 36.02 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.668 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.576 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 19.8 m -74.17 141.68 45.5 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.9 m -64.36 146.02 55.11 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 60.9 pttt -78.44 141.62 61.44 Favored Pre-proline 0 C--N 1.311 -1.09 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.571 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 79.6 Cg_endo -103.49 37.25 5.0 Favored 'Cis proline' 0 N--CA 1.453 -0.902 0 C-N-CA 123.906 -1.289 . . . . 0.0 113.779 1.372 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.944 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 58.2 m-85 -69.39 159.51 33.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.902 0.382 . . . . 0.0 110.773 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.584 HD23 ' HE1' ' A' ' 38' ' ' TRP . 36.8 tp -132.85 130.19 39.44 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.6 t -69.79 124.98 25.39 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.399 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.3 p -148.31 145.27 28.08 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.745 0.307 . . . . 0.0 110.845 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.427 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -113.17 65.78 0.65 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.873 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.887 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -82.28 -170.2 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.349 -178.762 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -83.16 -50.47 8.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.017 -178.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -59.96 -32.51 70.88 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.649 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -141.81 134.65 14.05 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.06 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.19 -160.75 0.05 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.293 1.995 . . . . 0.0 111.811 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.427 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 90.1 m -59.14 98.51 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.816 0.341 . . . . 0.0 110.104 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.442 ' O ' ' HG2' ' A' ' 34' ' ' ARG . 6.2 p -155.5 144.42 20.66 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.672 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 32.9 m -70.08 110.05 4.91 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.749 -1.574 . . . . 0.0 106.749 177.201 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.645 ' HB2' ' CD1' ' A' ' 38' ' ' TRP . 12.2 mmm-85 -101.73 167.15 11.0 Favored Pre-proline 0 C--N 1.313 -1.001 0 O-C-N 124.143 0.902 . . . . 0.0 108.632 -178.802 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.944 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 17.8 Cg_endo -59.81 166.17 8.86 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 121.822 1.681 . . . . 0.0 111.267 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 20.9 tptm -78.22 75.13 4.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.839 0.828 . . . . 0.0 109.428 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.84 47.55 0.05 OUTLIER Glycine 0 N--CA 1.447 -0.626 0 CA-C-N 114.019 -1.446 . . . . 0.0 109.549 -177.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.645 ' CD1' ' HB2' ' A' ' 34' ' ' ARG . 6.8 p-90 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.056 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.6 pttt . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p -161.32 159.79 28.91 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 123.285 0.365 . . . . 0.0 110.204 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 75.2 mt -79.18 126.25 30.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.457 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.403 ' HB1' ' OE1' ' A' ' 5' ' ' GLU . . . -78.9 -166.9 0.98 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.99 0.424 . . . . 0.0 112.043 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.582 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.6 pm0 -67.56 129.95 41.5 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.502 0.668 . . . . 0.0 111.482 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 66.88 39.01 3.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.947 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.466 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -105.38 133.17 50.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.919 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -60.78 136.93 58.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.112 0.482 . . . . 0.0 111.107 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.6 m -91.07 155.43 18.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.273 0.559 . . . . 0.0 111.074 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 25.1 p -79.12 132.06 64.48 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.616 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -63.3 -41.08 28.65 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 123.035 2.49 . . . . 0.0 113.62 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.3 m-90 -129.57 -43.16 1.27 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.7 t -149.56 141.24 23.54 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.92 -139.38 5.61 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 111.519 -0.632 . . . . 0.0 111.519 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.64 150.43 20.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.116 0.484 . . . . 0.0 111.196 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 m -94.45 150.02 20.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.918 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.509 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 60.2 m -64.34 142.38 58.44 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.609 0.242 . . . . 0.0 111.593 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 70.9 m -68.8 142.34 54.91 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.521 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.14 144.28 62.6 Favored Pre-proline 0 C--N 1.315 -0.934 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.534 -179.575 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.472 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 89.2 Cg_endo -100.89 32.47 9.24 Favored 'Cis proline' 0 N--CA 1.451 -0.997 0 C-N-CA 123.334 -1.527 . . . . 0.0 113.479 1.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.582 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 28.1 m-85 -65.63 148.02 52.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.136 0.493 . . . . 0.0 110.455 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.6 tp -122.39 138.23 54.6 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.865 -178.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 48.8 t -69.04 112.71 5.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.02 0.438 . . . . 0.0 109.986 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.431 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 83.9 p -89.44 121.47 31.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.287 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.0 m -119.97 52.29 1.13 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.493 HG13 ' H ' ' A' ' 29' ' ' TYR . 12.3 pt -81.78 -170.76 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.658 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -72.98 -59.71 2.58 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -177.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -71.68 -32.24 67.65 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.493 ' H ' HG13 ' A' ' 26' ' ' ILE . 53.2 m-85 -111.5 124.31 32.86 Favored Pre-proline 0 C--N 1.321 -0.662 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.088 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.01 166.33 29.48 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.848 2.365 . . . . 0.0 111.595 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 24' ' ' SER . 92.0 m -49.48 104.35 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.547 0.689 . . . . 0.0 112.046 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.526 ' O ' ' HD3' ' A' ' 34' ' ' ARG . 6.7 p -153.57 137.9 16.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.33 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.3 m -65.42 119.93 11.9 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.526 ' HD3' ' O ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -118.72 159.22 45.13 Favored Pre-proline 0 C--N 1.324 -0.536 0 O-C-N 124.386 1.053 . . . . 0.0 108.223 179.835 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.548 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 50.0 Cg_exo -52.66 159.81 4.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.5 2.133 . . . . 0.0 112.48 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.472 ' HD3' ' O ' ' A' ' 20' ' ' PRO . 49.3 tptt -77.48 109.91 11.81 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.65 46.96 5.01 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 -177.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 16.7 p90 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.679 -179.204 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.2 tttt . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.0 p -161.3 158.07 26.49 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.484 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 71.0 mt -80.82 122.12 26.79 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.559 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.09 -162.44 0.39 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.155 0.502 . . . . 0.0 111.976 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.568 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 8.8 pm0 -63.75 126.17 26.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.573 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.79 45.54 4.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.467 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.461 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -115.61 120.83 40.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.631 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.538 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.2 m-20 -50.99 129.72 24.24 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.188 0.518 . . . . 0.0 112.282 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.89 147.94 30.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.3 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.4 m -78.99 130.57 69.51 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.19 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.478 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 40.0 Cg_endo -66.16 -52.21 0.94 Allowed 'Trans proline' 0 N--CA 1.472 0.216 0 C-N-CA 123.141 2.561 . . . . 0.0 113.604 -178.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.478 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 12.7 m-90 -79.98 -56.31 4.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.76 0.314 . . . . 0.0 111.396 -178.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.7 m -161.8 140.66 9.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.579 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 175.27 -153.85 16.46 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.506 -0.637 . . . . 0.0 111.506 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -70.16 143.21 52.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.999 0.428 . . . . 0.0 110.678 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.6 m -88.48 147.52 24.62 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.604 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.1 m -69.3 144.53 53.53 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.27 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 83.3 m -66.53 145.79 55.24 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.711 ' HD2' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.19 139.72 56.58 Favored Pre-proline 0 C--N 1.307 -1.239 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.274 -179.473 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.549 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 74.9 Cg_endo -103.04 36.37 5.63 Favored 'Cis proline' 0 N--CA 1.456 -0.732 0 C-N-CA 124.188 -1.172 . . . . 0.0 114.083 1.452 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.568 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 62.5 m-85 -66.98 147.5 53.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.324 0.583 . . . . 0.0 110.855 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.5 tp -116.47 135.42 53.85 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.168 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.4 t -70.37 124.63 24.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -132.12 134.67 45.72 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.903 0.382 . . . . 0.0 111.143 -178.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.419 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -113.16 85.54 2.2 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 179.663 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.82 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -79.84 -171.47 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.887 -178.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -71.91 -69.84 0.37 Allowed 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -177.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -69.19 -41.28 77.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.959 0.409 . . . . 0.0 111.885 -177.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.438 ' O ' HG12 ' A' ' 26' ' ' ILE . 46.7 m-85 -97.71 135.56 21.55 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.125 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.59 -171.26 0.37 Allowed 'Trans proline' 0 C--O 1.238 0.487 0 C-N-CA 122.474 2.116 . . . . 0.0 112.692 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.419 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 75.7 m -61.14 106.02 0.56 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.135 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 4.5 p -144.32 138.63 28.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.074 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 12.7 m -66.1 130.23 42.51 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.995 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.402 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 24.4 mmt85 -128.38 161.51 56.31 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 52.0 Cg_exo -51.25 154.37 8.16 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 122.531 2.154 . . . . 0.0 112.314 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 6.9 tmtm? -78.12 71.54 4.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.58 43.9 0.13 Allowed Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.088 -1.415 . . . . 0.0 109.663 -177.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 13.0 p90 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.972 -178.797 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 81.9 tttt . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.8 p -76.97 146.23 37.6 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 118.889 -1.125 . . . . 0.0 110.88 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 9' ' ' CYS . 90.4 mt -78.83 137.78 37.86 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.096 -1.411 . . . . 0.0 110.518 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.78 -178.87 5.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.43 ' HB3' ' CZ ' ' A' ' 21' ' ' TYR . 19.6 pt-20 -69.99 134.84 48.74 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.041 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . . . 56.48 40.15 29.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.311 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.45 135.8 52.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.151 -179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -57.02 141.57 45.24 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.501 0.501 . . . . 0.0 109.881 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.548 ' HA ' HD13 ' A' ' 3' ' ' LEU . 32.4 m -79.11 163.76 24.83 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.103 0.478 . . . . 0.0 110.982 -178.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.484 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 28.8 p -78.62 115.31 50.68 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.314 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 5.9 Cg_exo -79.13 -56.57 0.04 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.994 2.463 . . . . 0.0 112.348 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 23.8 m-90 -85.41 -40.49 16.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.12 0.486 . . . . 0.0 110.57 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.0 m -87.9 -163.58 0.97 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.243 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -160.08 129.37 2.17 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.136 -1.03 . . . . 0.0 112.412 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -159.41 152.53 22.13 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.615 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 5.9 m -88.14 147.08 25.08 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.985 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.411 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 8.4 m -74.54 145.12 43.7 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.426 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 58.8 m -60.77 144.29 52.74 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.36 144.18 65.81 Favored Pre-proline 0 C--N 1.312 -1.028 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -99.0 52.31 1.36 Allowed 'Cis proline' 0 N--CA 1.454 -0.821 0 C-N-CA 124.065 -1.223 . . . . 0.0 113.905 1.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 5' ' ' GLU . 37.8 m-85 -105.15 145.98 29.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.056 0.455 . . . . 0.0 110.316 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.7 tp -127.91 143.31 51.1 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.76 -178.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 41.9 t -66.48 122.07 16.74 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.1 p -126.33 139.92 52.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.324 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.9 t -135.58 96.3 3.42 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.641 HD11 ' HB2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -109.59 -168.02 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.911 -179.251 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -70.73 -59.44 2.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -73.65 -34.55 65.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.847 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.641 ' HB2' HD11 ' A' ' 26' ' ' ILE . 8.1 m-85 -109.18 128.15 25.96 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.943 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.04 177.3 5.21 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.887 2.391 . . . . 0.0 112.036 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 98.4 m -58.53 102.13 0.1 Allowed 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.48 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.3 p -153.56 140.91 19.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.609 -179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 25.2 m -71.17 127.58 33.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 6' ' ' ALA . 23.8 mmt180 -132.71 164.67 42.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 72.6 Cg_exo -46.47 139.96 12.37 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.139 1.893 . . . . 0.0 111.532 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -76.96 103.21 6.77 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.92 45.09 2.13 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.777 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.8 p90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.437 -179.505 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.486 ' HB3' ' HE2' ' A' ' 1' ' ' LYS . 28.0 mtpt . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.621 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.9 p -160.82 149.71 16.66 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.296 0.569 . . . . 0.0 110.527 178.166 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 98.3 mt -85.53 136.11 33.55 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.332 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.38 -171.5 2.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.025 0.44 . . . . 0.0 111.609 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.474 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 10.9 pt-20 -74.32 137.56 42.94 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.347 0.594 . . . . 0.0 111.272 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 62.69 38.39 12.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.741 -178.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.78 139.39 44.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.311 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -60.73 149.59 35.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.928 0.394 . . . . 0.0 110.775 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.0 p -153.25 -170.63 3.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.125 0.488 . . . . 0.0 111.093 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.7 m -154.57 144.35 15.44 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.377 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.77 -36.65 91.26 Favored 'Trans proline' 0 CA--C 1.53 0.308 0 C-N-CA 123.547 2.832 . . . . 0.0 113.732 -178.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 9.3 m-90 -128.41 -54.28 1.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.023 0.439 . . . . 0.0 111.579 -179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 t -80.17 61.59 4.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.622 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -167.88 150.55 16.82 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.232 -0.985 . . . . 0.0 112.788 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.06 156.64 24.26 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.814 0.34 . . . . 0.0 110.429 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.621 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 4.5 m -78.2 143.22 37.36 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 4.9 m -76.82 141.34 40.73 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.349 -178.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 55.5 m -60.65 146.82 44.13 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 24.1 mmmt -83.31 150.98 61.82 Favored Pre-proline 0 C--N 1.31 -1.114 0 C-N-CA 120.13 -0.628 . . . . 0.0 109.81 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.409 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 96.1 Cg_endo -95.45 40.06 4.57 Favored 'Cis proline' 0 N--CA 1.45 -1.039 0 C-N-CA 123.205 -1.581 . . . . 0.0 114.085 1.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.474 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 29.6 m-85 -84.36 163.36 19.61 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 121.983 -0.448 . . . . 0.0 110.533 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 48.1 tp -138.37 141.55 39.65 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.502 -178.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 46.7 t -74.12 84.59 1.83 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.668 0.747 . . . . 0.0 110.118 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.649 ' OG ' ' HG3' ' A' ' 34' ' ' ARG . 33.4 p -81.15 136.82 35.93 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.318 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.9 t -136.84 69.29 1.41 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.28 0.562 . . . . 0.0 109.77 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.807 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -84.61 -172.4 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.243 -179.744 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -74.52 -51.83 13.62 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.344 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -73.42 -23.08 60.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.763 -178.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.589 ' HB2' HD11 ' A' ' 26' ' ' ILE . 87.3 m-85 -130.67 120.2 18.56 Favored Pre-proline 0 C--N 1.324 -0.532 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.399 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.73 175.02 3.2 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.988 2.458 . . . . 0.0 112.541 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 84.3 m -51.89 106.75 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.275 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.6 p -155.16 137.12 14.57 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.032 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 14.3 m -74.01 128.71 36.23 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 179.478 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.649 ' HG3' ' OG ' ' A' ' 24' ' ' SER . 5.8 mtp180 -142.73 163.87 35.92 Favored Pre-proline 0 C--N 1.318 -0.768 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.436 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 82.8 Cg_exo -46.59 141.57 10.85 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.502 2.135 . . . . 0.0 111.936 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.405 ' HE3' ' HB3' ' A' ' 36' ' ' LYS . 8.6 ttpp -77.05 106.41 8.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.984 0.421 . . . . 0.0 109.905 -179.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.21 46.16 2.88 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.8 p90 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.386 -0.816 . . . . 0.0 110.59 -179.491 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.548 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 9.1 mtpm? . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p -160.83 156.61 25.39 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.357 0.41 . . . . 0.0 110.194 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.501 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 88.3 mt -79.95 130.11 35.02 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.3 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.27 -158.38 0.15 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.357 0.599 . . . . 0.0 111.962 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.615 ' HG3' ' CE2' ' A' ' 21' ' ' TYR . 15.0 mp0 -69.97 132.82 46.53 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.209 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 58.91 45.22 15.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.367 179.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.462 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -113.76 124.75 53.0 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.656 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.6 p30 -57.84 140.78 51.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.771 0.32 . . . . 0.0 110.711 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 17.4 p -114.32 -173.42 2.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.61 0.719 . . . . 0.0 112.022 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.517 ' HB2' ' HA3' ' A' ' 14' ' ' GLY . 75.3 m -153.88 143.67 15.3 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.471 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.64 -39.5 87.46 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.249 2.632 . . . . 0.0 113.641 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -137.17 -53.22 0.68 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.875 0.369 . . . . 0.0 111.278 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m -76.7 56.06 1.12 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.95 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.517 ' HA3' ' HB2' ' A' ' 10' ' ' SER . . . -173.56 148.29 10.1 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.508 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.548 ' OD2' ' HB3' ' A' ' 1' ' ' LYS . 69.1 m-20 -62.61 151.47 37.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.014 0.435 . . . . 0.0 110.946 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.3 m -79.69 151.47 30.46 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.501 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 60.5 m -64.19 141.27 58.83 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 121.272 -0.171 . . . . 0.0 110.656 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.1 m -64.87 146.5 54.82 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.8 ptmt -78.62 142.27 61.49 Favored Pre-proline 0 C--N 1.309 -1.17 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.879 -178.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.506 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 87.7 Cg_endo -101.97 35.11 6.82 Favored 'Cis proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.95 -1.271 . . . . 0.0 113.55 0.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.615 ' CE2' ' HG3' ' A' ' 5' ' ' GLU . 40.4 m-85 -69.62 155.09 41.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.218 0.532 . . . . 0.0 111.041 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.8 tp -131.64 136.17 47.52 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.716 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 16.4 t -74.03 125.1 27.54 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.7 p -126.34 133.21 51.42 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.051 0.453 . . . . 0.0 110.677 -178.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.7 m -99.54 72.66 1.79 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.352 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.806 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -79.89 -175.39 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.032 0.444 . . . . 0.0 111.16 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -82.05 -48.79 10.97 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.787 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -65.74 -26.09 67.57 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.579 -178.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.423 ' H ' HG12 ' A' ' 26' ' ' ILE . 96.4 m-85 -143.61 136.81 13.94 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.296 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.72 -175.89 0.39 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.487 2.125 . . . . 0.0 111.787 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 62.9 m -52.65 105.6 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.073 0.463 . . . . 0.0 110.996 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 6.0 p -148.81 141.84 24.86 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.053 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.7 m -64.23 126.61 28.32 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.123 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.576 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 23.5 mmt180 -129.5 165.01 35.85 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.576 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 9.4 Cg_endo -56.65 154.32 31.66 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 121.687 1.591 . . . . 0.0 111.66 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 19.1 tptm -77.61 114.62 16.63 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.66 46.47 7.27 Favored Glycine 0 N--CA 1.448 -0.54 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 -177.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.8 p90 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.652 -179.147 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.8 pptp? . . . . . 0 N--CA 1.483 1.181 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.1 p -126.69 155.68 42.27 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.023 0.44 . . . . 0.0 110.443 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.3 mt -86.41 123.77 32.01 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.763 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.32 -164.95 0.61 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.987 0.422 . . . . 0.0 111.236 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.422 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 7.1 pt-20 -74.03 131.97 41.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.393 0.616 . . . . 0.0 110.941 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 70.35 35.52 2.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.156 -1.384 . . . . 0.0 110.242 -177.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.419 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -105.57 131.59 52.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.93 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -62.34 131.64 49.97 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.283 0.364 . . . . 0.0 110.306 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.42 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 8.6 m -88.41 155.13 19.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.316 0.579 . . . . 0.0 110.858 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.2 m -79.55 128.14 75.93 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.856 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.29 -57.04 1.02 Allowed 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 123.258 2.639 . . . . 0.0 113.998 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.9 m-90 -89.97 -56.01 3.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.866 0.365 . . . . 0.0 111.554 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 m -159.69 146.16 16.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.976 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 178.17 -147.01 7.77 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.876 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -79.61 141.47 36.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.941 0.4 . . . . 0.0 110.842 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.8 m -83.89 154.37 23.46 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.899 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.447 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.7 m -66.45 141.68 57.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.578 0.228 . . . . 0.0 111.015 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.4 m -66.4 145.4 55.73 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 177.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.433 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 25.3 pttm -78.87 141.01 58.69 Favored Pre-proline 0 C--N 1.31 -1.144 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.254 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.475 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 73.9 Cg_endo -103.82 37.55 4.75 Favored 'Cis proline' 0 N--CA 1.451 -0.973 0 C-N-CA 123.916 -1.285 . . . . 0.0 113.919 1.307 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.747 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 50.5 m-85 -70.54 158.87 35.34 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.964 0.412 . . . . 0.0 110.499 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.7 tp -133.33 135.12 44.59 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.148 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.626 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.6 t -72.16 129.11 37.69 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.0 p -135.98 127.65 29.0 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.644 -178.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 14.8 m -100.08 72.93 1.69 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.528 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.811 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -82.11 -170.91 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.112 0.482 . . . . 0.0 111.141 -179.934 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -85.55 -48.97 8.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.621 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -65.79 -25.27 67.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.406 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.461 ' HB2' HD11 ' A' ' 26' ' ' ILE . 83.5 m-85 -141.42 138.22 17.32 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 17.1 Cg_exo -66.23 -165.12 0.09 OUTLIER 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.394 2.063 . . . . 0.0 111.595 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 80.0 m -62.43 99.17 0.13 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.906 0.384 . . . . 0.0 110.142 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.408 ' OG ' ' HD3' ' A' ' 34' ' ' ARG . 3.2 p -135.98 142.06 44.48 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.394 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.626 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 22.3 m -73.66 118.49 16.68 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 177.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.408 ' HD3' ' OG ' ' A' ' 32' ' ' SER . 18.8 mmm-85 -122.86 160.14 50.51 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.747 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 51.2 Cg_exo -50.93 148.26 17.19 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.072 1.848 . . . . 0.0 111.198 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.475 ' HE3' ' O ' ' A' ' 20' ' ' PRO . 37.1 ttmt -76.94 116.43 17.6 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.34 45.55 5.83 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -177.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 15.5 p90 . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.731 -179.131 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.0 p -160.65 161.68 32.47 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.365 0.416 . . . . 0.0 110.394 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.478 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 81.9 mt -79.3 134.39 36.62 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.356 -179.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.41 -166.04 0.79 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.309 0.576 . . . . 0.0 112.011 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.404 ' OE2' ' HG3' ' A' ' 35' ' ' PRO . 42.6 tt0 -71.1 134.3 46.91 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.762 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.09 42.5 12.37 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.666 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.16 136.31 48.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.201 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.401 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.1 p30 -58.58 147.41 32.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.88 0.372 . . . . 0.0 111.149 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.7 p -146.07 159.08 43.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.389 0.614 . . . . 0.0 111.682 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 71.6 m -157.42 146.16 14.61 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.468 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.31 -42.98 57.11 Favored 'Trans proline' 0 CA--C 1.529 0.236 0 C-N-CA 123.606 2.871 . . . . 0.0 113.229 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -111.28 -50.85 2.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.131 0.491 . . . . 0.0 110.683 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.0 t -85.9 52.66 2.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.893 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -169.5 145.65 9.5 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.117 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -82.25 -177.84 6.8 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -85.23 141.7 29.94 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.573 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 56.3 m -73.09 141.38 47.56 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.476 0.179 . . . . 0.0 110.551 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.5 m -66.5 140.41 58.0 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 177.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.669 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.8 OUTLIER -78.54 148.53 73.57 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -179.575 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.468 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.5 Cg_endo -98.08 38.67 5.46 Favored 'Cis proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.182 -1.591 . . . . 0.0 113.924 1.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -81.91 147.89 29.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.027 0.441 . . . . 0.0 110.502 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 54.1 tp -118.75 140.97 49.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.245 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.573 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 40.9 t -72.61 104.11 3.78 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 76.8 p -98.4 139.62 33.88 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.449 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.0 t -140.3 63.25 1.48 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.378 0.609 . . . . 0.0 109.489 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.793 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -85.01 -167.05 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.26 -179.678 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -69.52 -59.29 3.07 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -71.41 -35.4 70.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.683 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.711 ' HB2' HD11 ' A' ' 26' ' ' ILE . 15.5 m-85 -109.4 123.57 36.27 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.831 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -71.35 172.89 13.24 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 122.741 2.294 . . . . 0.0 111.414 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.2 m -51.31 103.16 0.05 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.991 0.424 . . . . 0.0 111.148 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.7 p -160.13 137.08 9.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.644 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.9 m -67.01 127.54 32.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.719 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -134.26 162.16 59.38 Favored Pre-proline 0 C--N 1.324 -0.534 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.404 ' HG3' ' OE2' ' A' ' 5' ' ' GLU . 49.9 Cg_exo -50.9 147.92 17.8 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.116 1.877 . . . . 0.0 111.58 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 35.4 ttpt -77.16 113.97 15.47 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.66 46.76 4.48 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 28.7 p90 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.559 -179.381 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.7 mtmm . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.526 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.1 p -150.45 149.54 30.14 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.191 0.519 . . . . 0.0 110.302 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.553 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 80.0 mt -79.89 135.08 36.35 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.386 -178.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.15 -168.62 1.34 Allowed 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.482 ' OE2' ' HG3' ' A' ' 35' ' ' PRO . 40.0 tt0 -70.61 135.01 48.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.007 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.11 43.26 11.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.726 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.54 127.24 53.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.741 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.451 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 5.6 t70 -57.01 132.72 53.73 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.553 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 30.4 p -94.47 170.21 9.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.832 0.825 . . . . 0.0 112.509 -178.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.9 p -78.89 120.27 80.25 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.952 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.471 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 38.0 Cg_endo -66.95 -46.08 3.56 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 122.948 2.432 . . . . 0.0 112.903 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.471 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 11.1 m-90 -91.36 -53.97 4.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.707 0.289 . . . . 0.0 111.268 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.3 t -173.21 148.57 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.233 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.7 -153.25 22.84 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.298 -0.721 . . . . 0.0 111.298 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -74.34 138.49 43.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.126 0.488 . . . . 0.0 110.368 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.526 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.8 m -83.14 156.46 23.25 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.353 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.502 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 31.1 m -63.84 143.94 57.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.81 -0.177 . . . . 0.0 110.695 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.0 m -63.4 145.21 56.07 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt -78.47 145.4 67.68 Favored Pre-proline 0 C--N 1.312 -1.043 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.314 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.696 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 90.0 Cg_endo -99.67 28.6 14.38 Favored 'Cis proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.023 -1.657 . . . . 0.0 113.583 1.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -64.85 153.0 41.45 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.312 0.577 . . . . 0.0 111.57 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 44.7 tp -131.68 140.74 49.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.187 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.66 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 16.6 t -75.3 120.51 20.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.998 0.428 . . . . 0.0 110.028 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.4 p -110.72 126.8 54.94 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.412 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 58.7 m -101.79 68.97 1.18 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.411 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.847 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -80.96 -172.97 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.998 0.428 . . . . 0.0 111.289 -179.962 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -86.17 -49.22 7.9 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.944 -178.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -66.14 -25.28 66.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.618 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.464 ' HB2' HD11 ' A' ' 26' ' ' ILE . 88.5 m-85 -139.11 138.23 20.62 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.935 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.15 -174.59 0.33 Allowed 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.448 2.099 . . . . 0.0 111.857 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 79.6 m -59.38 99.91 0.07 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.109 0.481 . . . . 0.0 110.503 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.451 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 3.9 p -139.1 138.51 37.12 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.202 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.66 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -65.48 127.44 31.84 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.649 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.462 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 25.6 mmt180 -130.37 164.77 38.83 Favored Pre-proline 0 C--N 1.324 -0.542 0 O-C-N 124.622 1.201 . . . . 0.0 107.88 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.482 ' HG3' ' OE2' ' A' ' 5' ' ' GLU . 32.4 Cg_exo -51.03 153.7 8.51 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.316 2.01 . . . . 0.0 112.02 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.696 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 40.3 tttp -77.65 114.52 16.58 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.0 47.84 5.39 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -177.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.3 p90 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.709 -179.335 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.551 ' HE2' ' OD2' ' A' ' 15' ' ' ASP . 9.2 mmmm . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.5 p -161.92 153.57 18.75 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.052 0.453 . . . . 0.0 110.827 178.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.9 mt -80.99 134.67 35.73 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.891 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.48 -168.56 1.39 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.143 0.497 . . . . 0.0 111.665 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.627 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 9.3 pt-20 -73.13 135.56 44.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.551 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.534 ' HA ' ' HD2' ' A' ' 34' ' ' ARG . . . 62.92 44.56 6.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.906 -178.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -119.51 127.76 53.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.535 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -52.86 135.26 36.38 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.5 p -111.93 -176.38 2.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 122.093 0.949 . . . . 0.0 113.059 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.433 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 58.6 m -157.85 144.49 13.07 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 114.544 -1.207 . . . . 0.0 109.366 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.508 ' HB2' ' CE3' ' A' ' 12' ' ' TRP . 24.1 Cg_exo -62.52 -43.88 20.21 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.799 2.333 . . . . 0.0 112.725 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.508 ' CE3' ' HB2' ' A' ' 11' ' ' PRO . 11.5 m-90 -136.53 -34.2 0.77 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.768 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 p -77.77 44.79 0.47 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.41 160.49 20.08 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.18 -1.009 . . . . 0.0 112.648 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.551 ' OD2' ' HE2' ' A' ' 1' ' ' LYS . 64.7 m-20 -60.96 153.1 25.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.922 0.391 . . . . 0.0 110.827 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.429 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.6 m -79.49 149.82 31.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 55.9 m -61.75 140.61 58.2 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.407 0.146 . . . . 0.0 111.219 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.7 m -64.81 144.35 57.31 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.8 pttp -78.14 142.27 63.67 Favored Pre-proline 0 C--N 1.312 -1.045 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.643 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.509 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 76.8 Cg_endo -102.74 38.22 4.82 Favored 'Cis proline' 0 N--CA 1.455 -0.774 0 C-N-CA 123.948 -1.271 . . . . 0.0 113.901 1.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.627 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 38.0 m-85 -74.0 143.67 45.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.352 0.596 . . . . 0.0 110.824 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.1 tp -115.04 138.66 50.61 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.008 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.682 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.8 t -73.23 103.41 3.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.581 0.705 . . . . 0.0 110.53 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 52.3 p -80.38 132.6 35.79 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.87 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.2 t -143.25 53.92 1.35 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.454 0.645 . . . . 0.0 109.384 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.636 HG12 ' HB2' ' A' ' 29' ' ' TYR . 28.7 pt -85.79 -165.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.622 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.48 -56.48 15.75 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -79.83 -31.9 40.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.98 0.419 . . . . 0.0 112.117 -178.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.636 ' HB2' HG12 ' A' ' 26' ' ' ILE . 3.1 m-85 -102.66 111.06 64.44 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.613 -179.07 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -65.86 162.57 34.37 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.766 2.311 . . . . 0.0 110.425 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 27.8 m -48.64 97.93 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.119 0.485 . . . . 0.0 111.924 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 p -153.92 139.01 17.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.539 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.682 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -65.68 120.37 12.85 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.534 ' HD2' ' HA ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -123.58 158.06 60.33 Favored Pre-proline 0 C--N 1.321 -0.636 0 O-C-N 124.624 1.203 . . . . 0.0 107.877 179.923 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.446 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 50.2 Cg_exo -53.38 154.57 14.56 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.216 1.944 . . . . 0.0 111.644 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 1.6 tmtp? -77.09 108.49 10.2 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.01 46.47 3.35 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.6 p90 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.385 -0.816 . . . . 0.0 110.672 -179.355 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.633 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 7.4 p -160.87 158.15 27.82 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 123.84 0.713 . . . . 0.0 109.306 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 70.8 mt -79.61 119.33 22.41 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.251 -0.432 . . . . 0.0 109.958 -179.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.31 -163.41 0.44 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.034 0.445 . . . . 0.0 111.575 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.407 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 6.9 pt-20 -72.28 134.08 45.37 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.335 0.588 . . . . 0.0 110.936 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 68.71 37.53 2.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.416 -177.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -107.19 128.74 54.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.078 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -58.93 133.72 56.31 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.325 0.391 . . . . 0.0 111.104 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 m -93.8 153.46 18.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.317 0.58 . . . . 0.0 110.453 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.4 m -79.52 129.89 70.06 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.916 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.406 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 19.3 Cg_endo -59.8 -57.31 0.86 Allowed 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 123.277 2.651 . . . . 0.0 113.968 -178.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.406 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 19.8 m-90 -82.12 -50.61 8.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.827 0.346 . . . . 0.0 111.296 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.1 t -175.22 150.21 1.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.01 -144.55 5.16 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.948 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.633 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 0.1 OUTLIER -79.13 157.93 27.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.265 0.555 . . . . 0.0 111.671 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.6 m -93.22 150.61 20.37 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.199 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.443 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.1 m -71.27 144.09 50.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.097 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.9 m -64.68 147.92 52.05 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.3 137.8 60.1 Favored Pre-proline 0 C--N 1.314 -0.972 0 CA-C-O 120.796 0.332 . . . . 0.0 110.941 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.631 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 69.1 Cg_endo -104.89 37.09 4.59 Favored 'Cis proline' 0 N--CA 1.454 -0.843 0 C-N-CA 124.346 -1.106 . . . . 0.0 113.72 0.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.657 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 41.7 m-85 -71.14 143.19 50.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.223 0.535 . . . . 0.0 110.649 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 tp -117.26 139.65 50.54 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.795 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.685 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.1 t -74.08 116.09 14.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.038 0.447 . . . . 0.0 109.798 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 84.2 p -107.95 143.47 36.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.656 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -143.3 58.43 1.4 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.481 HG13 ' H ' ' A' ' 29' ' ' TYR . 38.0 pt -84.55 -162.73 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.341 -179.219 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -67.38 -62.66 1.31 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.709 -178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -72.71 -41.76 64.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.607 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.481 ' H ' HG13 ' A' ' 26' ' ' ILE . 3.2 m-85 -95.99 120.87 62.21 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.747 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.69 172.46 15.74 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.562 2.175 . . . . 0.0 110.98 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.9 m -52.32 99.25 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.0 0.429 . . . . 0.0 111.196 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.8 p -160.07 143.49 13.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.739 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.685 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.0 m -69.43 132.04 45.72 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -133.93 161.49 63.42 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.657 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 50.9 Cg_exo -51.39 153.19 10.52 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.434 2.09 . . . . 0.0 111.918 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.631 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 59.4 tttm -77.32 103.56 7.33 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.74 46.71 2.64 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 -177.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.6 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.819 -179.198 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.5 p -160.14 154.78 24.05 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.002 0.429 . . . . 0.0 110.15 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 85.8 mt -79.85 132.82 36.19 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.077 -179.036 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.16 -179.55 6.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.697 0.284 . . . . 0.0 110.675 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.429 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 11.5 pt-20 -70.79 141.53 51.39 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.29 0.567 . . . . 0.0 110.807 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 66.45 45.43 2.14 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.389 -177.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -132.09 124.23 28.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.898 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.617 ' OD1' ' HB3' ' A' ' 32' ' ' SER . 36.0 m-20 -56.97 131.09 48.75 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 123.418 0.449 . . . . 0.0 110.835 -179.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.509 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 31.8 p -91.08 169.62 10.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.641 0.734 . . . . 0.0 112.072 -178.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.5 m -81.77 125.05 78.93 Favored Pre-proline 0 C--N 1.319 -0.724 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.276 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.455 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 38.8 Cg_endo -67.61 -51.96 0.63 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.86 2.373 . . . . 0.0 113.575 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.455 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 14.7 m-90 -82.06 -52.38 7.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.712 0.291 . . . . 0.0 111.334 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.3 t -174.18 148.14 1.29 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.117 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 169.34 -151.78 18.26 Favored Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -72.28 141.94 48.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.387 0.613 . . . . 0.0 110.462 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.0 m -85.65 154.51 21.63 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.842 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 33.4 m -67.79 139.37 56.62 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.7 m -61.69 147.52 45.75 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.726 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -78.77 144.7 65.0 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.135 -179.965 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 87.0 Cg_endo -101.66 34.95 7.05 Favored 'Cis proline' 0 N--CA 1.45 -1.037 0 C-N-CA 123.438 -1.484 . . . . 0.0 113.507 1.22 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.52 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 43.0 m-85 -73.35 174.96 7.37 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.112 0.482 . . . . 0.0 111.339 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.589 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 49.6 tp -152.7 142.44 21.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.136 -178.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.675 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 18.0 t -75.85 112.03 11.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.349 0.595 . . . . 0.0 110.608 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.4 p -101.68 137.4 40.04 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.01 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.9 t -129.91 71.79 1.46 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.29 0.567 . . . . 0.0 109.906 -179.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.743 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -90.42 -167.98 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.93 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -75.91 -52.92 9.26 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.245 -178.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -70.8 -25.83 63.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.177 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HB2' HD11 ' A' ' 26' ' ' ILE . 32.4 m-85 -128.94 128.34 23.41 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.633 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.92 179.23 2.86 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.756 2.304 . . . . 0.0 111.757 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 87.3 m -57.61 95.52 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.157 0 O-C-N 123.301 0.375 . . . . 0.0 110.492 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.617 ' HB3' ' OD1' ' A' ' 8' ' ' ASP . 8.7 p -144.57 142.21 30.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.193 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.675 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -70.78 129.67 39.71 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.236 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -139.05 163.9 42.94 Favored Pre-proline 0 C--N 1.318 -0.796 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.52 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 52.6 Cg_exo -49.67 141.73 26.39 Favored 'Trans proline' 0 N--CA 1.464 -0.234 0 C-N-CA 121.99 1.793 . . . . 0.0 111.122 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.589 ' HE2' ' HB2' ' A' ' 22' ' ' LEU . 30.3 ttmt -77.94 123.56 26.93 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.75 43.51 6.79 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -178.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 15.8 p90 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.41 -0.805 . . . . 0.0 110.46 -179.484 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.3 p -159.3 151.24 20.73 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.463 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.492 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 87.4 mt -86.46 121.59 29.22 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.725 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.79 -162.18 0.35 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.256 0.55 . . . . 0.0 112.216 -178.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.468 ' H ' ' CD ' ' A' ' 5' ' ' GLU . 8.4 pm0 -64.06 125.71 25.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.792 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.74 45.45 5.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.277 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.469 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -111.38 117.75 33.95 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.785 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.551 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 1.2 m-20 -56.68 131.66 49.68 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.379 0.609 . . . . 0.0 111.614 -179.036 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.434 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 2.7 m -83.1 154.92 24.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.439 -178.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.2 m -79.1 130.56 69.15 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.907 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.45 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 29.2 Cg_endo -63.83 -55.29 0.69 Allowed 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.021 2.481 . . . . 0.0 113.78 -178.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.45 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.0 m-90 -80.26 -52.24 7.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.727 0.299 . . . . 0.0 111.32 -179.023 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.9 p -174.09 149.35 1.44 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.474 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.09 -151.43 10.24 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -79.61 147.35 32.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.295 0.569 . . . . 0.0 111.067 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.1 m -83.71 156.53 22.55 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.122 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.456 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 45.6 m -64.22 141.01 58.92 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.426 0.155 . . . . 0.0 110.834 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.2 m -63.74 148.19 49.78 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.743 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.02 141.89 59.16 Favored Pre-proline 0 C--N 1.312 -1.058 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.196 -179.888 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -104.64 40.98 3.13 Favored 'Cis proline' 0 N--CA 1.448 -1.179 0 C-N-CA 123.752 -1.353 . . . . 0.0 113.641 1.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.463 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 59.8 m-85 -72.41 179.48 3.44 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.317 0.579 . . . . 0.0 111.417 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.603 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 59.7 tp -151.95 138.92 19.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.783 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.592 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.1 t -71.84 111.76 7.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.822 0.344 . . . . 0.0 111.132 -179.415 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.739 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 72.2 p -84.91 108.0 17.34 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.9 t -118.99 59.04 0.84 Allowed 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.108 -177.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.611 HG13 ' HB2' ' A' ' 29' ' ' TYR . 10.3 pt -90.22 -171.07 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.983 0.42 . . . . 0.0 111.332 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -67.01 -81.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -177.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.543 ' HD1' ' HD1' ' A' ' 29' ' ' TYR . 0.3 OUTLIER -79.86 36.06 0.32 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -177.032 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.611 ' HB2' HG13 ' A' ' 26' ' ' ILE . 11.3 m-85 -148.67 131.52 7.99 Favored Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 177.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -60.98 131.21 35.92 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.553 2.169 . . . . 0.0 111.0 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.739 ' HA ' ' O ' ' A' ' 24' ' ' SER . 69.8 m -61.99 100.56 0.16 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.446 0.641 . . . . 0.0 111.015 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.551 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 5.2 p -145.02 148.25 33.52 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.389 -178.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.592 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 14.9 m -67.54 128.84 37.95 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 120.933 0.397 . . . . 0.0 110.242 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.61 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 26.0 mmt85 -132.48 168.07 19.53 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.884 -1.524 . . . . 0.0 106.884 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.61 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 10.0 Cg_endo -55.02 151.15 35.27 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 121.429 1.419 . . . . 0.0 110.48 179.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.603 ' HE2' ' HB2' ' A' ' 22' ' ' LEU . 20.2 ttmt -77.41 118.21 19.65 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.323 -178.23 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.74 47.01 1.55 Allowed Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.5 -178.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 C--O 1.253 1.243 0 CA-C-O 117.853 -1.07 . . . . 0.0 110.072 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.4 tptp . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p -161.96 159.27 26.35 Favored 'General case' 0 C--N 1.322 -0.628 0 O-C-N 123.596 0.56 . . . . 0.0 109.988 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.452 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.1 mt -80.03 133.09 36.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.351 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.41 -168.09 1.25 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.202 0.525 . . . . 0.0 112.031 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.51 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 6.4 pt-20 -72.96 132.52 43.54 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.106 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.67 38.74 9.2 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.535 -1.212 . . . . 0.0 110.411 -178.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.86 133.58 52.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.396 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -58.68 145.39 40.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.261 0.553 . . . . 0.0 111.473 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.22 142.72 50.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.826 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.5 m -79.8 128.45 74.24 Favored Pre-proline 0 C--N 1.318 -0.79 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.489 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.5 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 51.8 Cg_endo -67.87 -43.31 5.29 Favored 'Trans proline' 0 N--CA 1.474 0.334 0 C-N-CA 123.434 2.756 . . . . 0.0 113.925 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.5 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 19.4 m-90 -78.99 -44.82 21.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.611 0.243 . . . . 0.0 111.453 -178.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.2 t -175.47 139.09 0.42 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.303 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.71 -147.83 7.01 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -81.29 152.02 27.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.93 0.395 . . . . 0.0 110.24 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 m -85.49 144.3 28.03 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 54.3 m -72.16 140.58 48.87 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.0 m -64.13 142.39 58.43 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.697 ' HD2' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.64 143.83 63.9 Favored Pre-proline 0 C--N 1.311 -1.101 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.12 -179.555 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -101.0 44.53 2.81 Favored 'Cis proline' 0 N--CA 1.455 -0.768 0 C-N-CA 124.069 -1.221 . . . . 0.0 113.858 1.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.51 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 40.3 m-85 -87.5 147.0 25.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.154 0.502 . . . . 0.0 110.634 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 56.7 tp -121.61 143.66 49.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.759 -179.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 41.9 t -68.02 114.23 6.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.926 0.393 . . . . 0.0 109.951 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.567 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 97.4 p -96.51 126.68 41.87 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.122 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 77.5 m -122.52 59.19 1.04 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.004 0.43 . . . . 0.0 110.407 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.771 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -84.72 -174.85 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.986 0.422 . . . . 0.0 111.055 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -81.16 -47.98 12.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.53 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -64.97 -25.37 67.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.646 -178.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.481 ' H ' HG12 ' A' ' 26' ' ' ILE . 96.9 m-85 -141.75 128.93 11.52 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.562 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.03 173.65 5.72 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.869 2.379 . . . . 0.0 112.229 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.567 ' HA ' ' O ' ' A' ' 24' ' ' SER . 92.6 m -50.33 108.55 0.23 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.522 0.677 . . . . 0.0 111.768 -179.383 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.4 p -152.46 131.32 12.48 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.969 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.9 m -65.32 128.19 34.85 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.423 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 81.0 mtt-85 -138.16 162.85 51.48 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.423 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 51.5 Cg_exo -48.69 144.1 15.22 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.244 1.962 . . . . 0.0 111.483 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -77.16 119.8 21.36 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.166 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.59 44.68 6.05 Favored Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 110.784 -0.926 . . . . 0.0 110.784 -178.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.8 p90 . . . . . 0 C--O 1.252 1.199 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.421 -179.625 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.509 ' HG2' ' N ' ' A' ' 2' ' ' CYS . 19.8 ttpp . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.68 ' HA ' ' O ' ' A' ' 16' ' ' SER . 18.4 p -113.63 157.94 21.49 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.504 178.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 93.0 mt -99.71 130.15 45.9 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.773 -178.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.01 -165.88 0.72 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.095 0.474 . . . . 0.0 111.719 -179.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.603 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 13.2 pt-20 -71.35 131.65 43.71 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.054 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 65.4 38.9 5.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.553 -178.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.436 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -106.13 126.9 52.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.457 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -51.72 136.75 26.85 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.415 0.447 . . . . 0.0 111.021 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 32' ' ' SER . 1.4 p -129.59 142.54 50.72 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.909 0.861 . . . . 0.0 112.213 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.2 m -79.9 130.49 66.74 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 114.293 -1.322 . . . . 0.0 110.336 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.488 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 58.8 Cg_endo -69.54 -43.58 2.75 Favored 'Trans proline' 0 N--CA 1.474 0.333 0 C-N-CA 123.386 2.724 . . . . 0.0 113.981 -178.572 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.488 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.3 m-90 -79.07 -45.53 19.93 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.8 t -175.36 143.93 0.68 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.786 0.326 . . . . 0.0 111.106 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.61 -153.16 18.21 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.446 ' OD2' ' HB3' ' A' ' 1' ' ' LYS . 11.5 m-20 -69.8 145.81 51.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.099 0.476 . . . . 0.0 110.332 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.68 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 3.9 m -86.21 146.54 26.51 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.19 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 34.3 m -69.66 139.35 53.51 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.805 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 56.4 m -63.47 149.19 46.65 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 61.2 pttt -78.91 142.33 60.21 Favored Pre-proline 0 C--N 1.311 -1.094 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.17 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 83.0 Cg_endo -103.16 39.47 4.09 Favored 'Cis proline' 0 N--CA 1.45 -1.046 0 C-N-CA 123.991 -1.254 . . . . 0.0 113.81 1.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.603 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 57.4 m-85 -77.71 -176.37 4.33 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 121.992 -0.442 . . . . 0.0 111.202 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.6 tp -159.21 139.52 12.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.3 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.9 t -69.65 112.57 6.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.842 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.61 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 55.2 p -99.45 108.62 21.12 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.074 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 31' ' ' CYS . 1.8 t -103.96 58.41 0.73 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.062 -178.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.822 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -91.4 -175.41 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.18 -179.612 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -86.67 -56.65 3.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -178.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -61.47 -32.87 72.89 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.827 -178.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.75 ' HB2' HD11 ' A' ' 26' ' ' ILE . 7.8 m-85 -115.7 129.55 25.06 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.801 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.7 142.64 91.3 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.545 2.164 . . . . 0.0 111.409 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.61 ' HA ' ' O ' ' A' ' 24' ' ' SER . 72.4 m -54.84 100.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.816 0.817 . . . . 0.0 111.348 -179.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.406 ' HA ' ' SG ' ' A' ' 9' ' ' CYS . 6.4 p -153.37 149.59 27.98 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.144 -0.934 . . . . 0.0 110.254 -178.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.7 m -67.99 128.71 37.51 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.418 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 22.7 mmt180 -132.92 164.44 43.85 Favored Pre-proline 0 C--N 1.32 -0.687 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.418 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 52.7 Cg_exo -49.99 143.38 24.51 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.028 1.818 . . . . 0.0 110.795 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -77.34 115.89 17.49 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -179.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.53 44.6 3.94 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -177.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.5 p90 . . . . . 0 C--O 1.252 1.196 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.449 -179.258 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.467 ' HG3' ' N ' ' A' ' 2' ' ' CYS . 51.6 tptt . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.4 p -149.41 149.38 30.74 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.523 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 85.3 mt -79.63 137.37 37.08 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.004 -178.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.62 -166.78 0.93 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.224 0.535 . . . . 0.0 112.065 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.4 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 38.7 tt0 -72.06 134.37 45.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.906 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.11 46.07 6.63 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.508 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -122.01 122.5 39.45 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.458 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.667 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 37.4 m-20 -57.21 131.17 49.17 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.57 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.523 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 26.2 p -95.88 -173.98 3.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.455 -179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 21.1 t -160.29 138.74 7.54 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.58 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.59 -31.56 87.11 Favored 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 123.127 2.551 . . . . 0.0 113.307 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -137.54 -51.44 0.63 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.869 0.366 . . . . 0.0 111.42 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 m -79.42 50.96 1.16 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.942 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 178.41 141.12 4.16 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.657 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.99 163.83 18.99 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.121 0.486 . . . . 0.0 111.098 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.53 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 15.9 m -79.15 153.84 29.77 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.962 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 12.5 m -64.28 142.87 58.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.364 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.9 m -64.64 144.73 57.01 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 177.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.766 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -77.55 143.23 67.71 Favored Pre-proline 0 C--N 1.313 -0.992 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.892 -178.742 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.526 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 84.6 Cg_endo -102.72 35.64 6.18 Favored 'Cis proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.181 -1.591 . . . . 0.0 113.893 1.078 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -67.2 150.06 49.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.29 0.567 . . . . 0.0 111.368 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.0 tp -124.89 134.4 52.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.567 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.668 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 11.3 t -74.87 122.42 23.36 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.0 p -126.69 129.3 48.17 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.243 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.1 76.6 1.47 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.309 -179.008 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.81 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -84.9 -168.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.036 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -84.98 -50.56 7.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.915 -178.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -66.99 -26.45 66.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.513 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.528 ' HB2' HD11 ' A' ' 26' ' ' ILE . 75.6 m-85 -136.99 138.38 25.65 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.474 ' HG2' ' OD1' ' A' ' 8' ' ' ASP . 36.4 Cg_endo -67.17 -158.92 0.04 OUTLIER 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.225 1.95 . . . . 0.0 112.215 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 73.1 m -68.28 77.38 0.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.033 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.667 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 3.5 p -114.65 141.5 47.71 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.668 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 21.2 m -71.95 118.58 14.99 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 24.5 mmm-85 -121.47 162.08 38.04 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.4 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 47.7 Cg_exo -50.99 152.28 10.46 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.28 1.986 . . . . 0.0 112.121 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 21.4 tptm -77.42 108.31 10.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.75 47.51 3.94 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.063 -1.215 . . . . 0.0 110.063 -177.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.5 p90 . . . . . 0 C--O 1.252 1.195 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.897 -179.08 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.571 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 7.6 ptpp? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 16' ' ' SER . 25.7 p -118.59 150.39 39.75 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.649 178.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.503 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 82.3 mt -84.91 127.88 34.36 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.607 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.77 -163.48 0.48 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.078 0.466 . . . . 0.0 111.634 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.606 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 5.0 pt-20 -70.93 130.97 42.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.347 0.594 . . . . 0.0 111.341 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 64.52 39.96 6.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.855 -178.608 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.48 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -106.37 128.55 54.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.473 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.414 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 3.6 p30 -58.81 138.47 57.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.155 0.502 . . . . 0.0 111.406 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.4 m -97.57 151.66 19.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.125 0.488 . . . . 0.0 110.629 -179.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.1 m -79.57 128.23 75.58 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.973 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.456 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 30.3 Cg_endo -63.96 -54.82 0.78 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 123.041 2.494 . . . . 0.0 113.722 -178.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.456 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.2 m-90 -80.61 -52.55 7.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.797 0.332 . . . . 0.0 111.255 -179.192 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 t -175.86 150.01 0.98 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.67 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.69 -142.77 6.96 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.878 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.571 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 46.6 m-20 -72.13 144.67 48.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.204 0.526 . . . . 0.0 110.652 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.582 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 7.7 m -95.75 150.72 20.08 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.816 179.497 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.649 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 60.7 m -63.71 142.98 58.2 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.618 0.247 . . . . 0.0 111.625 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.5 m -68.12 143.66 55.34 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 177.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 8.7 ptpp? -78.87 141.73 59.65 Favored Pre-proline 0 C--N 1.311 -1.097 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.417 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.564 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 86.7 Cg_endo -102.91 36.48 5.62 Favored 'Cis proline' 0 N--CA 1.454 -0.827 0 C-N-CA 124.18 -1.175 . . . . 0.0 113.931 1.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.606 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 32.8 m-85 -69.53 150.05 47.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.146 0.498 . . . . 0.0 110.774 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -119.64 134.68 55.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.719 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.1 t -76.16 113.12 13.34 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.829 0.347 . . . . 0.0 111.013 179.727 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 64.8 p -84.88 102.73 13.34 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 31' ' ' CYS . 4.2 t -110.13 54.89 0.65 Allowed 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -178.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.468 HG13 ' H ' ' A' ' 29' ' ' TYR . 16.0 pt -110.2 -170.56 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.202 -179.324 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -78.36 -56.53 4.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.228 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -65.15 -33.56 76.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.168 0.508 . . . . 0.0 111.289 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.468 ' H ' HG13 ' A' ' 26' ' ' ILE . 4.3 m-85 -114.54 112.69 45.69 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.027 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -56.33 141.36 89.02 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.9 2.4 . . . . 0.0 111.4 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.689 ' HA ' ' O ' ' A' ' 24' ' ' SER . 62.8 m -50.92 96.51 0.01 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.766 0.794 . . . . 0.0 112.536 -178.394 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.414 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 7.7 p -158.2 145.04 17.7 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.772 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -67.11 125.65 26.7 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.607 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 25.0 mmt85 -123.23 166.25 19.0 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.607 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 12.2 Cg_endo -57.2 166.25 4.53 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 121.629 1.553 . . . . 0.0 111.398 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.564 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 47.7 tttp -77.83 73.91 4.39 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.959 0.885 . . . . 0.0 109.53 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.27 49.39 0.05 OUTLIER Glycine 0 N--CA 1.441 -0.998 0 CA-C-N 113.697 -1.592 . . . . 0.0 109.469 -177.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.2 p-90 . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.404 -178.846 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? . . . . . 0 N--CA 1.482 1.14 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 16' ' ' SER . 27.2 p -162.32 153.83 18.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.109 0.481 . . . . 0.0 110.778 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 89.1 mt -80.28 128.17 33.22 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.372 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.65 -166.65 0.91 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.991 0.424 . . . . 0.0 111.424 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.606 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 8.1 pt-20 -72.4 130.89 41.78 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.152 0.501 . . . . 0.0 110.791 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 69.69 34.23 2.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.428 -178.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.459 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -104.14 127.03 51.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.815 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -57.16 132.72 53.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.846 0.355 . . . . 0.0 111.31 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.09 137.03 52.55 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.499 0.666 . . . . 0.0 110.952 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.0 m -79.44 128.87 73.81 Favored Pre-proline 0 C--N 1.314 -0.945 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.475 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.516 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 56.5 Cg_endo -68.42 -41.12 6.98 Favored 'Trans proline' 0 N--CA 1.474 0.338 0 C-N-CA 123.557 2.838 . . . . 0.0 113.943 -178.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.516 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 20.8 m-90 -78.7 -43.16 26.51 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.09 -178.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 t -177.79 138.55 0.21 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.474 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.91 -153.74 10.41 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -83.01 152.34 25.45 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.402 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 13.3 m -83.54 144.76 29.29 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.016 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 12.9 m -70.9 138.16 49.9 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.8 m -61.82 146.68 48.82 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 178.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -82.75 147.79 56.09 Favored Pre-proline 0 C--N 1.311 -1.096 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.152 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.536 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 94.1 Cg_endo -97.82 32.28 10.92 Favored 'Cis proline' 0 N--CA 1.451 -0.997 0 C-N-CA 122.988 -1.672 . . . . 0.0 113.752 1.218 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.606 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 39.1 m-85 -70.6 156.54 39.3 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.199 0.523 . . . . 0.0 111.304 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 tp -131.36 140.7 49.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.316 -178.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 50.6 t -71.68 125.51 27.29 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.443 ' OG ' ' HG2' ' A' ' 34' ' ' ARG . 63.6 p -132.46 133.99 44.52 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -179.348 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -118.65 86.37 2.53 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.727 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -91.26 -168.76 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.544 -179.425 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -75.32 -64.13 1.13 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.02 -39.58 87.07 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.955 0.407 . . . . 0.0 111.367 -177.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.478 ' HB2' HD11 ' A' ' 26' ' ' ILE . 31.6 m-85 -105.77 129.79 24.07 Favored Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 16.2 Cg_exo -67.2 -167.95 0.15 Allowed 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.34 2.027 . . . . 0.0 111.596 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 90.0 m -62.86 104.61 0.56 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.0 p -144.98 137.53 26.17 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.894 0.378 . . . . 0.0 111.597 -178.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.9 m -72.53 120.59 18.35 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 177.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.443 ' HG2' ' OG ' ' A' ' 24' ' ' SER . 21.1 mmm-85 -121.45 167.2 13.96 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.559 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 72.7 Cg_exo -47.62 163.95 0.17 Allowed 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 122.726 2.284 . . . . 0.0 112.591 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.536 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 22.3 tptm -76.86 73.14 3.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.745 0.783 . . . . 0.0 109.666 -179.545 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 123.65 23.37 2.09 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.92 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.459 ' O ' ' HB2' ' A' ' 35' ' ' PRO . 1.3 m-90 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.481 -0.771 . . . . 0.0 111.471 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.507 ' HG3' ' OD2' ' A' ' 15' ' ' ASP . 26.2 tptp . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 22.7 p -161.36 159.0 27.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.15 -178.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.577 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 69.3 mt -80.11 120.57 24.43 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.45 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.43 -155.52 0.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.506 0.669 . . . . 0.0 112.693 -178.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.431 ' OE1' ' HD3' ' A' ' 35' ' ' PRO . 12.6 tp10 -65.56 128.46 36.03 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.19 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.534 ' HB2' ' NH1' ' A' ' 34' ' ' ARG . . . 59.66 43.23 15.93 Favored 'General case' 0 CA--C 1.515 -0.386 0 O-C-N 124.144 0.902 . . . . 0.0 110.615 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -102.07 129.81 48.49 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 119.897 -0.721 . . . . 0.0 111.803 -178.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -62.73 134.37 56.19 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.221 0.534 . . . . 0.0 110.537 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.4 m -92.8 152.81 19.24 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.602 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.0 m -79.11 131.93 64.88 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.999 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.421 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 24.8 Cg_endo -62.47 -55.08 1.02 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.142 2.561 . . . . 0.0 113.771 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.421 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 12.8 m-90 -88.42 -58.27 2.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.865 0.364 . . . . 0.0 111.23 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.3 m -161.62 146.36 13.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.967 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.56 -145.47 8.02 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.985 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.507 ' OD2' ' HG3' ' A' ' 1' ' ' LYS . 0.7 OUTLIER -70.0 148.13 49.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.359 0.6 . . . . 0.0 111.447 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.2 m -99.58 150.34 22.34 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.068 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.518 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 61.3 m -63.47 141.43 58.77 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.629 0.252 . . . . 0.0 111.338 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.6 m -67.38 143.65 56.21 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.18 141.88 62.98 Favored Pre-proline 0 C--N 1.31 -1.125 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.438 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.455 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 92.1 Cg_endo -102.66 44.82 2.63 Favored 'Cis proline' 0 N--CA 1.453 -0.895 0 C-N-CA 124.073 -1.219 . . . . 0.0 114.095 1.334 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -81.76 148.41 28.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.229 0.538 . . . . 0.0 110.457 179.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.0 tp -119.47 139.19 52.47 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.575 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.566 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.4 t -71.1 106.19 3.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 110.401 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -88.4 130.83 35.07 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.513 179.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.9 t -136.47 63.77 1.57 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.407 0.623 . . . . 0.0 109.331 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.79 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -81.22 -168.64 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.241 -179.53 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -66.95 -60.58 2.52 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -74.07 -36.49 64.32 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -177.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.693 ' HB2' HD11 ' A' ' 26' ' ' ILE . 23.4 m-85 -103.63 124.96 36.16 Favored Pre-proline 0 C--N 1.322 -0.621 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.079 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.82 172.45 13.65 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.817 2.345 . . . . 0.0 111.966 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 88.2 m -52.41 105.38 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 O-C-N 123.468 0.48 . . . . 0.0 111.175 -179.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 p -152.73 135.23 15.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.39 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.566 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.3 m -65.86 129.06 38.45 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.538 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.534 ' NH1' ' HB2' ' A' ' 6' ' ' ALA . 34.4 mmt180 -138.04 162.18 55.45 Favored Pre-proline 0 C--N 1.327 -0.409 0 O-C-N 125.504 1.753 . . . . 0.0 107.649 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.431 ' HD3' ' OE1' ' A' ' 5' ' ' GLU . 44.1 Cg_exo -51.96 147.6 25.63 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.261 1.974 . . . . 0.0 111.728 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 32.6 ttpt -77.64 94.16 4.35 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 112.21 43.88 0.89 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 -178.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.8 p90 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.283 -0.865 . . . . 0.0 110.483 -179.334 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 83.5 tttt . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.563 ' HA ' ' O ' ' A' ' 16' ' ' SER . 28.9 p -77.7 146.97 35.68 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.469 -0.892 . . . . 0.0 110.739 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 63.2 mt -82.3 127.18 32.96 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.89 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.16 -169.75 1.72 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.89 0.376 . . . . 0.0 111.57 -179.15 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' A' ' 5' ' ' GLU . 10.4 pt-20 -75.12 133.24 41.57 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.395 0.616 . . . . 0.0 110.8 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.432 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 69.03 33.74 3.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.157 -1.383 . . . . 0.0 110.207 -177.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -110.48 134.81 52.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.773 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -57.37 147.42 26.03 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.094 0.473 . . . . 0.0 111.538 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.7 p -137.49 149.34 46.74 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.476 0.655 . . . . 0.0 111.288 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.0 m -79.43 125.66 82.55 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.584 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.518 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 60.2 Cg_endo -70.47 -42.21 2.83 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 123.213 2.609 . . . . 0.0 113.437 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.518 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.8 m-90 -79.28 -46.5 17.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.299 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.9 t -176.59 140.67 0.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.844 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 177.69 -160.87 27.73 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -70.04 148.81 48.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.32 0.581 . . . . 0.0 110.787 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.563 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 8.0 m -82.88 149.57 27.03 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.924 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 5.0 m -74.53 145.14 43.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.22 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.25 146.41 50.97 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.7 ptmt -79.18 142.99 59.92 Favored Pre-proline 0 C--N 1.311 -1.102 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.079 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.59 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 82.1 Cg_endo -103.55 43.33 2.8 Favored 'Cis proline' 0 N--CA 1.449 -1.089 0 C-N-CA 124.089 -1.213 . . . . 0.0 113.697 1.191 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.674 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 18.4 m-85 -73.37 -164.33 0.19 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 117.957 0.344 . . . . 0.0 111.223 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 24.3 tp -168.07 133.32 1.83 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.813 -0.176 . . . . 0.0 111.247 -178.564 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.8 t -70.21 128.39 36.1 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.508 ' OG ' ' HG2' ' A' ' 34' ' ' ARG . 22.6 p -142.53 132.02 23.74 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.805 0.336 . . . . 0.0 110.623 -178.66 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.436 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.7 OUTLIER -112.05 77.77 1.07 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.519 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.782 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -89.16 -169.48 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.643 -179.289 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -84.01 -50.35 8.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.765 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -63.01 -28.92 70.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.303 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.448 ' H ' HG12 ' A' ' 26' ' ' ILE . 67.6 m-85 -140.12 134.29 15.58 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.303 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 21.9 Cg_exo -64.83 -166.99 0.09 OUTLIER 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.49 2.126 . . . . 0.0 111.828 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.436 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 93.7 m -58.32 103.72 0.17 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.999 0.428 . . . . 0.0 110.082 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.6 p -151.2 141.01 21.88 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.027 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 18.8 m -74.97 123.06 24.46 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 177.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.508 ' HG2' ' OG ' ' A' ' 24' ' ' SER . 21.1 mmm-85 -119.04 162.0 33.69 Favored Pre-proline 0 C--N 1.316 -0.869 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.674 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 32.7 Cg_exo -53.35 157.52 8.92 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.37 2.046 . . . . 0.0 111.589 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 1.3 tppp? -77.72 113.68 15.83 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.46 48.72 5.49 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 -177.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.1 p90 . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.862 -179.074 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.5 p -160.52 159.14 30.36 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 123.443 0.464 . . . . 0.0 109.956 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 92.4 mt -79.63 132.13 36.17 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.745 -179.32 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.43 -166.37 0.84 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.081 0.467 . . . . 0.0 111.786 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.572 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 12.3 pt-20 -73.1 132.06 42.83 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.15 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.99 36.85 9.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.48 -178.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -100.78 137.22 39.46 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.791 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -56.59 142.14 40.62 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.969 0.414 . . . . 0.0 111.553 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 22.2 p -153.03 171.77 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.3 0.572 . . . . 0.0 111.37 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.537 ' HB2' ' O ' ' A' ' 13' ' ' SER . 66.9 m -156.51 123.79 2.71 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.507 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 32.3 Cg_exo -63.82 -29.26 68.01 Favored 'Trans proline' 0 N--CA 1.474 0.38 0 C-N-CA 123.493 2.795 . . . . 0.0 113.399 -178.473 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.9 m-90 -78.85 -19.62 51.58 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.003 -179.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.537 ' O ' ' HB2' ' A' ' 10' ' ' SER . 9.4 t -178.17 126.29 0.12 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.372 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 159.32 164.61 14.89 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.92 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.88 158.01 29.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.062 0.458 . . . . 0.0 110.63 179.508 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.1 m -79.62 141.98 36.02 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.668 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.576 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 19.8 m -74.17 141.68 45.5 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.9 m -64.36 146.02 55.11 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 60.9 pttt -78.44 141.62 61.44 Favored Pre-proline 0 C--N 1.311 -1.09 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.571 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 79.6 Cg_endo -103.49 37.25 5.0 Favored 'Cis proline' 0 N--CA 1.453 -0.902 0 C-N-CA 123.906 -1.289 . . . . 0.0 113.779 1.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.944 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 58.2 m-85 -69.39 159.51 33.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.902 0.382 . . . . 0.0 110.773 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.584 HD23 ' HE1' ' A' ' 38' ' ' TRP . 36.8 tp -132.85 130.19 39.44 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.6 t -69.79 124.98 25.39 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.399 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.3 p -148.31 145.27 28.08 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.745 0.307 . . . . 0.0 110.845 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.427 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -113.17 65.78 0.65 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.873 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.887 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -82.28 -170.2 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.349 -178.762 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -83.16 -50.47 8.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.017 -178.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -59.96 -32.51 70.88 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.649 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -141.81 134.65 14.05 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.06 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.19 -160.75 0.05 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.293 1.995 . . . . 0.0 111.811 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.427 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 90.1 m -59.14 98.51 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.816 0.341 . . . . 0.0 110.104 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.442 ' O ' ' HG2' ' A' ' 34' ' ' ARG . 6.2 p -155.5 144.42 20.66 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.672 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 32.9 m -70.08 110.05 4.91 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.749 -1.574 . . . . 0.0 106.749 177.201 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.645 ' HB2' ' CD1' ' A' ' 38' ' ' TRP . 12.2 mmm-85 -101.73 167.15 11.0 Favored Pre-proline 0 C--N 1.313 -1.001 0 O-C-N 124.143 0.902 . . . . 0.0 108.632 -178.802 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.944 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 17.8 Cg_endo -59.81 166.17 8.86 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 121.822 1.681 . . . . 0.0 111.267 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 20.9 tptm -78.22 75.13 4.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.839 0.828 . . . . 0.0 109.428 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.84 47.55 0.05 OUTLIER Glycine 0 N--CA 1.447 -0.626 0 CA-C-N 114.019 -1.446 . . . . 0.0 109.549 -177.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.645 ' CD1' ' HB2' ' A' ' 34' ' ' ARG . 6.8 p-90 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.056 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.6 pttt . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p -161.32 159.79 28.91 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 123.285 0.365 . . . . 0.0 110.204 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 75.2 mt -79.18 126.25 30.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.457 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.403 ' HB1' ' OE1' ' A' ' 5' ' ' GLU . . . -78.9 -166.9 0.98 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.99 0.424 . . . . 0.0 112.043 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.582 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.6 pm0 -67.56 129.95 41.5 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.502 0.668 . . . . 0.0 111.482 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 66.88 39.01 3.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.947 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.466 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -105.38 133.17 50.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.919 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -60.78 136.93 58.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.112 0.482 . . . . 0.0 111.107 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.6 m -91.07 155.43 18.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.273 0.559 . . . . 0.0 111.074 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 25.1 p -79.12 132.06 64.48 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.616 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -63.3 -41.08 28.65 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 123.035 2.49 . . . . 0.0 113.62 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.3 m-90 -129.57 -43.16 1.27 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.7 t -149.56 141.24 23.54 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.92 -139.38 5.61 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 111.519 -0.632 . . . . 0.0 111.519 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.64 150.43 20.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.116 0.484 . . . . 0.0 111.196 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 m -94.45 150.02 20.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.918 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.509 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 60.2 m -64.34 142.38 58.44 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.609 0.242 . . . . 0.0 111.593 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 70.9 m -68.8 142.34 54.91 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.521 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.14 144.28 62.6 Favored Pre-proline 0 C--N 1.315 -0.934 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.534 -179.575 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.472 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 89.2 Cg_endo -100.89 32.47 9.24 Favored 'Cis proline' 0 N--CA 1.451 -0.997 0 C-N-CA 123.334 -1.527 . . . . 0.0 113.479 1.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.582 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 28.1 m-85 -65.63 148.02 52.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.136 0.493 . . . . 0.0 110.455 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.6 tp -122.39 138.23 54.6 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.865 -178.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 48.8 t -69.04 112.71 5.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.02 0.438 . . . . 0.0 109.986 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.431 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 83.9 p -89.44 121.47 31.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.287 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.0 m -119.97 52.29 1.13 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.493 HG13 ' H ' ' A' ' 29' ' ' TYR . 12.3 pt -81.78 -170.76 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.658 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -72.98 -59.71 2.58 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -177.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -71.68 -32.24 67.65 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.493 ' H ' HG13 ' A' ' 26' ' ' ILE . 53.2 m-85 -111.5 124.31 32.86 Favored Pre-proline 0 C--N 1.321 -0.662 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.088 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.01 166.33 29.48 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.848 2.365 . . . . 0.0 111.595 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 24' ' ' SER . 92.0 m -49.48 104.35 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.547 0.689 . . . . 0.0 112.046 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.526 ' O ' ' HD3' ' A' ' 34' ' ' ARG . 6.7 p -153.57 137.9 16.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.33 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.3 m -65.42 119.93 11.9 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.526 ' HD3' ' O ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -118.72 159.22 45.13 Favored Pre-proline 0 C--N 1.324 -0.536 0 O-C-N 124.386 1.053 . . . . 0.0 108.223 179.835 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.548 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 50.0 Cg_exo -52.66 159.81 4.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.5 2.133 . . . . 0.0 112.48 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.472 ' HD3' ' O ' ' A' ' 20' ' ' PRO . 49.3 tptt -77.48 109.91 11.81 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.65 46.96 5.01 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 -177.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 16.7 p90 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.679 -179.204 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.2 tttt . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.0 p -161.3 158.07 26.49 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.484 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 71.0 mt -80.82 122.12 26.79 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.559 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.09 -162.44 0.39 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.155 0.502 . . . . 0.0 111.976 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.568 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 8.8 pm0 -63.75 126.17 26.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.573 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.79 45.54 4.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.467 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.461 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -115.61 120.83 40.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.631 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.538 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.2 m-20 -50.99 129.72 24.24 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.188 0.518 . . . . 0.0 112.282 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.89 147.94 30.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.3 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.4 m -78.99 130.57 69.51 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.19 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.478 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 40.0 Cg_endo -66.16 -52.21 0.94 Allowed 'Trans proline' 0 N--CA 1.472 0.216 0 C-N-CA 123.141 2.561 . . . . 0.0 113.604 -178.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.478 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 12.7 m-90 -79.98 -56.31 4.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.76 0.314 . . . . 0.0 111.396 -178.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.7 m -161.8 140.66 9.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.579 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 175.27 -153.85 16.46 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.506 -0.637 . . . . 0.0 111.506 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -70.16 143.21 52.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.999 0.428 . . . . 0.0 110.678 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.6 m -88.48 147.52 24.62 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.604 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.1 m -69.3 144.53 53.53 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.27 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 83.3 m -66.53 145.79 55.24 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.711 ' HD2' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.19 139.72 56.58 Favored Pre-proline 0 C--N 1.307 -1.239 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.274 -179.473 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.549 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 74.9 Cg_endo -103.04 36.37 5.63 Favored 'Cis proline' 0 N--CA 1.456 -0.732 0 C-N-CA 124.188 -1.172 . . . . 0.0 114.083 1.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.568 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 62.5 m-85 -66.98 147.5 53.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.324 0.583 . . . . 0.0 110.855 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.5 tp -116.47 135.42 53.85 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.168 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.4 t -70.37 124.63 24.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -132.12 134.67 45.72 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.903 0.382 . . . . 0.0 111.143 -178.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.419 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -113.16 85.54 2.2 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 179.663 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.82 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -79.84 -171.47 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.887 -178.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -71.91 -69.84 0.37 Allowed 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -177.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -69.19 -41.28 77.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.959 0.409 . . . . 0.0 111.885 -177.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.438 ' O ' HG12 ' A' ' 26' ' ' ILE . 46.7 m-85 -97.71 135.56 21.55 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.125 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.59 -171.26 0.37 Allowed 'Trans proline' 0 C--O 1.238 0.487 0 C-N-CA 122.474 2.116 . . . . 0.0 112.692 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.419 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 75.7 m -61.14 106.02 0.56 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.135 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 4.5 p -144.32 138.63 28.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.074 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 12.7 m -66.1 130.23 42.51 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.995 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.402 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 24.4 mmt85 -128.38 161.51 56.31 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 52.0 Cg_exo -51.25 154.37 8.16 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 122.531 2.154 . . . . 0.0 112.314 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 6.9 tmtm? -78.12 71.54 4.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.58 43.9 0.13 Allowed Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.088 -1.415 . . . . 0.0 109.663 -177.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 13.0 p90 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.972 -178.797 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 81.9 tttt . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.8 p -76.97 146.23 37.6 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 118.889 -1.125 . . . . 0.0 110.88 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 9' ' ' CYS . 90.4 mt -78.83 137.78 37.86 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.096 -1.411 . . . . 0.0 110.518 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.78 -178.87 5.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.43 ' HB3' ' CZ ' ' A' ' 21' ' ' TYR . 19.6 pt-20 -69.99 134.84 48.74 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.041 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . . . 56.48 40.15 29.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.311 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.45 135.8 52.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.151 -179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -57.02 141.57 45.24 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.501 0.501 . . . . 0.0 109.881 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.548 ' HA ' HD13 ' A' ' 3' ' ' LEU . 32.4 m -79.11 163.76 24.83 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.103 0.478 . . . . 0.0 110.982 -178.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.484 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 28.8 p -78.62 115.31 50.68 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.314 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 5.9 Cg_exo -79.13 -56.57 0.04 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.994 2.463 . . . . 0.0 112.348 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 23.8 m-90 -85.41 -40.49 16.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.12 0.486 . . . . 0.0 110.57 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.0 m -87.9 -163.58 0.97 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.243 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -160.08 129.37 2.17 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.136 -1.03 . . . . 0.0 112.412 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -159.41 152.53 22.13 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.615 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 5.9 m -88.14 147.08 25.08 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.985 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.411 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 8.4 m -74.54 145.12 43.7 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.426 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 58.8 m -60.77 144.29 52.74 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.36 144.18 65.81 Favored Pre-proline 0 C--N 1.312 -1.028 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -99.0 52.31 1.36 Allowed 'Cis proline' 0 N--CA 1.454 -0.821 0 C-N-CA 124.065 -1.223 . . . . 0.0 113.905 1.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 5' ' ' GLU . 37.8 m-85 -105.15 145.98 29.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.056 0.455 . . . . 0.0 110.316 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.7 tp -127.91 143.31 51.1 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.76 -178.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 41.9 t -66.48 122.07 16.74 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.1 p -126.33 139.92 52.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.324 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.9 t -135.58 96.3 3.42 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.641 HD11 ' HB2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -109.59 -168.02 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.911 -179.251 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -70.73 -59.44 2.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -73.65 -34.55 65.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.847 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.641 ' HB2' HD11 ' A' ' 26' ' ' ILE . 8.1 m-85 -109.18 128.15 25.96 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.943 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.04 177.3 5.21 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.887 2.391 . . . . 0.0 112.036 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 98.4 m -58.53 102.13 0.1 Allowed 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.48 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.3 p -153.56 140.91 19.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.609 -179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 25.2 m -71.17 127.58 33.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 6' ' ' ALA . 23.8 mmt180 -132.71 164.67 42.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 72.6 Cg_exo -46.47 139.96 12.37 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.139 1.893 . . . . 0.0 111.532 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -76.96 103.21 6.77 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.92 45.09 2.13 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.777 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.8 p90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.437 -179.505 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . 0.486 ' HB3' ' HE2' ' A' ' 1' ' ' LYS . 28.0 mtpt . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.621 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.9 p -160.82 149.71 16.66 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.296 0.569 . . . . 0.0 110.527 178.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 98.3 mt -85.53 136.11 33.55 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.332 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.38 -171.5 2.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.025 0.44 . . . . 0.0 111.609 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.474 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 10.9 pt-20 -74.32 137.56 42.94 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.347 0.594 . . . . 0.0 111.272 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 62.69 38.39 12.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.741 -178.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.78 139.39 44.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.311 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -60.73 149.59 35.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.928 0.394 . . . . 0.0 110.775 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.0 p -153.25 -170.63 3.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.125 0.488 . . . . 0.0 111.093 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.7 m -154.57 144.35 15.44 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.377 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.77 -36.65 91.26 Favored 'Trans proline' 0 CA--C 1.53 0.308 0 C-N-CA 123.547 2.832 . . . . 0.0 113.732 -178.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 9.3 m-90 -128.41 -54.28 1.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.023 0.439 . . . . 0.0 111.579 -179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 t -80.17 61.59 4.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.622 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -167.88 150.55 16.82 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.232 -0.985 . . . . 0.0 112.788 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.06 156.64 24.26 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.814 0.34 . . . . 0.0 110.429 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.621 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 4.5 m -78.2 143.22 37.36 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 4.9 m -76.82 141.34 40.73 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.349 -178.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 55.5 m -60.65 146.82 44.13 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 24.1 mmmt -83.31 150.98 61.82 Favored Pre-proline 0 C--N 1.31 -1.114 0 C-N-CA 120.13 -0.628 . . . . 0.0 109.81 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.409 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 96.1 Cg_endo -95.45 40.06 4.57 Favored 'Cis proline' 0 N--CA 1.45 -1.039 0 C-N-CA 123.205 -1.581 . . . . 0.0 114.085 1.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.474 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 29.6 m-85 -84.36 163.36 19.61 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 121.983 -0.448 . . . . 0.0 110.533 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 48.1 tp -138.37 141.55 39.65 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.502 -178.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 46.7 t -74.12 84.59 1.83 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.668 0.747 . . . . 0.0 110.118 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.649 ' OG ' ' HG3' ' A' ' 34' ' ' ARG . 33.4 p -81.15 136.82 35.93 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.318 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.9 t -136.84 69.29 1.41 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.28 0.562 . . . . 0.0 109.77 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.807 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -84.61 -172.4 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.243 -179.744 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -74.52 -51.83 13.62 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.344 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -73.42 -23.08 60.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.763 -178.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.589 ' HB2' HD11 ' A' ' 26' ' ' ILE . 87.3 m-85 -130.67 120.2 18.56 Favored Pre-proline 0 C--N 1.324 -0.532 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.399 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.73 175.02 3.2 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.988 2.458 . . . . 0.0 112.541 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 84.3 m -51.89 106.75 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.275 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.6 p -155.16 137.12 14.57 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.032 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 14.3 m -74.01 128.71 36.23 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 179.478 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.649 ' HG3' ' OG ' ' A' ' 24' ' ' SER . 5.8 mtp180 -142.73 163.87 35.92 Favored Pre-proline 0 C--N 1.318 -0.768 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.436 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 82.8 Cg_exo -46.59 141.57 10.85 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.502 2.135 . . . . 0.0 111.936 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.405 ' HE3' ' HB3' ' A' ' 36' ' ' LYS . 8.6 ttpp -77.05 106.41 8.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.984 0.421 . . . . 0.0 109.905 -179.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.21 46.16 2.88 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.8 p90 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.386 -0.816 . . . . 0.0 110.59 -179.491 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . 0.548 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 9.1 mtpm? . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p -160.83 156.61 25.39 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.357 0.41 . . . . 0.0 110.194 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.501 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 88.3 mt -79.95 130.11 35.02 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.3 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.27 -158.38 0.15 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.357 0.599 . . . . 0.0 111.962 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.615 ' HG3' ' CE2' ' A' ' 21' ' ' TYR . 15.0 mp0 -69.97 132.82 46.53 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.209 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 58.91 45.22 15.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.367 179.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.462 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -113.76 124.75 53.0 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.656 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.6 p30 -57.84 140.78 51.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.771 0.32 . . . . 0.0 110.711 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 17.4 p -114.32 -173.42 2.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.61 0.719 . . . . 0.0 112.022 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.517 ' HB2' ' HA3' ' A' ' 14' ' ' GLY . 75.3 m -153.88 143.67 15.3 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.471 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.64 -39.5 87.46 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.249 2.632 . . . . 0.0 113.641 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -137.17 -53.22 0.68 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.875 0.369 . . . . 0.0 111.278 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m -76.7 56.06 1.12 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.95 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.517 ' HA3' ' HB2' ' A' ' 10' ' ' SER . . . -173.56 148.29 10.1 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.508 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.548 ' OD2' ' HB3' ' A' ' 1' ' ' LYS . 69.1 m-20 -62.61 151.47 37.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.014 0.435 . . . . 0.0 110.946 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.3 m -79.69 151.47 30.46 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.501 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 60.5 m -64.19 141.27 58.83 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 121.272 -0.171 . . . . 0.0 110.656 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.1 m -64.87 146.5 54.82 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.8 ptmt -78.62 142.27 61.49 Favored Pre-proline 0 C--N 1.309 -1.17 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.879 -178.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.506 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 87.7 Cg_endo -101.97 35.11 6.82 Favored 'Cis proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.95 -1.271 . . . . 0.0 113.55 0.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.615 ' CE2' ' HG3' ' A' ' 5' ' ' GLU . 40.4 m-85 -69.62 155.09 41.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.218 0.532 . . . . 0.0 111.041 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.8 tp -131.64 136.17 47.52 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.716 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 16.4 t -74.03 125.1 27.54 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.7 p -126.34 133.21 51.42 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.051 0.453 . . . . 0.0 110.677 -178.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.7 m -99.54 72.66 1.79 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.352 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.806 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -79.89 -175.39 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.032 0.444 . . . . 0.0 111.16 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -82.05 -48.79 10.97 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.787 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -65.74 -26.09 67.57 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.579 -178.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.423 ' H ' HG12 ' A' ' 26' ' ' ILE . 96.4 m-85 -143.61 136.81 13.94 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.296 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.72 -175.89 0.39 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.487 2.125 . . . . 0.0 111.787 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 62.9 m -52.65 105.6 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.073 0.463 . . . . 0.0 110.996 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 6.0 p -148.81 141.84 24.86 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.053 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.7 m -64.23 126.61 28.32 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.123 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.576 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 23.5 mmt180 -129.5 165.01 35.85 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.576 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 9.4 Cg_endo -56.65 154.32 31.66 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 121.687 1.591 . . . . 0.0 111.66 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 19.1 tptm -77.61 114.62 16.63 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.66 46.47 7.27 Favored Glycine 0 N--CA 1.448 -0.54 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 -177.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.8 p90 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.652 -179.147 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.8 pptp? . . . . . 0 N--CA 1.483 1.181 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.1 p -126.69 155.68 42.27 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.023 0.44 . . . . 0.0 110.443 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.3 mt -86.41 123.77 32.01 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.763 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.32 -164.95 0.61 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.987 0.422 . . . . 0.0 111.236 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.422 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 7.1 pt-20 -74.03 131.97 41.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.393 0.616 . . . . 0.0 110.941 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 70.35 35.52 2.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.156 -1.384 . . . . 0.0 110.242 -177.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.419 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -105.57 131.59 52.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.93 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -62.34 131.64 49.97 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.283 0.364 . . . . 0.0 110.306 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.42 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 8.6 m -88.41 155.13 19.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.316 0.579 . . . . 0.0 110.858 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.2 m -79.55 128.14 75.93 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.856 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.29 -57.04 1.02 Allowed 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 123.258 2.639 . . . . 0.0 113.998 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.9 m-90 -89.97 -56.01 3.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.866 0.365 . . . . 0.0 111.554 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 m -159.69 146.16 16.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.976 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 178.17 -147.01 7.77 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.876 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -79.61 141.47 36.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.941 0.4 . . . . 0.0 110.842 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.8 m -83.89 154.37 23.46 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.899 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.447 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.7 m -66.45 141.68 57.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.578 0.228 . . . . 0.0 111.015 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.4 m -66.4 145.4 55.73 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 177.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.433 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 25.3 pttm -78.87 141.01 58.69 Favored Pre-proline 0 C--N 1.31 -1.144 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.254 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.475 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 73.9 Cg_endo -103.82 37.55 4.75 Favored 'Cis proline' 0 N--CA 1.451 -0.973 0 C-N-CA 123.916 -1.285 . . . . 0.0 113.919 1.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.747 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 50.5 m-85 -70.54 158.87 35.34 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.964 0.412 . . . . 0.0 110.499 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.7 tp -133.33 135.12 44.59 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.148 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.626 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.6 t -72.16 129.11 37.69 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.0 p -135.98 127.65 29.0 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.644 -178.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 14.8 m -100.08 72.93 1.69 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.528 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.811 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -82.11 -170.91 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.112 0.482 . . . . 0.0 111.141 -179.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -85.55 -48.97 8.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.621 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -65.79 -25.27 67.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.406 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.461 ' HB2' HD11 ' A' ' 26' ' ' ILE . 83.5 m-85 -141.42 138.22 17.32 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 17.1 Cg_exo -66.23 -165.12 0.09 OUTLIER 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.394 2.063 . . . . 0.0 111.595 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 80.0 m -62.43 99.17 0.13 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.906 0.384 . . . . 0.0 110.142 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.408 ' OG ' ' HD3' ' A' ' 34' ' ' ARG . 3.2 p -135.98 142.06 44.48 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.394 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.626 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 22.3 m -73.66 118.49 16.68 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 177.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.408 ' HD3' ' OG ' ' A' ' 32' ' ' SER . 18.8 mmm-85 -122.86 160.14 50.51 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.747 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 51.2 Cg_exo -50.93 148.26 17.19 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.072 1.848 . . . . 0.0 111.198 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.475 ' HE3' ' O ' ' A' ' 20' ' ' PRO . 37.1 ttmt -76.94 116.43 17.6 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.34 45.55 5.83 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -177.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 15.5 p90 . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.731 -179.131 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.0 p -160.65 161.68 32.47 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.365 0.416 . . . . 0.0 110.394 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.478 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 81.9 mt -79.3 134.39 36.62 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.356 -179.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.41 -166.04 0.79 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.309 0.576 . . . . 0.0 112.011 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.404 ' OE2' ' HG3' ' A' ' 35' ' ' PRO . 42.6 tt0 -71.1 134.3 46.91 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.762 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.09 42.5 12.37 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.666 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.16 136.31 48.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.201 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.401 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.1 p30 -58.58 147.41 32.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.88 0.372 . . . . 0.0 111.149 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.7 p -146.07 159.08 43.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.389 0.614 . . . . 0.0 111.682 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 71.6 m -157.42 146.16 14.61 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.468 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.31 -42.98 57.11 Favored 'Trans proline' 0 CA--C 1.529 0.236 0 C-N-CA 123.606 2.871 . . . . 0.0 113.229 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -111.28 -50.85 2.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.131 0.491 . . . . 0.0 110.683 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.0 t -85.9 52.66 2.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.893 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -169.5 145.65 9.5 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.117 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -82.25 -177.84 6.8 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -85.23 141.7 29.94 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.573 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 56.3 m -73.09 141.38 47.56 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.476 0.179 . . . . 0.0 110.551 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.5 m -66.5 140.41 58.0 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 177.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.669 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.8 OUTLIER -78.54 148.53 73.57 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -179.575 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.468 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.5 Cg_endo -98.08 38.67 5.46 Favored 'Cis proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.182 -1.591 . . . . 0.0 113.924 1.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -81.91 147.89 29.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.027 0.441 . . . . 0.0 110.502 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 54.1 tp -118.75 140.97 49.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.245 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.573 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 40.9 t -72.61 104.11 3.78 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 76.8 p -98.4 139.62 33.88 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.449 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.0 t -140.3 63.25 1.48 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.378 0.609 . . . . 0.0 109.489 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.793 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -85.01 -167.05 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.26 -179.678 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -69.52 -59.29 3.07 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -71.41 -35.4 70.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.683 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.711 ' HB2' HD11 ' A' ' 26' ' ' ILE . 15.5 m-85 -109.4 123.57 36.27 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.831 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -71.35 172.89 13.24 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 122.741 2.294 . . . . 0.0 111.414 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.2 m -51.31 103.16 0.05 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.991 0.424 . . . . 0.0 111.148 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.7 p -160.13 137.08 9.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.644 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.9 m -67.01 127.54 32.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.719 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -134.26 162.16 59.38 Favored Pre-proline 0 C--N 1.324 -0.534 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.404 ' HG3' ' OE2' ' A' ' 5' ' ' GLU . 49.9 Cg_exo -50.9 147.92 17.8 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.116 1.877 . . . . 0.0 111.58 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 35.4 ttpt -77.16 113.97 15.47 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.66 46.76 4.48 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 28.7 p90 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.559 -179.381 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.7 mtmm . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.526 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.1 p -150.45 149.54 30.14 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.191 0.519 . . . . 0.0 110.302 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.553 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 80.0 mt -79.89 135.08 36.35 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.386 -178.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.15 -168.62 1.34 Allowed 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.482 ' OE2' ' HG3' ' A' ' 35' ' ' PRO . 40.0 tt0 -70.61 135.01 48.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.007 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.11 43.26 11.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.726 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.54 127.24 53.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.741 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.451 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 5.6 t70 -57.01 132.72 53.73 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.553 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 30.4 p -94.47 170.21 9.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.832 0.825 . . . . 0.0 112.509 -178.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.9 p -78.89 120.27 80.25 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.952 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.471 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 38.0 Cg_endo -66.95 -46.08 3.56 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 122.948 2.432 . . . . 0.0 112.903 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.471 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 11.1 m-90 -91.36 -53.97 4.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.707 0.289 . . . . 0.0 111.268 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.3 t -173.21 148.57 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.233 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.7 -153.25 22.84 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.298 -0.721 . . . . 0.0 111.298 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -74.34 138.49 43.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.126 0.488 . . . . 0.0 110.368 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.526 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.8 m -83.14 156.46 23.25 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.353 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.502 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 31.1 m -63.84 143.94 57.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.81 -0.177 . . . . 0.0 110.695 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.0 m -63.4 145.21 56.07 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt -78.47 145.4 67.68 Favored Pre-proline 0 C--N 1.312 -1.043 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.314 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.696 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 90.0 Cg_endo -99.67 28.6 14.38 Favored 'Cis proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.023 -1.657 . . . . 0.0 113.583 1.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -64.85 153.0 41.45 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.312 0.577 . . . . 0.0 111.57 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 44.7 tp -131.68 140.74 49.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.187 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.66 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 16.6 t -75.3 120.51 20.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.998 0.428 . . . . 0.0 110.028 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.4 p -110.72 126.8 54.94 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.412 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 58.7 m -101.79 68.97 1.18 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.411 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.847 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -80.96 -172.97 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.998 0.428 . . . . 0.0 111.289 -179.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -86.17 -49.22 7.9 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.944 -178.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -66.14 -25.28 66.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.618 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.464 ' HB2' HD11 ' A' ' 26' ' ' ILE . 88.5 m-85 -139.11 138.23 20.62 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.935 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.15 -174.59 0.33 Allowed 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.448 2.099 . . . . 0.0 111.857 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 79.6 m -59.38 99.91 0.07 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.109 0.481 . . . . 0.0 110.503 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.451 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 3.9 p -139.1 138.51 37.12 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.202 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.66 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -65.48 127.44 31.84 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.649 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.462 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 25.6 mmt180 -130.37 164.77 38.83 Favored Pre-proline 0 C--N 1.324 -0.542 0 O-C-N 124.622 1.201 . . . . 0.0 107.88 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.482 ' HG3' ' OE2' ' A' ' 5' ' ' GLU . 32.4 Cg_exo -51.03 153.7 8.51 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.316 2.01 . . . . 0.0 112.02 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.696 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 40.3 tttp -77.65 114.52 16.58 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.0 47.84 5.39 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -177.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.3 p90 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.709 -179.335 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . 0.551 ' HE2' ' OD2' ' A' ' 15' ' ' ASP . 9.2 mmmm . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.5 p -161.92 153.57 18.75 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.052 0.453 . . . . 0.0 110.827 178.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.9 mt -80.99 134.67 35.73 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.891 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.48 -168.56 1.39 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.143 0.497 . . . . 0.0 111.665 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.627 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 9.3 pt-20 -73.13 135.56 44.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.551 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.534 ' HA ' ' HD2' ' A' ' 34' ' ' ARG . . . 62.92 44.56 6.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.906 -178.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -119.51 127.76 53.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.535 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -52.86 135.26 36.38 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.5 p -111.93 -176.38 2.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 122.093 0.949 . . . . 0.0 113.059 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.433 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 58.6 m -157.85 144.49 13.07 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 114.544 -1.207 . . . . 0.0 109.366 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.508 ' HB2' ' CE3' ' A' ' 12' ' ' TRP . 24.1 Cg_exo -62.52 -43.88 20.21 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.799 2.333 . . . . 0.0 112.725 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.508 ' CE3' ' HB2' ' A' ' 11' ' ' PRO . 11.5 m-90 -136.53 -34.2 0.77 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.768 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 p -77.77 44.79 0.47 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.41 160.49 20.08 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.18 -1.009 . . . . 0.0 112.648 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.551 ' OD2' ' HE2' ' A' ' 1' ' ' LYS . 64.7 m-20 -60.96 153.1 25.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.922 0.391 . . . . 0.0 110.827 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.429 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.6 m -79.49 149.82 31.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 55.9 m -61.75 140.61 58.2 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.407 0.146 . . . . 0.0 111.219 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.7 m -64.81 144.35 57.31 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.8 pttp -78.14 142.27 63.67 Favored Pre-proline 0 C--N 1.312 -1.045 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.643 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.509 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 76.8 Cg_endo -102.74 38.22 4.82 Favored 'Cis proline' 0 N--CA 1.455 -0.774 0 C-N-CA 123.948 -1.271 . . . . 0.0 113.901 1.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.627 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 38.0 m-85 -74.0 143.67 45.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.352 0.596 . . . . 0.0 110.824 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.1 tp -115.04 138.66 50.61 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.008 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.682 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.8 t -73.23 103.41 3.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.581 0.705 . . . . 0.0 110.53 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 52.3 p -80.38 132.6 35.79 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.87 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.2 t -143.25 53.92 1.35 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.454 0.645 . . . . 0.0 109.384 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.636 HG12 ' HB2' ' A' ' 29' ' ' TYR . 28.7 pt -85.79 -165.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.622 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.48 -56.48 15.75 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -79.83 -31.9 40.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.98 0.419 . . . . 0.0 112.117 -178.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.636 ' HB2' HG12 ' A' ' 26' ' ' ILE . 3.1 m-85 -102.66 111.06 64.44 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.613 -179.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -65.86 162.57 34.37 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.766 2.311 . . . . 0.0 110.425 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 27.8 m -48.64 97.93 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.119 0.485 . . . . 0.0 111.924 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 p -153.92 139.01 17.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.539 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.682 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -65.68 120.37 12.85 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.534 ' HD2' ' HA ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -123.58 158.06 60.33 Favored Pre-proline 0 C--N 1.321 -0.636 0 O-C-N 124.624 1.203 . . . . 0.0 107.877 179.923 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.446 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 50.2 Cg_exo -53.38 154.57 14.56 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.216 1.944 . . . . 0.0 111.644 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 1.6 tmtp? -77.09 108.49 10.2 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.01 46.47 3.35 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.6 p90 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.385 -0.816 . . . . 0.0 110.672 -179.355 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . 0.633 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 7.4 p -160.87 158.15 27.82 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 123.84 0.713 . . . . 0.0 109.306 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 70.8 mt -79.61 119.33 22.41 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.251 -0.432 . . . . 0.0 109.958 -179.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.31 -163.41 0.44 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.034 0.445 . . . . 0.0 111.575 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.407 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 6.9 pt-20 -72.28 134.08 45.37 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.335 0.588 . . . . 0.0 110.936 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 68.71 37.53 2.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.416 -177.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -107.19 128.74 54.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.078 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -58.93 133.72 56.31 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.325 0.391 . . . . 0.0 111.104 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 m -93.8 153.46 18.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.317 0.58 . . . . 0.0 110.453 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.4 m -79.52 129.89 70.06 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.916 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.406 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 19.3 Cg_endo -59.8 -57.31 0.86 Allowed 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 123.277 2.651 . . . . 0.0 113.968 -178.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.406 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 19.8 m-90 -82.12 -50.61 8.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.827 0.346 . . . . 0.0 111.296 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.1 t -175.22 150.21 1.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.01 -144.55 5.16 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.948 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.633 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 0.1 OUTLIER -79.13 157.93 27.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.265 0.555 . . . . 0.0 111.671 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.6 m -93.22 150.61 20.37 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.199 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.443 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.1 m -71.27 144.09 50.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.097 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.9 m -64.68 147.92 52.05 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.3 137.8 60.1 Favored Pre-proline 0 C--N 1.314 -0.972 0 CA-C-O 120.796 0.332 . . . . 0.0 110.941 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.631 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 69.1 Cg_endo -104.89 37.09 4.59 Favored 'Cis proline' 0 N--CA 1.454 -0.843 0 C-N-CA 124.346 -1.106 . . . . 0.0 113.72 0.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.657 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 41.7 m-85 -71.14 143.19 50.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.223 0.535 . . . . 0.0 110.649 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 tp -117.26 139.65 50.54 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.795 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.685 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.1 t -74.08 116.09 14.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.038 0.447 . . . . 0.0 109.798 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 84.2 p -107.95 143.47 36.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.656 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -143.3 58.43 1.4 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.481 HG13 ' H ' ' A' ' 29' ' ' TYR . 38.0 pt -84.55 -162.73 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.341 -179.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -67.38 -62.66 1.31 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.709 -178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -72.71 -41.76 64.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.607 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.481 ' H ' HG13 ' A' ' 26' ' ' ILE . 3.2 m-85 -95.99 120.87 62.21 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.747 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.69 172.46 15.74 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.562 2.175 . . . . 0.0 110.98 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.9 m -52.32 99.25 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.0 0.429 . . . . 0.0 111.196 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.8 p -160.07 143.49 13.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.739 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.685 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.0 m -69.43 132.04 45.72 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -133.93 161.49 63.42 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.657 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 50.9 Cg_exo -51.39 153.19 10.52 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.434 2.09 . . . . 0.0 111.918 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.631 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 59.4 tttm -77.32 103.56 7.33 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.74 46.71 2.64 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 -177.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.6 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.819 -179.198 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.5 p -160.14 154.78 24.05 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.002 0.429 . . . . 0.0 110.15 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 85.8 mt -79.85 132.82 36.19 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.077 -179.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.16 -179.55 6.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.697 0.284 . . . . 0.0 110.675 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.429 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 11.5 pt-20 -70.79 141.53 51.39 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.29 0.567 . . . . 0.0 110.807 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 66.45 45.43 2.14 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.389 -177.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -132.09 124.23 28.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.898 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.617 ' OD1' ' HB3' ' A' ' 32' ' ' SER . 36.0 m-20 -56.97 131.09 48.75 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 123.418 0.449 . . . . 0.0 110.835 -179.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.509 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 31.8 p -91.08 169.62 10.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.641 0.734 . . . . 0.0 112.072 -178.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.5 m -81.77 125.05 78.93 Favored Pre-proline 0 C--N 1.319 -0.724 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.276 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.455 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 38.8 Cg_endo -67.61 -51.96 0.63 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.86 2.373 . . . . 0.0 113.575 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.455 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 14.7 m-90 -82.06 -52.38 7.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.712 0.291 . . . . 0.0 111.334 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.3 t -174.18 148.14 1.29 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.117 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 169.34 -151.78 18.26 Favored Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -72.28 141.94 48.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.387 0.613 . . . . 0.0 110.462 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.0 m -85.65 154.51 21.63 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.842 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 33.4 m -67.79 139.37 56.62 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.7 m -61.69 147.52 45.75 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.726 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -78.77 144.7 65.0 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.135 -179.965 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 87.0 Cg_endo -101.66 34.95 7.05 Favored 'Cis proline' 0 N--CA 1.45 -1.037 0 C-N-CA 123.438 -1.484 . . . . 0.0 113.507 1.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.52 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 43.0 m-85 -73.35 174.96 7.37 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.112 0.482 . . . . 0.0 111.339 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.589 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 49.6 tp -152.7 142.44 21.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.136 -178.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.675 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 18.0 t -75.85 112.03 11.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.349 0.595 . . . . 0.0 110.608 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.4 p -101.68 137.4 40.04 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.01 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.9 t -129.91 71.79 1.46 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.29 0.567 . . . . 0.0 109.906 -179.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.743 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -90.42 -167.98 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.93 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -75.91 -52.92 9.26 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.245 -178.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -70.8 -25.83 63.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.177 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HB2' HD11 ' A' ' 26' ' ' ILE . 32.4 m-85 -128.94 128.34 23.41 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.633 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.92 179.23 2.86 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.756 2.304 . . . . 0.0 111.757 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 87.3 m -57.61 95.52 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.157 0 O-C-N 123.301 0.375 . . . . 0.0 110.492 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.617 ' HB3' ' OD1' ' A' ' 8' ' ' ASP . 8.7 p -144.57 142.21 30.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.193 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.675 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -70.78 129.67 39.71 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -139.05 163.9 42.94 Favored Pre-proline 0 C--N 1.318 -0.796 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.52 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 52.6 Cg_exo -49.67 141.73 26.39 Favored 'Trans proline' 0 N--CA 1.464 -0.234 0 C-N-CA 121.99 1.793 . . . . 0.0 111.122 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.589 ' HE2' ' HB2' ' A' ' 22' ' ' LEU . 30.3 ttmt -77.94 123.56 26.93 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.75 43.51 6.79 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -178.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 15.8 p90 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.41 -0.805 . . . . 0.0 110.46 -179.484 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.3 p -159.3 151.24 20.73 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.463 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.492 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 87.4 mt -86.46 121.59 29.22 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.725 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.79 -162.18 0.35 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.256 0.55 . . . . 0.0 112.216 -178.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.468 ' H ' ' CD ' ' A' ' 5' ' ' GLU . 8.4 pm0 -64.06 125.71 25.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.792 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.74 45.45 5.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.277 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.469 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -111.38 117.75 33.95 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.785 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.551 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 1.2 m-20 -56.68 131.66 49.68 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.379 0.609 . . . . 0.0 111.614 -179.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.434 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 2.7 m -83.1 154.92 24.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.439 -178.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.2 m -79.1 130.56 69.15 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.907 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.45 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 29.2 Cg_endo -63.83 -55.29 0.69 Allowed 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.021 2.481 . . . . 0.0 113.78 -178.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.45 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.0 m-90 -80.26 -52.24 7.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.727 0.299 . . . . 0.0 111.32 -179.023 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.9 p -174.09 149.35 1.44 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.474 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.09 -151.43 10.24 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -79.61 147.35 32.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.295 0.569 . . . . 0.0 111.067 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.1 m -83.71 156.53 22.55 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.122 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.456 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 45.6 m -64.22 141.01 58.92 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.426 0.155 . . . . 0.0 110.834 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.2 m -63.74 148.19 49.78 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.743 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.02 141.89 59.16 Favored Pre-proline 0 C--N 1.312 -1.058 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.196 -179.888 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -104.64 40.98 3.13 Favored 'Cis proline' 0 N--CA 1.448 -1.179 0 C-N-CA 123.752 -1.353 . . . . 0.0 113.641 1.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.463 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 59.8 m-85 -72.41 179.48 3.44 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.317 0.579 . . . . 0.0 111.417 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.603 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 59.7 tp -151.95 138.92 19.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.783 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.592 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.1 t -71.84 111.76 7.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.822 0.344 . . . . 0.0 111.132 -179.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.739 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 72.2 p -84.91 108.0 17.34 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.9 t -118.99 59.04 0.84 Allowed 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.108 -177.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.611 HG13 ' HB2' ' A' ' 29' ' ' TYR . 10.3 pt -90.22 -171.07 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.983 0.42 . . . . 0.0 111.332 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -67.01 -81.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -177.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.543 ' HD1' ' HD1' ' A' ' 29' ' ' TYR . 0.3 OUTLIER -79.86 36.06 0.32 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -177.032 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.611 ' HB2' HG13 ' A' ' 26' ' ' ILE . 11.3 m-85 -148.67 131.52 7.99 Favored Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 177.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -60.98 131.21 35.92 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.553 2.169 . . . . 0.0 111.0 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.739 ' HA ' ' O ' ' A' ' 24' ' ' SER . 69.8 m -61.99 100.56 0.16 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.446 0.641 . . . . 0.0 111.015 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.551 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 5.2 p -145.02 148.25 33.52 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.389 -178.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.592 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 14.9 m -67.54 128.84 37.95 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 120.933 0.397 . . . . 0.0 110.242 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.61 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 26.0 mmt85 -132.48 168.07 19.53 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.884 -1.524 . . . . 0.0 106.884 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.61 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 10.0 Cg_endo -55.02 151.15 35.27 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 121.429 1.419 . . . . 0.0 110.48 179.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.603 ' HE2' ' HB2' ' A' ' 22' ' ' LEU . 20.2 ttmt -77.41 118.21 19.65 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.323 -178.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.74 47.01 1.55 Allowed Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.5 -178.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 C--O 1.253 1.243 0 CA-C-O 117.853 -1.07 . . . . 0.0 110.072 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.4 tptp . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p -161.96 159.27 26.35 Favored 'General case' 0 C--N 1.322 -0.628 0 O-C-N 123.596 0.56 . . . . 0.0 109.988 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.452 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.1 mt -80.03 133.09 36.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.351 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.41 -168.09 1.25 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.202 0.525 . . . . 0.0 112.031 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.51 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 6.4 pt-20 -72.96 132.52 43.54 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.106 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.67 38.74 9.2 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.535 -1.212 . . . . 0.0 110.411 -178.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.86 133.58 52.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.396 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -58.68 145.39 40.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.261 0.553 . . . . 0.0 111.473 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.22 142.72 50.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.826 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.5 m -79.8 128.45 74.24 Favored Pre-proline 0 C--N 1.318 -0.79 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.489 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.5 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 51.8 Cg_endo -67.87 -43.31 5.29 Favored 'Trans proline' 0 N--CA 1.474 0.334 0 C-N-CA 123.434 2.756 . . . . 0.0 113.925 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.5 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 19.4 m-90 -78.99 -44.82 21.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.611 0.243 . . . . 0.0 111.453 -178.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.2 t -175.47 139.09 0.42 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.303 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.71 -147.83 7.01 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -81.29 152.02 27.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.93 0.395 . . . . 0.0 110.24 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 m -85.49 144.3 28.03 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 54.3 m -72.16 140.58 48.87 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.0 m -64.13 142.39 58.43 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.697 ' HD2' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.64 143.83 63.9 Favored Pre-proline 0 C--N 1.311 -1.101 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.12 -179.555 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -101.0 44.53 2.81 Favored 'Cis proline' 0 N--CA 1.455 -0.768 0 C-N-CA 124.069 -1.221 . . . . 0.0 113.858 1.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.51 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 40.3 m-85 -87.5 147.0 25.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.154 0.502 . . . . 0.0 110.634 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 56.7 tp -121.61 143.66 49.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.759 -179.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 41.9 t -68.02 114.23 6.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.926 0.393 . . . . 0.0 109.951 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.567 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 97.4 p -96.51 126.68 41.87 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.122 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 77.5 m -122.52 59.19 1.04 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.004 0.43 . . . . 0.0 110.407 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.771 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -84.72 -174.85 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.986 0.422 . . . . 0.0 111.055 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -81.16 -47.98 12.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.53 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -64.97 -25.37 67.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.646 -178.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.481 ' H ' HG12 ' A' ' 26' ' ' ILE . 96.9 m-85 -141.75 128.93 11.52 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.562 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.03 173.65 5.72 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.869 2.379 . . . . 0.0 112.229 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.567 ' HA ' ' O ' ' A' ' 24' ' ' SER . 92.6 m -50.33 108.55 0.23 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.522 0.677 . . . . 0.0 111.768 -179.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.4 p -152.46 131.32 12.48 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.969 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.9 m -65.32 128.19 34.85 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.423 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 81.0 mtt-85 -138.16 162.85 51.48 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.423 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 51.5 Cg_exo -48.69 144.1 15.22 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.244 1.962 . . . . 0.0 111.483 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -77.16 119.8 21.36 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.166 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.59 44.68 6.05 Favored Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 110.784 -0.926 . . . . 0.0 110.784 -178.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.8 p90 . . . . . 0 C--O 1.252 1.199 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.421 -179.625 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . 0.509 ' HG2' ' N ' ' A' ' 2' ' ' CYS . 19.8 ttpp . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.68 ' HA ' ' O ' ' A' ' 16' ' ' SER . 18.4 p -113.63 157.94 21.49 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.504 178.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 93.0 mt -99.71 130.15 45.9 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.773 -178.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.01 -165.88 0.72 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.095 0.474 . . . . 0.0 111.719 -179.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.603 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 13.2 pt-20 -71.35 131.65 43.71 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.054 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 65.4 38.9 5.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.553 -178.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.436 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -106.13 126.9 52.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.457 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -51.72 136.75 26.85 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.415 0.447 . . . . 0.0 111.021 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 32' ' ' SER . 1.4 p -129.59 142.54 50.72 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.909 0.861 . . . . 0.0 112.213 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.2 m -79.9 130.49 66.74 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 114.293 -1.322 . . . . 0.0 110.336 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.488 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 58.8 Cg_endo -69.54 -43.58 2.75 Favored 'Trans proline' 0 N--CA 1.474 0.333 0 C-N-CA 123.386 2.724 . . . . 0.0 113.981 -178.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.488 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.3 m-90 -79.07 -45.53 19.93 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.8 t -175.36 143.93 0.68 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.786 0.326 . . . . 0.0 111.106 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.61 -153.16 18.21 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.446 ' OD2' ' HB3' ' A' ' 1' ' ' LYS . 11.5 m-20 -69.8 145.81 51.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.099 0.476 . . . . 0.0 110.332 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.68 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 3.9 m -86.21 146.54 26.51 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.19 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 34.3 m -69.66 139.35 53.51 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.805 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 56.4 m -63.47 149.19 46.65 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 61.2 pttt -78.91 142.33 60.21 Favored Pre-proline 0 C--N 1.311 -1.094 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.17 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 83.0 Cg_endo -103.16 39.47 4.09 Favored 'Cis proline' 0 N--CA 1.45 -1.046 0 C-N-CA 123.991 -1.254 . . . . 0.0 113.81 1.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.603 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 57.4 m-85 -77.71 -176.37 4.33 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 121.992 -0.442 . . . . 0.0 111.202 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.6 tp -159.21 139.52 12.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.3 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.9 t -69.65 112.57 6.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.842 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.61 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 55.2 p -99.45 108.62 21.12 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.074 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 31' ' ' CYS . 1.8 t -103.96 58.41 0.73 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.062 -178.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.822 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -91.4 -175.41 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.18 -179.612 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -86.67 -56.65 3.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -178.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -61.47 -32.87 72.89 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.827 -178.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.75 ' HB2' HD11 ' A' ' 26' ' ' ILE . 7.8 m-85 -115.7 129.55 25.06 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.801 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.7 142.64 91.3 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.545 2.164 . . . . 0.0 111.409 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.61 ' HA ' ' O ' ' A' ' 24' ' ' SER . 72.4 m -54.84 100.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.816 0.817 . . . . 0.0 111.348 -179.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.406 ' HA ' ' SG ' ' A' ' 9' ' ' CYS . 6.4 p -153.37 149.59 27.98 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.144 -0.934 . . . . 0.0 110.254 -178.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.7 m -67.99 128.71 37.51 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.418 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 22.7 mmt180 -132.92 164.44 43.85 Favored Pre-proline 0 C--N 1.32 -0.687 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.418 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 52.7 Cg_exo -49.99 143.38 24.51 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.028 1.818 . . . . 0.0 110.795 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -77.34 115.89 17.49 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -179.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.53 44.6 3.94 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -177.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.5 p90 . . . . . 0 C--O 1.252 1.196 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.449 -179.258 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . 0.467 ' HG3' ' N ' ' A' ' 2' ' ' CYS . 51.6 tptt . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.4 p -149.41 149.38 30.74 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.523 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 85.3 mt -79.63 137.37 37.08 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.004 -178.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.62 -166.78 0.93 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.224 0.535 . . . . 0.0 112.065 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.4 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 38.7 tt0 -72.06 134.37 45.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.906 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.11 46.07 6.63 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.508 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -122.01 122.5 39.45 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.458 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.667 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 37.4 m-20 -57.21 131.17 49.17 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.57 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.523 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 26.2 p -95.88 -173.98 3.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.455 -179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 21.1 t -160.29 138.74 7.54 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.58 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.59 -31.56 87.11 Favored 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 123.127 2.551 . . . . 0.0 113.307 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -137.54 -51.44 0.63 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.869 0.366 . . . . 0.0 111.42 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 m -79.42 50.96 1.16 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.942 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 178.41 141.12 4.16 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.657 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.99 163.83 18.99 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.121 0.486 . . . . 0.0 111.098 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.53 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 15.9 m -79.15 153.84 29.77 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.962 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 12.5 m -64.28 142.87 58.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.364 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.9 m -64.64 144.73 57.01 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 177.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.766 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -77.55 143.23 67.71 Favored Pre-proline 0 C--N 1.313 -0.992 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.892 -178.742 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.526 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 84.6 Cg_endo -102.72 35.64 6.18 Favored 'Cis proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.181 -1.591 . . . . 0.0 113.893 1.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -67.2 150.06 49.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.29 0.567 . . . . 0.0 111.368 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.0 tp -124.89 134.4 52.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.567 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.668 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 11.3 t -74.87 122.42 23.36 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.0 p -126.69 129.3 48.17 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.243 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.1 76.6 1.47 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.309 -179.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.81 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -84.9 -168.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.036 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -84.98 -50.56 7.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.915 -178.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -66.99 -26.45 66.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.513 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.528 ' HB2' HD11 ' A' ' 26' ' ' ILE . 75.6 m-85 -136.99 138.38 25.65 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.474 ' HG2' ' OD1' ' A' ' 8' ' ' ASP . 36.4 Cg_endo -67.17 -158.92 0.04 OUTLIER 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.225 1.95 . . . . 0.0 112.215 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 73.1 m -68.28 77.38 0.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.033 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.667 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 3.5 p -114.65 141.5 47.71 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.668 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 21.2 m -71.95 118.58 14.99 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 24.5 mmm-85 -121.47 162.08 38.04 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.4 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 47.7 Cg_exo -50.99 152.28 10.46 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.28 1.986 . . . . 0.0 112.121 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 21.4 tptm -77.42 108.31 10.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.75 47.51 3.94 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.063 -1.215 . . . . 0.0 110.063 -177.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.5 p90 . . . . . 0 C--O 1.252 1.195 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.897 -179.08 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . 0.571 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 7.6 ptpp? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 16' ' ' SER . 25.7 p -118.59 150.39 39.75 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.649 178.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.503 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 82.3 mt -84.91 127.88 34.36 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.607 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.77 -163.48 0.48 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.078 0.466 . . . . 0.0 111.634 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.606 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 5.0 pt-20 -70.93 130.97 42.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.347 0.594 . . . . 0.0 111.341 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 64.52 39.96 6.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.855 -178.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.48 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -106.37 128.55 54.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.473 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.414 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 3.6 p30 -58.81 138.47 57.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.155 0.502 . . . . 0.0 111.406 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.4 m -97.57 151.66 19.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.125 0.488 . . . . 0.0 110.629 -179.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.1 m -79.57 128.23 75.58 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.973 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.456 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 30.3 Cg_endo -63.96 -54.82 0.78 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 123.041 2.494 . . . . 0.0 113.722 -178.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.456 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.2 m-90 -80.61 -52.55 7.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.797 0.332 . . . . 0.0 111.255 -179.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 t -175.86 150.01 0.98 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.67 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.69 -142.77 6.96 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.878 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.571 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 46.6 m-20 -72.13 144.67 48.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.204 0.526 . . . . 0.0 110.652 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.582 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 7.7 m -95.75 150.72 20.08 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.816 179.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.649 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 60.7 m -63.71 142.98 58.2 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.618 0.247 . . . . 0.0 111.625 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.5 m -68.12 143.66 55.34 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 177.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 8.7 ptpp? -78.87 141.73 59.65 Favored Pre-proline 0 C--N 1.311 -1.097 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.417 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.564 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 86.7 Cg_endo -102.91 36.48 5.62 Favored 'Cis proline' 0 N--CA 1.454 -0.827 0 C-N-CA 124.18 -1.175 . . . . 0.0 113.931 1.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.606 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 32.8 m-85 -69.53 150.05 47.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.146 0.498 . . . . 0.0 110.774 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -119.64 134.68 55.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.719 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.1 t -76.16 113.12 13.34 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.829 0.347 . . . . 0.0 111.013 179.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 64.8 p -84.88 102.73 13.34 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 31' ' ' CYS . 4.2 t -110.13 54.89 0.65 Allowed 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -178.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.468 HG13 ' H ' ' A' ' 29' ' ' TYR . 16.0 pt -110.2 -170.56 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.202 -179.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -78.36 -56.53 4.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.228 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -65.15 -33.56 76.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.168 0.508 . . . . 0.0 111.289 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.468 ' H ' HG13 ' A' ' 26' ' ' ILE . 4.3 m-85 -114.54 112.69 45.69 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.027 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -56.33 141.36 89.02 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.9 2.4 . . . . 0.0 111.4 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.689 ' HA ' ' O ' ' A' ' 24' ' ' SER . 62.8 m -50.92 96.51 0.01 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.766 0.794 . . . . 0.0 112.536 -178.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.414 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 7.7 p -158.2 145.04 17.7 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.772 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -67.11 125.65 26.7 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.607 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 25.0 mmt85 -123.23 166.25 19.0 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.607 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 12.2 Cg_endo -57.2 166.25 4.53 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 121.629 1.553 . . . . 0.0 111.398 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.564 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 47.7 tttp -77.83 73.91 4.39 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.959 0.885 . . . . 0.0 109.53 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.27 49.39 0.05 OUTLIER Glycine 0 N--CA 1.441 -0.998 0 CA-C-N 113.697 -1.592 . . . . 0.0 109.469 -177.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.2 p-90 . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.404 -178.846 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? . . . . . 0 N--CA 1.482 1.14 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 16' ' ' SER . 27.2 p -162.32 153.83 18.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.109 0.481 . . . . 0.0 110.778 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 89.1 mt -80.28 128.17 33.22 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.372 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.65 -166.65 0.91 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.991 0.424 . . . . 0.0 111.424 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.606 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 8.1 pt-20 -72.4 130.89 41.78 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.152 0.501 . . . . 0.0 110.791 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 69.69 34.23 2.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.428 -178.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.459 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -104.14 127.03 51.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.815 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -57.16 132.72 53.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.846 0.355 . . . . 0.0 111.31 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.09 137.03 52.55 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.499 0.666 . . . . 0.0 110.952 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.0 m -79.44 128.87 73.81 Favored Pre-proline 0 C--N 1.314 -0.945 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.475 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.516 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 56.5 Cg_endo -68.42 -41.12 6.98 Favored 'Trans proline' 0 N--CA 1.474 0.338 0 C-N-CA 123.557 2.838 . . . . 0.0 113.943 -178.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.516 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 20.8 m-90 -78.7 -43.16 26.51 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.09 -178.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 t -177.79 138.55 0.21 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.474 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.91 -153.74 10.41 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -83.01 152.34 25.45 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.402 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 13.3 m -83.54 144.76 29.29 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.016 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 12.9 m -70.9 138.16 49.9 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.8 m -61.82 146.68 48.82 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 178.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -82.75 147.79 56.09 Favored Pre-proline 0 C--N 1.311 -1.096 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.152 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.536 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 94.1 Cg_endo -97.82 32.28 10.92 Favored 'Cis proline' 0 N--CA 1.451 -0.997 0 C-N-CA 122.988 -1.672 . . . . 0.0 113.752 1.218 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.606 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 39.1 m-85 -70.6 156.54 39.3 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.199 0.523 . . . . 0.0 111.304 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 tp -131.36 140.7 49.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.316 -178.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 50.6 t -71.68 125.51 27.29 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.443 ' OG ' ' HG2' ' A' ' 34' ' ' ARG . 63.6 p -132.46 133.99 44.52 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -179.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -118.65 86.37 2.53 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.727 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -91.26 -168.76 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.544 -179.425 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -75.32 -64.13 1.13 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.02 -39.58 87.07 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.955 0.407 . . . . 0.0 111.367 -177.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.478 ' HB2' HD11 ' A' ' 26' ' ' ILE . 31.6 m-85 -105.77 129.79 24.07 Favored Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 16.2 Cg_exo -67.2 -167.95 0.15 Allowed 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.34 2.027 . . . . 0.0 111.596 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 90.0 m -62.86 104.61 0.56 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.0 p -144.98 137.53 26.17 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.894 0.378 . . . . 0.0 111.597 -178.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.9 m -72.53 120.59 18.35 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 177.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.443 ' HG2' ' OG ' ' A' ' 24' ' ' SER . 21.1 mmm-85 -121.45 167.2 13.96 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.559 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 72.7 Cg_exo -47.62 163.95 0.17 Allowed 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 122.726 2.284 . . . . 0.0 112.591 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.536 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 22.3 tptm -76.86 73.14 3.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.745 0.783 . . . . 0.0 109.666 -179.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 123.65 23.37 2.09 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.92 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.459 ' O ' ' HB2' ' A' ' 35' ' ' PRO . 1.3 m-90 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.481 -0.771 . . . . 0.0 111.471 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . 0.507 ' HG3' ' OD2' ' A' ' 15' ' ' ASP . 26.2 tptp . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 22.7 p -161.36 159.0 27.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.15 -178.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.577 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 69.3 mt -80.11 120.57 24.43 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.45 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.43 -155.52 0.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.506 0.669 . . . . 0.0 112.693 -178.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.431 ' OE1' ' HD3' ' A' ' 35' ' ' PRO . 12.6 tp10 -65.56 128.46 36.03 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.19 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.534 ' HB2' ' NH1' ' A' ' 34' ' ' ARG . . . 59.66 43.23 15.93 Favored 'General case' 0 CA--C 1.515 -0.386 0 O-C-N 124.144 0.902 . . . . 0.0 110.615 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -102.07 129.81 48.49 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 119.897 -0.721 . . . . 0.0 111.803 -178.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -62.73 134.37 56.19 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.221 0.534 . . . . 0.0 110.537 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.4 m -92.8 152.81 19.24 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.602 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.0 m -79.11 131.93 64.88 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.999 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.421 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 24.8 Cg_endo -62.47 -55.08 1.02 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.142 2.561 . . . . 0.0 113.771 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.421 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 12.8 m-90 -88.42 -58.27 2.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.865 0.364 . . . . 0.0 111.23 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.3 m -161.62 146.36 13.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.967 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.56 -145.47 8.02 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.985 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.507 ' OD2' ' HG3' ' A' ' 1' ' ' LYS . 0.7 OUTLIER -70.0 148.13 49.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.359 0.6 . . . . 0.0 111.447 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.2 m -99.58 150.34 22.34 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.068 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.518 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 61.3 m -63.47 141.43 58.77 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.629 0.252 . . . . 0.0 111.338 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.6 m -67.38 143.65 56.21 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.18 141.88 62.98 Favored Pre-proline 0 C--N 1.31 -1.125 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.438 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.455 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 92.1 Cg_endo -102.66 44.82 2.63 Favored 'Cis proline' 0 N--CA 1.453 -0.895 0 C-N-CA 124.073 -1.219 . . . . 0.0 114.095 1.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -81.76 148.41 28.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.229 0.538 . . . . 0.0 110.457 179.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.0 tp -119.47 139.19 52.47 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.575 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.566 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.4 t -71.1 106.19 3.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 110.401 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -88.4 130.83 35.07 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.513 179.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.9 t -136.47 63.77 1.57 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.407 0.623 . . . . 0.0 109.331 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.79 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -81.22 -168.64 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.241 -179.53 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -66.95 -60.58 2.52 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -74.07 -36.49 64.32 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -177.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.693 ' HB2' HD11 ' A' ' 26' ' ' ILE . 23.4 m-85 -103.63 124.96 36.16 Favored Pre-proline 0 C--N 1.322 -0.621 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.079 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.82 172.45 13.65 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.817 2.345 . . . . 0.0 111.966 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 88.2 m -52.41 105.38 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 O-C-N 123.468 0.48 . . . . 0.0 111.175 -179.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 p -152.73 135.23 15.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.39 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.566 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.3 m -65.86 129.06 38.45 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.538 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.534 ' NH1' ' HB2' ' A' ' 6' ' ' ALA . 34.4 mmt180 -138.04 162.18 55.45 Favored Pre-proline 0 C--N 1.327 -0.409 0 O-C-N 125.504 1.753 . . . . 0.0 107.649 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.431 ' HD3' ' OE1' ' A' ' 5' ' ' GLU . 44.1 Cg_exo -51.96 147.6 25.63 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.261 1.974 . . . . 0.0 111.728 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 32.6 ttpt -77.64 94.16 4.35 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 112.21 43.88 0.89 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 -178.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.8 p90 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.283 -0.865 . . . . 0.0 110.483 -179.334 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 83.5 tttt . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.563 ' HA ' ' O ' ' A' ' 16' ' ' SER . 28.9 p -77.7 146.97 35.68 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.469 -0.892 . . . . 0.0 110.739 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 63.2 mt -82.3 127.18 32.96 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.89 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.16 -169.75 1.72 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.89 0.376 . . . . 0.0 111.57 -179.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' A' ' 5' ' ' GLU . 10.4 pt-20 -75.12 133.24 41.57 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.395 0.616 . . . . 0.0 110.8 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.432 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 69.03 33.74 3.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.157 -1.383 . . . . 0.0 110.207 -177.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -110.48 134.81 52.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.773 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -57.37 147.42 26.03 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.094 0.473 . . . . 0.0 111.538 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.7 p -137.49 149.34 46.74 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.476 0.655 . . . . 0.0 111.288 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.0 m -79.43 125.66 82.55 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.584 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.518 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 60.2 Cg_endo -70.47 -42.21 2.83 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 123.213 2.609 . . . . 0.0 113.437 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.518 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.8 m-90 -79.28 -46.5 17.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.299 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.9 t -176.59 140.67 0.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.844 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 177.69 -160.87 27.73 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -70.04 148.81 48.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.32 0.581 . . . . 0.0 110.787 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.563 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 8.0 m -82.88 149.57 27.03 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.924 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 5.0 m -74.53 145.14 43.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.22 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.25 146.41 50.97 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.7 ptmt -79.18 142.99 59.92 Favored Pre-proline 0 C--N 1.311 -1.102 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.079 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.59 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 82.1 Cg_endo -103.55 43.33 2.8 Favored 'Cis proline' 0 N--CA 1.449 -1.089 0 C-N-CA 124.089 -1.213 . . . . 0.0 113.697 1.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.674 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 18.4 m-85 -73.37 -164.33 0.19 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 117.957 0.344 . . . . 0.0 111.223 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 24.3 tp -168.07 133.32 1.83 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.813 -0.176 . . . . 0.0 111.247 -178.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.8 t -70.21 128.39 36.1 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.508 ' OG ' ' HG2' ' A' ' 34' ' ' ARG . 22.6 p -142.53 132.02 23.74 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.805 0.336 . . . . 0.0 110.623 -178.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.436 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.7 OUTLIER -112.05 77.77 1.07 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.519 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.782 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -89.16 -169.48 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.643 -179.289 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -84.01 -50.35 8.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.765 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -63.01 -28.92 70.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.303 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.448 ' H ' HG12 ' A' ' 26' ' ' ILE . 67.6 m-85 -140.12 134.29 15.58 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.303 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 21.9 Cg_exo -64.83 -166.99 0.09 OUTLIER 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.49 2.126 . . . . 0.0 111.828 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.436 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 93.7 m -58.32 103.72 0.17 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.999 0.428 . . . . 0.0 110.082 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.6 p -151.2 141.01 21.88 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.027 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 18.8 m -74.97 123.06 24.46 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 177.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.508 ' HG2' ' OG ' ' A' ' 24' ' ' SER . 21.1 mmm-85 -119.04 162.0 33.69 Favored Pre-proline 0 C--N 1.316 -0.869 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.674 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 32.7 Cg_exo -53.35 157.52 8.92 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.37 2.046 . . . . 0.0 111.589 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 1.3 tppp? -77.72 113.68 15.83 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.46 48.72 5.49 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 -177.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.1 p90 . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.862 -179.074 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.5 p -160.52 159.14 30.36 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 123.443 0.464 . . . . 0.0 109.956 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 92.4 mt -79.63 132.13 36.17 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.745 -179.32 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.43 -166.37 0.84 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.081 0.467 . . . . 0.0 111.786 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.572 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 12.3 pt-20 -73.1 132.06 42.83 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.15 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.99 36.85 9.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.48 -178.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -100.78 137.22 39.46 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.791 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -56.59 142.14 40.62 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.969 0.414 . . . . 0.0 111.553 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 22.2 p -153.03 171.77 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.3 0.572 . . . . 0.0 111.37 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.537 ' HB2' ' O ' ' A' ' 13' ' ' SER . 66.9 m -156.51 123.79 2.71 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.507 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 32.3 Cg_exo -63.82 -29.26 68.01 Favored 'Trans proline' 0 N--CA 1.474 0.38 0 C-N-CA 123.493 2.795 . . . . 0.0 113.399 -178.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.9 m-90 -78.85 -19.62 51.58 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.003 -179.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.537 ' O ' ' HB2' ' A' ' 10' ' ' SER . 9.4 t -178.17 126.29 0.12 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.372 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 159.32 164.61 14.89 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.92 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.88 158.01 29.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.062 0.458 . . . . 0.0 110.63 179.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.1 m -79.62 141.98 36.02 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.668 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.576 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 19.8 m -74.17 141.68 45.5 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.9 m -64.36 146.02 55.11 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 60.9 pttt -78.44 141.62 61.44 Favored Pre-proline 0 C--N 1.311 -1.09 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.571 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 79.6 Cg_endo -103.49 37.25 5.0 Favored 'Cis proline' 0 N--CA 1.453 -0.902 0 C-N-CA 123.906 -1.289 . . . . 0.0 113.779 1.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.944 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 58.2 m-85 -69.39 159.51 33.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.902 0.382 . . . . 0.0 110.773 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.584 HD23 ' HE1' ' A' ' 38' ' ' TRP . 36.8 tp -132.85 130.19 39.44 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.6 t -69.79 124.98 25.39 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.3 p -148.31 145.27 28.08 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.745 0.307 . . . . 0.0 110.845 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.427 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -113.17 65.78 0.65 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.873 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.887 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -82.28 -170.2 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.349 -178.762 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -83.16 -50.47 8.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.017 -178.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -59.96 -32.51 70.88 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.649 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -141.81 134.65 14.05 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.06 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.19 -160.75 0.05 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.293 1.995 . . . . 0.0 111.811 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.427 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 90.1 m -59.14 98.51 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.816 0.341 . . . . 0.0 110.104 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.442 ' O ' ' HG2' ' A' ' 34' ' ' ARG . 6.2 p -155.5 144.42 20.66 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.672 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 32.9 m -70.08 110.05 4.91 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.749 -1.574 . . . . 0.0 106.749 177.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.645 ' HB2' ' CD1' ' A' ' 38' ' ' TRP . 12.2 mmm-85 -101.73 167.15 11.0 Favored Pre-proline 0 C--N 1.313 -1.001 0 O-C-N 124.143 0.902 . . . . 0.0 108.632 -178.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.944 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 17.8 Cg_endo -59.81 166.17 8.86 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 121.822 1.681 . . . . 0.0 111.267 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 20.9 tptm -78.22 75.13 4.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.839 0.828 . . . . 0.0 109.428 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.84 47.55 0.05 OUTLIER Glycine 0 N--CA 1.447 -0.626 0 CA-C-N 114.019 -1.446 . . . . 0.0 109.549 -177.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.645 ' CD1' ' HB2' ' A' ' 34' ' ' ARG . 6.8 p-90 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.056 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.6 pttt . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p -161.32 159.79 28.91 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 123.285 0.365 . . . . 0.0 110.204 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 75.2 mt -79.18 126.25 30.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.457 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.403 ' HB1' ' OE1' ' A' ' 5' ' ' GLU . . . -78.9 -166.9 0.98 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.99 0.424 . . . . 0.0 112.043 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.582 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.6 pm0 -67.56 129.95 41.5 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.502 0.668 . . . . 0.0 111.482 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 66.88 39.01 3.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.947 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.466 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -105.38 133.17 50.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.919 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -60.78 136.93 58.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.112 0.482 . . . . 0.0 111.107 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.6 m -91.07 155.43 18.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.273 0.559 . . . . 0.0 111.074 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 25.1 p -79.12 132.06 64.48 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.616 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -63.3 -41.08 28.65 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 123.035 2.49 . . . . 0.0 113.62 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.3 m-90 -129.57 -43.16 1.27 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.7 t -149.56 141.24 23.54 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.92 -139.38 5.61 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 111.519 -0.632 . . . . 0.0 111.519 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.64 150.43 20.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.116 0.484 . . . . 0.0 111.196 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 m -94.45 150.02 20.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.918 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.509 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 60.2 m -64.34 142.38 58.44 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.609 0.242 . . . . 0.0 111.593 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 70.9 m -68.8 142.34 54.91 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.521 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.14 144.28 62.6 Favored Pre-proline 0 C--N 1.315 -0.934 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.534 -179.575 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.472 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 89.2 Cg_endo -100.89 32.47 9.24 Favored 'Cis proline' 0 N--CA 1.451 -0.997 0 C-N-CA 123.334 -1.527 . . . . 0.0 113.479 1.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.582 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 28.1 m-85 -65.63 148.02 52.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.136 0.493 . . . . 0.0 110.455 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.6 tp -122.39 138.23 54.6 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.865 -178.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 48.8 t -69.04 112.71 5.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.02 0.438 . . . . 0.0 109.986 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.431 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 83.9 p -89.44 121.47 31.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.287 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.0 m -119.97 52.29 1.13 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.493 HG13 ' H ' ' A' ' 29' ' ' TYR . 12.3 pt -81.78 -170.76 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.658 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -72.98 -59.71 2.58 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -177.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -71.68 -32.24 67.65 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.493 ' H ' HG13 ' A' ' 26' ' ' ILE . 53.2 m-85 -111.5 124.31 32.86 Favored Pre-proline 0 C--N 1.321 -0.662 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.088 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.01 166.33 29.48 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.848 2.365 . . . . 0.0 111.595 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 24' ' ' SER . 92.0 m -49.48 104.35 0.06 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.547 0.689 . . . . 0.0 112.046 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.526 ' O ' ' HD3' ' A' ' 34' ' ' ARG . 6.7 p -153.57 137.9 16.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.33 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.3 m -65.42 119.93 11.9 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.526 ' HD3' ' O ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -118.72 159.22 45.13 Favored Pre-proline 0 C--N 1.324 -0.536 0 O-C-N 124.386 1.053 . . . . 0.0 108.223 179.835 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.548 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 50.0 Cg_exo -52.66 159.81 4.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.5 2.133 . . . . 0.0 112.48 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.472 ' HD3' ' O ' ' A' ' 20' ' ' PRO . 49.3 tptt -77.48 109.91 11.81 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.65 46.96 5.01 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 -177.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 16.7 p90 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.679 -179.204 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.2 tttt . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.0 p -161.3 158.07 26.49 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.484 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 71.0 mt -80.82 122.12 26.79 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.559 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.09 -162.44 0.39 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.155 0.502 . . . . 0.0 111.976 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.568 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 8.8 pm0 -63.75 126.17 26.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.573 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.79 45.54 4.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.467 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.461 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -115.61 120.83 40.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.631 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.538 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.2 m-20 -50.99 129.72 24.24 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.188 0.518 . . . . 0.0 112.282 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.89 147.94 30.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.3 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.4 m -78.99 130.57 69.51 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.19 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.478 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 40.0 Cg_endo -66.16 -52.21 0.94 Allowed 'Trans proline' 0 N--CA 1.472 0.216 0 C-N-CA 123.141 2.561 . . . . 0.0 113.604 -178.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.478 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 12.7 m-90 -79.98 -56.31 4.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.76 0.314 . . . . 0.0 111.396 -178.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.7 m -161.8 140.66 9.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.579 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 175.27 -153.85 16.46 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.506 -0.637 . . . . 0.0 111.506 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -70.16 143.21 52.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.999 0.428 . . . . 0.0 110.678 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.6 m -88.48 147.52 24.62 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.604 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.1 m -69.3 144.53 53.53 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.27 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 83.3 m -66.53 145.79 55.24 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.711 ' HD2' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.19 139.72 56.58 Favored Pre-proline 0 C--N 1.307 -1.239 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.274 -179.473 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.549 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 74.9 Cg_endo -103.04 36.37 5.63 Favored 'Cis proline' 0 N--CA 1.456 -0.732 0 C-N-CA 124.188 -1.172 . . . . 0.0 114.083 1.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.568 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 62.5 m-85 -66.98 147.5 53.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.324 0.583 . . . . 0.0 110.855 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.5 tp -116.47 135.42 53.85 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.168 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.4 t -70.37 124.63 24.64 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -132.12 134.67 45.72 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.903 0.382 . . . . 0.0 111.143 -178.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.419 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -113.16 85.54 2.2 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 179.663 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.82 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -79.84 -171.47 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.887 -178.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -71.91 -69.84 0.37 Allowed 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -177.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -69.19 -41.28 77.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.959 0.409 . . . . 0.0 111.885 -177.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.438 ' O ' HG12 ' A' ' 26' ' ' ILE . 46.7 m-85 -97.71 135.56 21.55 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.125 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.59 -171.26 0.37 Allowed 'Trans proline' 0 C--O 1.238 0.487 0 C-N-CA 122.474 2.116 . . . . 0.0 112.692 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.419 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 75.7 m -61.14 106.02 0.56 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.135 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 4.5 p -144.32 138.63 28.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.074 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 12.7 m -66.1 130.23 42.51 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.995 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.402 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 24.4 mmt85 -128.38 161.51 56.31 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 52.0 Cg_exo -51.25 154.37 8.16 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 122.531 2.154 . . . . 0.0 112.314 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 6.9 tmtm? -78.12 71.54 4.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.58 43.9 0.13 Allowed Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.088 -1.415 . . . . 0.0 109.663 -177.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 13.0 p90 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.972 -178.797 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 81.9 tttt . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.8 p -76.97 146.23 37.6 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 118.889 -1.125 . . . . 0.0 110.88 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 9' ' ' CYS . 90.4 mt -78.83 137.78 37.86 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.096 -1.411 . . . . 0.0 110.518 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.78 -178.87 5.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.43 ' HB3' ' CZ ' ' A' ' 21' ' ' TYR . 19.6 pt-20 -69.99 134.84 48.74 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.041 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . . . 56.48 40.15 29.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.311 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.45 135.8 52.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.151 -179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -57.02 141.57 45.24 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.501 0.501 . . . . 0.0 109.881 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.548 ' HA ' HD13 ' A' ' 3' ' ' LEU . 32.4 m -79.11 163.76 24.83 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.103 0.478 . . . . 0.0 110.982 -178.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.484 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 28.8 p -78.62 115.31 50.68 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.314 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 5.9 Cg_exo -79.13 -56.57 0.04 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.994 2.463 . . . . 0.0 112.348 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 23.8 m-90 -85.41 -40.49 16.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.12 0.486 . . . . 0.0 110.57 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.0 m -87.9 -163.58 0.97 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.243 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -160.08 129.37 2.17 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.136 -1.03 . . . . 0.0 112.412 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -159.41 152.53 22.13 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.615 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 5.9 m -88.14 147.08 25.08 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.985 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.411 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 8.4 m -74.54 145.12 43.7 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.426 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 58.8 m -60.77 144.29 52.74 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.36 144.18 65.81 Favored Pre-proline 0 C--N 1.312 -1.028 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -99.0 52.31 1.36 Allowed 'Cis proline' 0 N--CA 1.454 -0.821 0 C-N-CA 124.065 -1.223 . . . . 0.0 113.905 1.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 5' ' ' GLU . 37.8 m-85 -105.15 145.98 29.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.056 0.455 . . . . 0.0 110.316 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.7 tp -127.91 143.31 51.1 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.76 -178.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 41.9 t -66.48 122.07 16.74 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.1 p -126.33 139.92 52.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.324 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.9 t -135.58 96.3 3.42 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.641 HD11 ' HB2' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -109.59 -168.02 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.911 -179.251 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -70.73 -59.44 2.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -73.65 -34.55 65.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.847 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.641 ' HB2' HD11 ' A' ' 26' ' ' ILE . 8.1 m-85 -109.18 128.15 25.96 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.943 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.04 177.3 5.21 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.887 2.391 . . . . 0.0 112.036 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 98.4 m -58.53 102.13 0.1 Allowed 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.48 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.3 p -153.56 140.91 19.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.609 -179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 25.2 m -71.17 127.58 33.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 6' ' ' ALA . 23.8 mmt180 -132.71 164.67 42.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 72.6 Cg_exo -46.47 139.96 12.37 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.139 1.893 . . . . 0.0 111.532 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -76.96 103.21 6.77 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.92 45.09 2.13 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.777 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.8 p90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.437 -179.505 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.486 ' HB3' ' HE2' ' A' ' 1' ' ' LYS . 28.0 mtpt . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.621 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.9 p -160.82 149.71 16.66 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.296 0.569 . . . . 0.0 110.527 178.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 98.3 mt -85.53 136.11 33.55 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.332 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.38 -171.5 2.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.025 0.44 . . . . 0.0 111.609 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.474 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 10.9 pt-20 -74.32 137.56 42.94 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.347 0.594 . . . . 0.0 111.272 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 62.69 38.39 12.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.741 -178.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.78 139.39 44.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.311 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -60.73 149.59 35.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.928 0.394 . . . . 0.0 110.775 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.0 p -153.25 -170.63 3.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.125 0.488 . . . . 0.0 111.093 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.7 m -154.57 144.35 15.44 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.377 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.77 -36.65 91.26 Favored 'Trans proline' 0 CA--C 1.53 0.308 0 C-N-CA 123.547 2.832 . . . . 0.0 113.732 -178.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 9.3 m-90 -128.41 -54.28 1.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.023 0.439 . . . . 0.0 111.579 -179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 t -80.17 61.59 4.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.622 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -167.88 150.55 16.82 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.232 -0.985 . . . . 0.0 112.788 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.06 156.64 24.26 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.814 0.34 . . . . 0.0 110.429 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.621 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 4.5 m -78.2 143.22 37.36 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 4.9 m -76.82 141.34 40.73 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.349 -178.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 55.5 m -60.65 146.82 44.13 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 24.1 mmmt -83.31 150.98 61.82 Favored Pre-proline 0 C--N 1.31 -1.114 0 C-N-CA 120.13 -0.628 . . . . 0.0 109.81 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.409 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 96.1 Cg_endo -95.45 40.06 4.57 Favored 'Cis proline' 0 N--CA 1.45 -1.039 0 C-N-CA 123.205 -1.581 . . . . 0.0 114.085 1.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.474 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 29.6 m-85 -84.36 163.36 19.61 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 121.983 -0.448 . . . . 0.0 110.533 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 48.1 tp -138.37 141.55 39.65 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.502 -178.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 46.7 t -74.12 84.59 1.83 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.668 0.747 . . . . 0.0 110.118 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.649 ' OG ' ' HG3' ' A' ' 34' ' ' ARG . 33.4 p -81.15 136.82 35.93 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.318 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.9 t -136.84 69.29 1.41 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.28 0.562 . . . . 0.0 109.77 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.807 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -84.61 -172.4 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.243 -179.744 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -74.52 -51.83 13.62 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.344 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -73.42 -23.08 60.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.763 -178.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.589 ' HB2' HD11 ' A' ' 26' ' ' ILE . 87.3 m-85 -130.67 120.2 18.56 Favored Pre-proline 0 C--N 1.324 -0.532 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.399 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.73 175.02 3.2 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.988 2.458 . . . . 0.0 112.541 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 84.3 m -51.89 106.75 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.275 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.6 p -155.16 137.12 14.57 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.032 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 14.3 m -74.01 128.71 36.23 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 179.478 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.649 ' HG3' ' OG ' ' A' ' 24' ' ' SER . 5.8 mtp180 -142.73 163.87 35.92 Favored Pre-proline 0 C--N 1.318 -0.768 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.436 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 82.8 Cg_exo -46.59 141.57 10.85 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.502 2.135 . . . . 0.0 111.936 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.405 ' HE3' ' HB3' ' A' ' 36' ' ' LYS . 8.6 ttpp -77.05 106.41 8.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.984 0.421 . . . . 0.0 109.905 -179.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.21 46.16 2.88 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.8 p90 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.386 -0.816 . . . . 0.0 110.59 -179.491 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.548 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 9.1 mtpm? . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p -160.83 156.61 25.39 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.357 0.41 . . . . 0.0 110.194 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.501 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 88.3 mt -79.95 130.11 35.02 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.3 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.27 -158.38 0.15 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.357 0.599 . . . . 0.0 111.962 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.615 ' HG3' ' CE2' ' A' ' 21' ' ' TYR . 15.0 mp0 -69.97 132.82 46.53 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.209 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 58.91 45.22 15.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.367 179.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.462 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -113.76 124.75 53.0 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.656 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.6 p30 -57.84 140.78 51.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.771 0.32 . . . . 0.0 110.711 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 17.4 p -114.32 -173.42 2.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.61 0.719 . . . . 0.0 112.022 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.517 ' HB2' ' HA3' ' A' ' 14' ' ' GLY . 75.3 m -153.88 143.67 15.3 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.471 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.64 -39.5 87.46 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.249 2.632 . . . . 0.0 113.641 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -137.17 -53.22 0.68 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.875 0.369 . . . . 0.0 111.278 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m -76.7 56.06 1.12 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.95 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.517 ' HA3' ' HB2' ' A' ' 10' ' ' SER . . . -173.56 148.29 10.1 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.508 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.548 ' OD2' ' HB3' ' A' ' 1' ' ' LYS . 69.1 m-20 -62.61 151.47 37.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.014 0.435 . . . . 0.0 110.946 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.3 m -79.69 151.47 30.46 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.501 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 60.5 m -64.19 141.27 58.83 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 121.272 -0.171 . . . . 0.0 110.656 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.1 m -64.87 146.5 54.82 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 177.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.8 ptmt -78.62 142.27 61.49 Favored Pre-proline 0 C--N 1.309 -1.17 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.879 -178.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.506 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 87.7 Cg_endo -101.97 35.11 6.82 Favored 'Cis proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.95 -1.271 . . . . 0.0 113.55 0.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.615 ' CE2' ' HG3' ' A' ' 5' ' ' GLU . 40.4 m-85 -69.62 155.09 41.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.218 0.532 . . . . 0.0 111.041 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.8 tp -131.64 136.17 47.52 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.716 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 16.4 t -74.03 125.1 27.54 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.7 p -126.34 133.21 51.42 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.051 0.453 . . . . 0.0 110.677 -178.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.7 m -99.54 72.66 1.79 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.352 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.806 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -79.89 -175.39 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.032 0.444 . . . . 0.0 111.16 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -82.05 -48.79 10.97 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.787 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -65.74 -26.09 67.57 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.579 -178.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.423 ' H ' HG12 ' A' ' 26' ' ' ILE . 96.4 m-85 -143.61 136.81 13.94 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.296 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.72 -175.89 0.39 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.487 2.125 . . . . 0.0 111.787 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 62.9 m -52.65 105.6 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.073 0.463 . . . . 0.0 110.996 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 6.0 p -148.81 141.84 24.86 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.053 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.7 m -64.23 126.61 28.32 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.123 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.576 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 23.5 mmt180 -129.5 165.01 35.85 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.576 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 9.4 Cg_endo -56.65 154.32 31.66 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 121.687 1.591 . . . . 0.0 111.66 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 19.1 tptm -77.61 114.62 16.63 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.66 46.47 7.27 Favored Glycine 0 N--CA 1.448 -0.54 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 -177.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.8 p90 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.652 -179.147 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.8 pptp? . . . . . 0 N--CA 1.483 1.181 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.1 p -126.69 155.68 42.27 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.023 0.44 . . . . 0.0 110.443 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.3 mt -86.41 123.77 32.01 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.763 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.32 -164.95 0.61 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.987 0.422 . . . . 0.0 111.236 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.422 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 7.1 pt-20 -74.03 131.97 41.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.393 0.616 . . . . 0.0 110.941 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 70.35 35.52 2.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.156 -1.384 . . . . 0.0 110.242 -177.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.419 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -105.57 131.59 52.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.93 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -62.34 131.64 49.97 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 123.283 0.364 . . . . 0.0 110.306 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.42 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 8.6 m -88.41 155.13 19.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.316 0.579 . . . . 0.0 110.858 -179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.2 m -79.55 128.14 75.93 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.856 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.29 -57.04 1.02 Allowed 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 123.258 2.639 . . . . 0.0 113.998 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.9 m-90 -89.97 -56.01 3.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.866 0.365 . . . . 0.0 111.554 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 m -159.69 146.16 16.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.976 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 178.17 -147.01 7.77 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.876 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -79.61 141.47 36.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.941 0.4 . . . . 0.0 110.842 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.8 m -83.89 154.37 23.46 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.899 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.447 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.7 m -66.45 141.68 57.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.578 0.228 . . . . 0.0 111.015 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.4 m -66.4 145.4 55.73 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 177.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.433 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 25.3 pttm -78.87 141.01 58.69 Favored Pre-proline 0 C--N 1.31 -1.144 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.254 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.475 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 73.9 Cg_endo -103.82 37.55 4.75 Favored 'Cis proline' 0 N--CA 1.451 -0.973 0 C-N-CA 123.916 -1.285 . . . . 0.0 113.919 1.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.747 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 50.5 m-85 -70.54 158.87 35.34 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.964 0.412 . . . . 0.0 110.499 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.7 tp -133.33 135.12 44.59 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.148 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.626 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.6 t -72.16 129.11 37.69 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.0 p -135.98 127.65 29.0 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.644 -178.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 14.8 m -100.08 72.93 1.69 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.528 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.811 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -82.11 -170.91 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.112 0.482 . . . . 0.0 111.141 -179.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -85.55 -48.97 8.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.621 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -65.79 -25.27 67.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.406 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.461 ' HB2' HD11 ' A' ' 26' ' ' ILE . 83.5 m-85 -141.42 138.22 17.32 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 17.1 Cg_exo -66.23 -165.12 0.09 OUTLIER 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.394 2.063 . . . . 0.0 111.595 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 80.0 m -62.43 99.17 0.13 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.906 0.384 . . . . 0.0 110.142 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.408 ' OG ' ' HD3' ' A' ' 34' ' ' ARG . 3.2 p -135.98 142.06 44.48 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.394 -178.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.626 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 22.3 m -73.66 118.49 16.68 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 177.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.408 ' HD3' ' OG ' ' A' ' 32' ' ' SER . 18.8 mmm-85 -122.86 160.14 50.51 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.747 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 51.2 Cg_exo -50.93 148.26 17.19 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.072 1.848 . . . . 0.0 111.198 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.475 ' HE3' ' O ' ' A' ' 20' ' ' PRO . 37.1 ttmt -76.94 116.43 17.6 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.34 45.55 5.83 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -177.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 15.5 p90 . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.731 -179.131 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.0 p -160.65 161.68 32.47 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.365 0.416 . . . . 0.0 110.394 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.478 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 81.9 mt -79.3 134.39 36.62 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.356 -179.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.41 -166.04 0.79 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.309 0.576 . . . . 0.0 112.011 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.404 ' OE2' ' HG3' ' A' ' 35' ' ' PRO . 42.6 tt0 -71.1 134.3 46.91 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.762 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.09 42.5 12.37 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.666 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.16 136.31 48.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.201 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.401 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.1 p30 -58.58 147.41 32.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.88 0.372 . . . . 0.0 111.149 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.7 p -146.07 159.08 43.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.389 0.614 . . . . 0.0 111.682 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 71.6 m -157.42 146.16 14.61 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.468 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.31 -42.98 57.11 Favored 'Trans proline' 0 CA--C 1.529 0.236 0 C-N-CA 123.606 2.871 . . . . 0.0 113.229 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -111.28 -50.85 2.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.131 0.491 . . . . 0.0 110.683 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.0 t -85.9 52.66 2.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.893 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -169.5 145.65 9.5 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.117 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -82.25 -177.84 6.8 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -85.23 141.7 29.94 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.573 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 56.3 m -73.09 141.38 47.56 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.476 0.179 . . . . 0.0 110.551 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.5 m -66.5 140.41 58.0 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 177.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.669 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.8 OUTLIER -78.54 148.53 73.57 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -179.575 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.468 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.5 Cg_endo -98.08 38.67 5.46 Favored 'Cis proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.182 -1.591 . . . . 0.0 113.924 1.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -81.91 147.89 29.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.027 0.441 . . . . 0.0 110.502 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 54.1 tp -118.75 140.97 49.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.245 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.573 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 40.9 t -72.61 104.11 3.78 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 76.8 p -98.4 139.62 33.88 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.449 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.0 t -140.3 63.25 1.48 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.378 0.609 . . . . 0.0 109.489 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.793 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -85.01 -167.05 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.26 -179.678 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -69.52 -59.29 3.07 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -71.41 -35.4 70.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.683 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.711 ' HB2' HD11 ' A' ' 26' ' ' ILE . 15.5 m-85 -109.4 123.57 36.27 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.831 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -71.35 172.89 13.24 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 122.741 2.294 . . . . 0.0 111.414 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.2 m -51.31 103.16 0.05 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.991 0.424 . . . . 0.0 111.148 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.7 p -160.13 137.08 9.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.644 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.9 m -67.01 127.54 32.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.719 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -134.26 162.16 59.38 Favored Pre-proline 0 C--N 1.324 -0.534 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.404 ' HG3' ' OE2' ' A' ' 5' ' ' GLU . 49.9 Cg_exo -50.9 147.92 17.8 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.116 1.877 . . . . 0.0 111.58 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 35.4 ttpt -77.16 113.97 15.47 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.66 46.76 4.48 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 28.7 p90 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.559 -179.381 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.7 mtmm . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.526 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.1 p -150.45 149.54 30.14 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.191 0.519 . . . . 0.0 110.302 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.553 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 80.0 mt -79.89 135.08 36.35 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.386 -178.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.15 -168.62 1.34 Allowed 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.482 ' OE2' ' HG3' ' A' ' 35' ' ' PRO . 40.0 tt0 -70.61 135.01 48.1 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.007 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.11 43.26 11.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.726 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.54 127.24 53.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.741 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.451 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 5.6 t70 -57.01 132.72 53.73 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.553 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 30.4 p -94.47 170.21 9.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.832 0.825 . . . . 0.0 112.509 -178.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.9 p -78.89 120.27 80.25 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.952 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.471 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 38.0 Cg_endo -66.95 -46.08 3.56 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 122.948 2.432 . . . . 0.0 112.903 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.471 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 11.1 m-90 -91.36 -53.97 4.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.707 0.289 . . . . 0.0 111.268 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.3 t -173.21 148.57 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.233 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.7 -153.25 22.84 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.298 -0.721 . . . . 0.0 111.298 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -74.34 138.49 43.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.126 0.488 . . . . 0.0 110.368 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.526 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.8 m -83.14 156.46 23.25 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.353 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.502 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 31.1 m -63.84 143.94 57.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.81 -0.177 . . . . 0.0 110.695 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.0 m -63.4 145.21 56.07 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt -78.47 145.4 67.68 Favored Pre-proline 0 C--N 1.312 -1.043 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.314 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.696 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 90.0 Cg_endo -99.67 28.6 14.38 Favored 'Cis proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.023 -1.657 . . . . 0.0 113.583 1.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -64.85 153.0 41.45 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.312 0.577 . . . . 0.0 111.57 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 44.7 tp -131.68 140.74 49.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.187 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.66 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 16.6 t -75.3 120.51 20.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.998 0.428 . . . . 0.0 110.028 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.4 p -110.72 126.8 54.94 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.412 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 58.7 m -101.79 68.97 1.18 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.411 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.847 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -80.96 -172.97 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.998 0.428 . . . . 0.0 111.289 -179.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -86.17 -49.22 7.9 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.944 -178.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -66.14 -25.28 66.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.618 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.464 ' HB2' HD11 ' A' ' 26' ' ' ILE . 88.5 m-85 -139.11 138.23 20.62 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.935 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.15 -174.59 0.33 Allowed 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.448 2.099 . . . . 0.0 111.857 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 79.6 m -59.38 99.91 0.07 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.109 0.481 . . . . 0.0 110.503 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.451 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 3.9 p -139.1 138.51 37.12 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.202 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.66 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -65.48 127.44 31.84 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.649 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.462 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 25.6 mmt180 -130.37 164.77 38.83 Favored Pre-proline 0 C--N 1.324 -0.542 0 O-C-N 124.622 1.201 . . . . 0.0 107.88 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.482 ' HG3' ' OE2' ' A' ' 5' ' ' GLU . 32.4 Cg_exo -51.03 153.7 8.51 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.316 2.01 . . . . 0.0 112.02 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.696 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 40.3 tttp -77.65 114.52 16.58 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.0 47.84 5.39 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -177.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.3 p90 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.709 -179.335 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.551 ' HE2' ' OD2' ' A' ' 15' ' ' ASP . 9.2 mmmm . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.5 p -161.92 153.57 18.75 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.052 0.453 . . . . 0.0 110.827 178.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.9 mt -80.99 134.67 35.73 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.891 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.48 -168.56 1.39 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.143 0.497 . . . . 0.0 111.665 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.627 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 9.3 pt-20 -73.13 135.56 44.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.551 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.534 ' HA ' ' HD2' ' A' ' 34' ' ' ARG . . . 62.92 44.56 6.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.906 -178.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -119.51 127.76 53.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.535 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -52.86 135.26 36.38 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.5 p -111.93 -176.38 2.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 122.093 0.949 . . . . 0.0 113.059 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.433 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 58.6 m -157.85 144.49 13.07 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 114.544 -1.207 . . . . 0.0 109.366 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.508 ' HB2' ' CE3' ' A' ' 12' ' ' TRP . 24.1 Cg_exo -62.52 -43.88 20.21 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.799 2.333 . . . . 0.0 112.725 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.508 ' CE3' ' HB2' ' A' ' 11' ' ' PRO . 11.5 m-90 -136.53 -34.2 0.77 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.768 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 p -77.77 44.79 0.47 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 171.41 160.49 20.08 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.18 -1.009 . . . . 0.0 112.648 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.551 ' OD2' ' HE2' ' A' ' 1' ' ' LYS . 64.7 m-20 -60.96 153.1 25.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.922 0.391 . . . . 0.0 110.827 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.429 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.6 m -79.49 149.82 31.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 55.9 m -61.75 140.61 58.2 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.407 0.146 . . . . 0.0 111.219 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.7 m -64.81 144.35 57.31 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.8 pttp -78.14 142.27 63.67 Favored Pre-proline 0 C--N 1.312 -1.045 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.643 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.509 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 76.8 Cg_endo -102.74 38.22 4.82 Favored 'Cis proline' 0 N--CA 1.455 -0.774 0 C-N-CA 123.948 -1.271 . . . . 0.0 113.901 1.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.627 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 38.0 m-85 -74.0 143.67 45.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.352 0.596 . . . . 0.0 110.824 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.1 tp -115.04 138.66 50.61 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.008 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.682 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.8 t -73.23 103.41 3.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.581 0.705 . . . . 0.0 110.53 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 52.3 p -80.38 132.6 35.79 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.87 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.2 t -143.25 53.92 1.35 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.454 0.645 . . . . 0.0 109.384 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.636 HG12 ' HB2' ' A' ' 29' ' ' TYR . 28.7 pt -85.79 -165.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.622 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -63.48 -56.48 15.75 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -79.83 -31.9 40.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.98 0.419 . . . . 0.0 112.117 -178.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.636 ' HB2' HG12 ' A' ' 26' ' ' ILE . 3.1 m-85 -102.66 111.06 64.44 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.613 -179.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -65.86 162.57 34.37 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.766 2.311 . . . . 0.0 110.425 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 27.8 m -48.64 97.93 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.119 0.485 . . . . 0.0 111.924 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 p -153.92 139.01 17.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.539 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.682 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -65.68 120.37 12.85 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.534 ' HD2' ' HA ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -123.58 158.06 60.33 Favored Pre-proline 0 C--N 1.321 -0.636 0 O-C-N 124.624 1.203 . . . . 0.0 107.877 179.923 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.446 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 50.2 Cg_exo -53.38 154.57 14.56 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.216 1.944 . . . . 0.0 111.644 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 1.6 tmtp? -77.09 108.49 10.2 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.01 46.47 3.35 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.6 p90 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.385 -0.816 . . . . 0.0 110.672 -179.355 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.633 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 7.4 p -160.87 158.15 27.82 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 123.84 0.713 . . . . 0.0 109.306 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 70.8 mt -79.61 119.33 22.41 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.251 -0.432 . . . . 0.0 109.958 -179.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.31 -163.41 0.44 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.034 0.445 . . . . 0.0 111.575 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.407 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 6.9 pt-20 -72.28 134.08 45.37 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.335 0.588 . . . . 0.0 110.936 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 68.71 37.53 2.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.416 -177.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -107.19 128.74 54.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.078 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -58.93 133.72 56.31 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.325 0.391 . . . . 0.0 111.104 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 m -93.8 153.46 18.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.317 0.58 . . . . 0.0 110.453 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.4 m -79.52 129.89 70.06 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.916 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.406 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 19.3 Cg_endo -59.8 -57.31 0.86 Allowed 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 123.277 2.651 . . . . 0.0 113.968 -178.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.406 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 19.8 m-90 -82.12 -50.61 8.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.827 0.346 . . . . 0.0 111.296 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.1 t -175.22 150.21 1.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.01 -144.55 5.16 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.948 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.633 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 0.1 OUTLIER -79.13 157.93 27.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.265 0.555 . . . . 0.0 111.671 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.6 m -93.22 150.61 20.37 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.199 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.443 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.1 m -71.27 144.09 50.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.097 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.9 m -64.68 147.92 52.05 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.3 137.8 60.1 Favored Pre-proline 0 C--N 1.314 -0.972 0 CA-C-O 120.796 0.332 . . . . 0.0 110.941 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.631 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 69.1 Cg_endo -104.89 37.09 4.59 Favored 'Cis proline' 0 N--CA 1.454 -0.843 0 C-N-CA 124.346 -1.106 . . . . 0.0 113.72 0.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.657 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 41.7 m-85 -71.14 143.19 50.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.223 0.535 . . . . 0.0 110.649 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 tp -117.26 139.65 50.54 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.795 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.685 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.1 t -74.08 116.09 14.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.038 0.447 . . . . 0.0 109.798 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 84.2 p -107.95 143.47 36.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.656 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -143.3 58.43 1.4 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.481 HG13 ' H ' ' A' ' 29' ' ' TYR . 38.0 pt -84.55 -162.73 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.341 -179.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -67.38 -62.66 1.31 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.709 -178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -72.71 -41.76 64.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.607 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.481 ' H ' HG13 ' A' ' 26' ' ' ILE . 3.2 m-85 -95.99 120.87 62.21 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.747 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -73.69 172.46 15.74 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.562 2.175 . . . . 0.0 110.98 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.9 m -52.32 99.25 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.0 0.429 . . . . 0.0 111.196 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.8 p -160.07 143.49 13.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.739 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.685 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.0 m -69.43 132.04 45.72 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -133.93 161.49 63.42 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.657 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 50.9 Cg_exo -51.39 153.19 10.52 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.434 2.09 . . . . 0.0 111.918 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.631 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 59.4 tttm -77.32 103.56 7.33 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.74 46.71 2.64 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 -177.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.6 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.819 -179.198 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.5 p -160.14 154.78 24.05 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.002 0.429 . . . . 0.0 110.15 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 85.8 mt -79.85 132.82 36.19 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.077 -179.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.16 -179.55 6.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.697 0.284 . . . . 0.0 110.675 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.429 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 11.5 pt-20 -70.79 141.53 51.39 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.29 0.567 . . . . 0.0 110.807 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 66.45 45.43 2.14 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.389 -177.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -132.09 124.23 28.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.898 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.617 ' OD1' ' HB3' ' A' ' 32' ' ' SER . 36.0 m-20 -56.97 131.09 48.75 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 123.418 0.449 . . . . 0.0 110.835 -179.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.509 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 31.8 p -91.08 169.62 10.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.641 0.734 . . . . 0.0 112.072 -178.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.5 m -81.77 125.05 78.93 Favored Pre-proline 0 C--N 1.319 -0.724 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.276 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.455 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 38.8 Cg_endo -67.61 -51.96 0.63 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.86 2.373 . . . . 0.0 113.575 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.455 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 14.7 m-90 -82.06 -52.38 7.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.712 0.291 . . . . 0.0 111.334 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.3 t -174.18 148.14 1.29 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.117 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 169.34 -151.78 18.26 Favored Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -72.28 141.94 48.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.387 0.613 . . . . 0.0 110.462 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.0 m -85.65 154.51 21.63 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.842 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 33.4 m -67.79 139.37 56.62 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.7 m -61.69 147.52 45.75 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.726 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -78.77 144.7 65.0 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.135 -179.965 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 87.0 Cg_endo -101.66 34.95 7.05 Favored 'Cis proline' 0 N--CA 1.45 -1.037 0 C-N-CA 123.438 -1.484 . . . . 0.0 113.507 1.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.52 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 43.0 m-85 -73.35 174.96 7.37 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.112 0.482 . . . . 0.0 111.339 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.589 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 49.6 tp -152.7 142.44 21.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.136 -178.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.675 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 18.0 t -75.85 112.03 11.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.349 0.595 . . . . 0.0 110.608 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.4 p -101.68 137.4 40.04 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.01 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.9 t -129.91 71.79 1.46 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.29 0.567 . . . . 0.0 109.906 -179.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.743 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -90.42 -167.98 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.93 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -75.91 -52.92 9.26 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.245 -178.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -70.8 -25.83 63.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.177 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HB2' HD11 ' A' ' 26' ' ' ILE . 32.4 m-85 -128.94 128.34 23.41 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.633 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.92 179.23 2.86 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.756 2.304 . . . . 0.0 111.757 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 87.3 m -57.61 95.52 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.157 0 O-C-N 123.301 0.375 . . . . 0.0 110.492 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.617 ' HB3' ' OD1' ' A' ' 8' ' ' ASP . 8.7 p -144.57 142.21 30.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.193 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.675 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -70.78 129.67 39.71 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -139.05 163.9 42.94 Favored Pre-proline 0 C--N 1.318 -0.796 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.52 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 52.6 Cg_exo -49.67 141.73 26.39 Favored 'Trans proline' 0 N--CA 1.464 -0.234 0 C-N-CA 121.99 1.793 . . . . 0.0 111.122 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.589 ' HE2' ' HB2' ' A' ' 22' ' ' LEU . 30.3 ttmt -77.94 123.56 26.93 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.75 43.51 6.79 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -178.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 15.8 p90 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.41 -0.805 . . . . 0.0 110.46 -179.484 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.3 p -159.3 151.24 20.73 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.463 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.492 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 87.4 mt -86.46 121.59 29.22 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.725 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.79 -162.18 0.35 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.256 0.55 . . . . 0.0 112.216 -178.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.468 ' H ' ' CD ' ' A' ' 5' ' ' GLU . 8.4 pm0 -64.06 125.71 25.36 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.792 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.74 45.45 5.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.277 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.469 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -111.38 117.75 33.95 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.785 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.551 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 1.2 m-20 -56.68 131.66 49.68 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.379 0.609 . . . . 0.0 111.614 -179.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.434 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 2.7 m -83.1 154.92 24.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.439 -178.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.2 m -79.1 130.56 69.15 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.907 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.45 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 29.2 Cg_endo -63.83 -55.29 0.69 Allowed 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.021 2.481 . . . . 0.0 113.78 -178.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.45 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.0 m-90 -80.26 -52.24 7.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.727 0.299 . . . . 0.0 111.32 -179.023 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.9 p -174.09 149.35 1.44 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.474 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.09 -151.43 10.24 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -79.61 147.35 32.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.295 0.569 . . . . 0.0 111.067 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.1 m -83.71 156.53 22.55 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.122 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.456 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 45.6 m -64.22 141.01 58.92 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.426 0.155 . . . . 0.0 110.834 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.2 m -63.74 148.19 49.78 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.743 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.02 141.89 59.16 Favored Pre-proline 0 C--N 1.312 -1.058 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.196 -179.888 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -104.64 40.98 3.13 Favored 'Cis proline' 0 N--CA 1.448 -1.179 0 C-N-CA 123.752 -1.353 . . . . 0.0 113.641 1.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.463 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 59.8 m-85 -72.41 179.48 3.44 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.317 0.579 . . . . 0.0 111.417 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.603 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 59.7 tp -151.95 138.92 19.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.783 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.592 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.1 t -71.84 111.76 7.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.822 0.344 . . . . 0.0 111.132 -179.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.739 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 72.2 p -84.91 108.0 17.34 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.9 t -118.99 59.04 0.84 Allowed 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.108 -177.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.611 HG13 ' HB2' ' A' ' 29' ' ' TYR . 10.3 pt -90.22 -171.07 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.983 0.42 . . . . 0.0 111.332 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -67.01 -81.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -177.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.543 ' HD1' ' HD1' ' A' ' 29' ' ' TYR . 0.3 OUTLIER -79.86 36.06 0.32 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -177.032 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.611 ' HB2' HG13 ' A' ' 26' ' ' ILE . 11.3 m-85 -148.67 131.52 7.99 Favored Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 177.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -60.98 131.21 35.92 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.553 2.169 . . . . 0.0 111.0 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.739 ' HA ' ' O ' ' A' ' 24' ' ' SER . 69.8 m -61.99 100.56 0.16 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.446 0.641 . . . . 0.0 111.015 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.551 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 5.2 p -145.02 148.25 33.52 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.389 -178.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.592 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 14.9 m -67.54 128.84 37.95 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 120.933 0.397 . . . . 0.0 110.242 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.61 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 26.0 mmt85 -132.48 168.07 19.53 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.884 -1.524 . . . . 0.0 106.884 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.61 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 10.0 Cg_endo -55.02 151.15 35.27 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 121.429 1.419 . . . . 0.0 110.48 179.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.603 ' HE2' ' HB2' ' A' ' 22' ' ' LEU . 20.2 ttmt -77.41 118.21 19.65 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.323 -178.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.74 47.01 1.55 Allowed Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.5 -178.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 C--O 1.253 1.243 0 CA-C-O 117.853 -1.07 . . . . 0.0 110.072 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.4 tptp . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p -161.96 159.27 26.35 Favored 'General case' 0 C--N 1.322 -0.628 0 O-C-N 123.596 0.56 . . . . 0.0 109.988 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.452 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.1 mt -80.03 133.09 36.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.351 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.41 -168.09 1.25 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.202 0.525 . . . . 0.0 112.031 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.51 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 6.4 pt-20 -72.96 132.52 43.54 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.106 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.67 38.74 9.2 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.535 -1.212 . . . . 0.0 110.411 -178.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.86 133.58 52.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.396 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -58.68 145.39 40.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.261 0.553 . . . . 0.0 111.473 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.22 142.72 50.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.826 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 8.5 m -79.8 128.45 74.24 Favored Pre-proline 0 C--N 1.318 -0.79 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.489 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.5 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 51.8 Cg_endo -67.87 -43.31 5.29 Favored 'Trans proline' 0 N--CA 1.474 0.334 0 C-N-CA 123.434 2.756 . . . . 0.0 113.925 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.5 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 19.4 m-90 -78.99 -44.82 21.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.611 0.243 . . . . 0.0 111.453 -178.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.2 t -175.47 139.09 0.42 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.303 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.71 -147.83 7.01 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -81.29 152.02 27.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.93 0.395 . . . . 0.0 110.24 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 m -85.49 144.3 28.03 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 54.3 m -72.16 140.58 48.87 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 72.0 m -64.13 142.39 58.43 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.697 ' HD2' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.64 143.83 63.9 Favored Pre-proline 0 C--N 1.311 -1.101 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.12 -179.555 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -101.0 44.53 2.81 Favored 'Cis proline' 0 N--CA 1.455 -0.768 0 C-N-CA 124.069 -1.221 . . . . 0.0 113.858 1.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.51 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 40.3 m-85 -87.5 147.0 25.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.154 0.502 . . . . 0.0 110.634 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 56.7 tp -121.61 143.66 49.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.759 -179.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 41.9 t -68.02 114.23 6.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.926 0.393 . . . . 0.0 109.951 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.567 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 97.4 p -96.51 126.68 41.87 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.122 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 77.5 m -122.52 59.19 1.04 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.004 0.43 . . . . 0.0 110.407 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.771 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -84.72 -174.85 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.986 0.422 . . . . 0.0 111.055 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -81.16 -47.98 12.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.53 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -64.97 -25.37 67.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.646 -178.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.481 ' H ' HG12 ' A' ' 26' ' ' ILE . 96.9 m-85 -141.75 128.93 11.52 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.562 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.03 173.65 5.72 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.869 2.379 . . . . 0.0 112.229 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.567 ' HA ' ' O ' ' A' ' 24' ' ' SER . 92.6 m -50.33 108.55 0.23 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.522 0.677 . . . . 0.0 111.768 -179.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.4 p -152.46 131.32 12.48 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.969 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.9 m -65.32 128.19 34.85 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.423 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 81.0 mtt-85 -138.16 162.85 51.48 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.423 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 51.5 Cg_exo -48.69 144.1 15.22 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.244 1.962 . . . . 0.0 111.483 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -77.16 119.8 21.36 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.166 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.59 44.68 6.05 Favored Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 110.784 -0.926 . . . . 0.0 110.784 -178.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.8 p90 . . . . . 0 C--O 1.252 1.199 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.421 -179.625 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.509 ' HG2' ' N ' ' A' ' 2' ' ' CYS . 19.8 ttpp . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.68 ' HA ' ' O ' ' A' ' 16' ' ' SER . 18.4 p -113.63 157.94 21.49 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.504 178.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 93.0 mt -99.71 130.15 45.9 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.773 -178.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.01 -165.88 0.72 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.095 0.474 . . . . 0.0 111.719 -179.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.603 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 13.2 pt-20 -71.35 131.65 43.71 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.054 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 65.4 38.9 5.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.553 -178.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.436 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -106.13 126.9 52.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.457 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -51.72 136.75 26.85 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.415 0.447 . . . . 0.0 111.021 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 32' ' ' SER . 1.4 p -129.59 142.54 50.72 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.909 0.861 . . . . 0.0 112.213 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.2 m -79.9 130.49 66.74 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 114.293 -1.322 . . . . 0.0 110.336 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.488 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 58.8 Cg_endo -69.54 -43.58 2.75 Favored 'Trans proline' 0 N--CA 1.474 0.333 0 C-N-CA 123.386 2.724 . . . . 0.0 113.981 -178.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.488 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.3 m-90 -79.07 -45.53 19.93 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.8 t -175.36 143.93 0.68 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.786 0.326 . . . . 0.0 111.106 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.61 -153.16 18.21 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.446 ' OD2' ' HB3' ' A' ' 1' ' ' LYS . 11.5 m-20 -69.8 145.81 51.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.099 0.476 . . . . 0.0 110.332 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.68 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 3.9 m -86.21 146.54 26.51 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.19 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 34.3 m -69.66 139.35 53.51 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.805 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 56.4 m -63.47 149.19 46.65 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 61.2 pttt -78.91 142.33 60.21 Favored Pre-proline 0 C--N 1.311 -1.094 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.17 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.446 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 83.0 Cg_endo -103.16 39.47 4.09 Favored 'Cis proline' 0 N--CA 1.45 -1.046 0 C-N-CA 123.991 -1.254 . . . . 0.0 113.81 1.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.603 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 57.4 m-85 -77.71 -176.37 4.33 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 121.992 -0.442 . . . . 0.0 111.202 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.6 tp -159.21 139.52 12.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.3 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.9 t -69.65 112.57 6.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.842 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.61 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 55.2 p -99.45 108.62 21.12 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.074 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 31' ' ' CYS . 1.8 t -103.96 58.41 0.73 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.062 -178.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.822 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -91.4 -175.41 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.18 -179.612 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -86.67 -56.65 3.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -178.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -61.47 -32.87 72.89 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.827 -178.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.75 ' HB2' HD11 ' A' ' 26' ' ' ILE . 7.8 m-85 -115.7 129.55 25.06 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.801 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.7 142.64 91.3 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.545 2.164 . . . . 0.0 111.409 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.61 ' HA ' ' O ' ' A' ' 24' ' ' SER . 72.4 m -54.84 100.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.816 0.817 . . . . 0.0 111.348 -179.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.406 ' HA ' ' SG ' ' A' ' 9' ' ' CYS . 6.4 p -153.37 149.59 27.98 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.144 -0.934 . . . . 0.0 110.254 -178.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.7 m -67.99 128.71 37.51 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.418 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 22.7 mmt180 -132.92 164.44 43.85 Favored Pre-proline 0 C--N 1.32 -0.687 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.418 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 52.7 Cg_exo -49.99 143.38 24.51 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.028 1.818 . . . . 0.0 110.795 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -77.34 115.89 17.49 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -179.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.53 44.6 3.94 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -177.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.5 p90 . . . . . 0 C--O 1.252 1.196 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.449 -179.258 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.467 ' HG3' ' N ' ' A' ' 2' ' ' CYS . 51.6 tptt . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.4 p -149.41 149.38 30.74 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.523 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 85.3 mt -79.63 137.37 37.08 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.004 -178.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.62 -166.78 0.93 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.224 0.535 . . . . 0.0 112.065 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.4 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 38.7 tt0 -72.06 134.37 45.8 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.906 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.11 46.07 6.63 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.508 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -122.01 122.5 39.45 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.458 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.667 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 37.4 m-20 -57.21 131.17 49.17 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.57 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.523 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 26.2 p -95.88 -173.98 3.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.455 -179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 21.1 t -160.29 138.74 7.54 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.58 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.59 -31.56 87.11 Favored 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 123.127 2.551 . . . . 0.0 113.307 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -137.54 -51.44 0.63 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.869 0.366 . . . . 0.0 111.42 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 m -79.42 50.96 1.16 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.942 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 178.41 141.12 4.16 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.657 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.99 163.83 18.99 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.121 0.486 . . . . 0.0 111.098 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.53 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 15.9 m -79.15 153.84 29.77 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.962 179.42 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 12.5 m -64.28 142.87 58.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.364 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.9 m -64.64 144.73 57.01 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 177.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.766 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -77.55 143.23 67.71 Favored Pre-proline 0 C--N 1.313 -0.992 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.892 -178.742 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.526 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 84.6 Cg_endo -102.72 35.64 6.18 Favored 'Cis proline' 0 N--CA 1.453 -0.862 0 C-N-CA 123.181 -1.591 . . . . 0.0 113.893 1.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -67.2 150.06 49.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.29 0.567 . . . . 0.0 111.368 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.0 tp -124.89 134.4 52.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.567 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.668 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 11.3 t -74.87 122.42 23.36 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.0 p -126.69 129.3 48.17 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.243 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.1 76.6 1.47 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.309 -179.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.81 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -84.9 -168.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.036 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -84.98 -50.56 7.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.915 -178.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -66.99 -26.45 66.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.513 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.528 ' HB2' HD11 ' A' ' 26' ' ' ILE . 75.6 m-85 -136.99 138.38 25.65 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.474 ' HG2' ' OD1' ' A' ' 8' ' ' ASP . 36.4 Cg_endo -67.17 -158.92 0.04 OUTLIER 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.225 1.95 . . . . 0.0 112.215 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 73.1 m -68.28 77.38 0.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.033 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.667 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 3.5 p -114.65 141.5 47.71 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.668 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 21.2 m -71.95 118.58 14.99 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 24.5 mmm-85 -121.47 162.08 38.04 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.4 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 47.7 Cg_exo -50.99 152.28 10.46 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.28 1.986 . . . . 0.0 112.121 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 21.4 tptm -77.42 108.31 10.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.75 47.51 3.94 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.063 -1.215 . . . . 0.0 110.063 -177.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.5 p90 . . . . . 0 C--O 1.252 1.195 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.897 -179.08 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.571 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 7.6 ptpp? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 16' ' ' SER . 25.7 p -118.59 150.39 39.75 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.649 178.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.503 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 82.3 mt -84.91 127.88 34.36 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.607 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.77 -163.48 0.48 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.078 0.466 . . . . 0.0 111.634 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.606 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 5.0 pt-20 -70.93 130.97 42.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.347 0.594 . . . . 0.0 111.341 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 64.52 39.96 6.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.855 -178.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.48 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -106.37 128.55 54.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.473 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.414 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 3.6 p30 -58.81 138.47 57.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.155 0.502 . . . . 0.0 111.406 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.4 m -97.57 151.66 19.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.125 0.488 . . . . 0.0 110.629 -179.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.1 m -79.57 128.23 75.58 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.973 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.456 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 30.3 Cg_endo -63.96 -54.82 0.78 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 123.041 2.494 . . . . 0.0 113.722 -178.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.456 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.2 m-90 -80.61 -52.55 7.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.797 0.332 . . . . 0.0 111.255 -179.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 t -175.86 150.01 0.98 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.67 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.69 -142.77 6.96 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.878 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.571 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 46.6 m-20 -72.13 144.67 48.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.204 0.526 . . . . 0.0 110.652 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.582 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 7.7 m -95.75 150.72 20.08 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.816 179.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.649 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 60.7 m -63.71 142.98 58.2 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.618 0.247 . . . . 0.0 111.625 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.5 m -68.12 143.66 55.34 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 177.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 8.7 ptpp? -78.87 141.73 59.65 Favored Pre-proline 0 C--N 1.311 -1.097 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.417 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.564 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 86.7 Cg_endo -102.91 36.48 5.62 Favored 'Cis proline' 0 N--CA 1.454 -0.827 0 C-N-CA 124.18 -1.175 . . . . 0.0 113.931 1.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.606 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 32.8 m-85 -69.53 150.05 47.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.146 0.498 . . . . 0.0 110.774 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -119.64 134.68 55.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.719 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.1 t -76.16 113.12 13.34 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.829 0.347 . . . . 0.0 111.013 179.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 64.8 p -84.88 102.73 13.34 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 31' ' ' CYS . 4.2 t -110.13 54.89 0.65 Allowed 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -178.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.468 HG13 ' H ' ' A' ' 29' ' ' TYR . 16.0 pt -110.2 -170.56 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.202 -179.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -78.36 -56.53 4.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.228 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -65.15 -33.56 76.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.168 0.508 . . . . 0.0 111.289 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.468 ' H ' HG13 ' A' ' 26' ' ' ILE . 4.3 m-85 -114.54 112.69 45.69 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.027 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -56.33 141.36 89.02 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.9 2.4 . . . . 0.0 111.4 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.689 ' HA ' ' O ' ' A' ' 24' ' ' SER . 62.8 m -50.92 96.51 0.01 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.766 0.794 . . . . 0.0 112.536 -178.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.414 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 7.7 p -158.2 145.04 17.7 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.772 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -67.11 125.65 26.7 Favored 'General case' 0 CA--C 1.506 -0.729 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.607 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 25.0 mmt85 -123.23 166.25 19.0 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.607 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 12.2 Cg_endo -57.2 166.25 4.53 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 121.629 1.553 . . . . 0.0 111.398 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.564 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 47.7 tttp -77.83 73.91 4.39 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.959 0.885 . . . . 0.0 109.53 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.27 49.39 0.05 OUTLIER Glycine 0 N--CA 1.441 -0.998 0 CA-C-N 113.697 -1.592 . . . . 0.0 109.469 -177.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.2 p-90 . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.404 -178.846 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? . . . . . 0 N--CA 1.482 1.14 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 16' ' ' SER . 27.2 p -162.32 153.83 18.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.109 0.481 . . . . 0.0 110.778 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 89.1 mt -80.28 128.17 33.22 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.372 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.65 -166.65 0.91 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.991 0.424 . . . . 0.0 111.424 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.606 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 8.1 pt-20 -72.4 130.89 41.78 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.152 0.501 . . . . 0.0 110.791 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 69.69 34.23 2.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.428 -178.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.459 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -104.14 127.03 51.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.815 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -57.16 132.72 53.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.846 0.355 . . . . 0.0 111.31 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.09 137.03 52.55 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.499 0.666 . . . . 0.0 110.952 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.0 m -79.44 128.87 73.81 Favored Pre-proline 0 C--N 1.314 -0.945 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.475 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.516 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 56.5 Cg_endo -68.42 -41.12 6.98 Favored 'Trans proline' 0 N--CA 1.474 0.338 0 C-N-CA 123.557 2.838 . . . . 0.0 113.943 -178.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.516 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 20.8 m-90 -78.7 -43.16 26.51 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.09 -178.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 t -177.79 138.55 0.21 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.474 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.91 -153.74 10.41 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -83.01 152.34 25.45 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.402 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 13.3 m -83.54 144.76 29.29 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.016 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 12.9 m -70.9 138.16 49.9 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.8 m -61.82 146.68 48.82 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 178.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -82.75 147.79 56.09 Favored Pre-proline 0 C--N 1.311 -1.096 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.152 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.536 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 94.1 Cg_endo -97.82 32.28 10.92 Favored 'Cis proline' 0 N--CA 1.451 -0.997 0 C-N-CA 122.988 -1.672 . . . . 0.0 113.752 1.218 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.606 ' CE1' ' HB3' ' A' ' 5' ' ' GLU . 39.1 m-85 -70.6 156.54 39.3 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.199 0.523 . . . . 0.0 111.304 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.1 tp -131.36 140.7 49.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.316 -178.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 50.6 t -71.68 125.51 27.29 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.443 ' OG ' ' HG2' ' A' ' 34' ' ' ARG . 63.6 p -132.46 133.99 44.52 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -179.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -118.65 86.37 2.53 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.727 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -91.26 -168.76 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.544 -179.425 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -75.32 -64.13 1.13 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.02 -39.58 87.07 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.955 0.407 . . . . 0.0 111.367 -177.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.478 ' HB2' HD11 ' A' ' 26' ' ' ILE . 31.6 m-85 -105.77 129.79 24.07 Favored Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 16.2 Cg_exo -67.2 -167.95 0.15 Allowed 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.34 2.027 . . . . 0.0 111.596 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 90.0 m -62.86 104.61 0.56 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.0 p -144.98 137.53 26.17 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.894 0.378 . . . . 0.0 111.597 -178.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.9 m -72.53 120.59 18.35 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 177.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.443 ' HG2' ' OG ' ' A' ' 24' ' ' SER . 21.1 mmm-85 -121.45 167.2 13.96 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.559 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 72.7 Cg_exo -47.62 163.95 0.17 Allowed 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 122.726 2.284 . . . . 0.0 112.591 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.536 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 22.3 tptm -76.86 73.14 3.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.745 0.783 . . . . 0.0 109.666 -179.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 123.65 23.37 2.09 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.92 -178.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.459 ' O ' ' HB2' ' A' ' 35' ' ' PRO . 1.3 m-90 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.481 -0.771 . . . . 0.0 111.471 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.507 ' HG3' ' OD2' ' A' ' 15' ' ' ASP . 26.2 tptp . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 22.7 p -161.36 159.0 27.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.15 -178.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.577 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 69.3 mt -80.11 120.57 24.43 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.45 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.43 -155.52 0.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.506 0.669 . . . . 0.0 112.693 -178.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.431 ' OE1' ' HD3' ' A' ' 35' ' ' PRO . 12.6 tp10 -65.56 128.46 36.03 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.19 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.534 ' HB2' ' NH1' ' A' ' 34' ' ' ARG . . . 59.66 43.23 15.93 Favored 'General case' 0 CA--C 1.515 -0.386 0 O-C-N 124.144 0.902 . . . . 0.0 110.615 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -102.07 129.81 48.49 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 119.897 -0.721 . . . . 0.0 111.803 -178.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -62.73 134.37 56.19 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.221 0.534 . . . . 0.0 110.537 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.4 m -92.8 152.81 19.24 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.602 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.0 m -79.11 131.93 64.88 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.999 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.421 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 24.8 Cg_endo -62.47 -55.08 1.02 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.142 2.561 . . . . 0.0 113.771 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.421 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 12.8 m-90 -88.42 -58.27 2.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.865 0.364 . . . . 0.0 111.23 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.3 m -161.62 146.36 13.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.967 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.56 -145.47 8.02 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.985 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.507 ' OD2' ' HG3' ' A' ' 1' ' ' LYS . 0.7 OUTLIER -70.0 148.13 49.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.359 0.6 . . . . 0.0 111.447 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.2 m -99.58 150.34 22.34 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.068 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.518 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 61.3 m -63.47 141.43 58.77 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.629 0.252 . . . . 0.0 111.338 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.6 m -67.38 143.65 56.21 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.18 141.88 62.98 Favored Pre-proline 0 C--N 1.31 -1.125 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.438 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.455 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 92.1 Cg_endo -102.66 44.82 2.63 Favored 'Cis proline' 0 N--CA 1.453 -0.895 0 C-N-CA 124.073 -1.219 . . . . 0.0 114.095 1.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -81.76 148.41 28.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.229 0.538 . . . . 0.0 110.457 179.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.0 tp -119.47 139.19 52.47 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.575 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.566 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.4 t -71.1 106.19 3.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 110.401 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -88.4 130.83 35.07 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.513 179.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.9 t -136.47 63.77 1.57 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.407 0.623 . . . . 0.0 109.331 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.79 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -81.22 -168.64 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.241 -179.53 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -66.95 -60.58 2.52 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -74.07 -36.49 64.32 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -177.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.693 ' HB2' HD11 ' A' ' 26' ' ' ILE . 23.4 m-85 -103.63 124.96 36.16 Favored Pre-proline 0 C--N 1.322 -0.621 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.079 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.82 172.45 13.65 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.817 2.345 . . . . 0.0 111.966 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 88.2 m -52.41 105.38 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 O-C-N 123.468 0.48 . . . . 0.0 111.175 -179.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 p -152.73 135.23 15.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.39 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.566 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.3 m -65.86 129.06 38.45 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.538 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.534 ' NH1' ' HB2' ' A' ' 6' ' ' ALA . 34.4 mmt180 -138.04 162.18 55.45 Favored Pre-proline 0 C--N 1.327 -0.409 0 O-C-N 125.504 1.753 . . . . 0.0 107.649 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.431 ' HD3' ' OE1' ' A' ' 5' ' ' GLU . 44.1 Cg_exo -51.96 147.6 25.63 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.261 1.974 . . . . 0.0 111.728 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 32.6 ttpt -77.64 94.16 4.35 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 112.21 43.88 0.89 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 -178.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.8 p90 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.283 -0.865 . . . . 0.0 110.483 -179.334 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 83.5 tttt . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.563 ' HA ' ' O ' ' A' ' 16' ' ' SER . 28.9 p -77.7 146.97 35.68 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.469 -0.892 . . . . 0.0 110.739 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 63.2 mt -82.3 127.18 32.96 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.89 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.16 -169.75 1.72 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.89 0.376 . . . . 0.0 111.57 -179.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' A' ' 5' ' ' GLU . 10.4 pt-20 -75.12 133.24 41.57 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.395 0.616 . . . . 0.0 110.8 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.432 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 69.03 33.74 3.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.157 -1.383 . . . . 0.0 110.207 -177.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -110.48 134.81 52.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.773 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -57.37 147.42 26.03 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.094 0.473 . . . . 0.0 111.538 -179.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.7 p -137.49 149.34 46.74 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.476 0.655 . . . . 0.0 111.288 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.0 m -79.43 125.66 82.55 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.584 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.518 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 60.2 Cg_endo -70.47 -42.21 2.83 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 123.213 2.609 . . . . 0.0 113.437 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.518 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 18.8 m-90 -79.28 -46.5 17.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.299 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.9 t -176.59 140.67 0.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.844 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 177.69 -160.87 27.73 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -70.04 148.81 48.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.32 0.581 . . . . 0.0 110.787 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.563 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 8.0 m -82.88 149.57 27.03 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.924 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 5.0 m -74.53 145.14 43.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.22 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.25 146.41 50.97 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.7 ptmt -79.18 142.99 59.92 Favored Pre-proline 0 C--N 1.311 -1.102 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.079 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.59 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 82.1 Cg_endo -103.55 43.33 2.8 Favored 'Cis proline' 0 N--CA 1.449 -1.089 0 C-N-CA 124.089 -1.213 . . . . 0.0 113.697 1.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.674 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 18.4 m-85 -73.37 -164.33 0.19 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 117.957 0.344 . . . . 0.0 111.223 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 24.3 tp -168.07 133.32 1.83 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.813 -0.176 . . . . 0.0 111.247 -178.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.8 t -70.21 128.39 36.1 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.508 ' OG ' ' HG2' ' A' ' 34' ' ' ARG . 22.6 p -142.53 132.02 23.74 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.805 0.336 . . . . 0.0 110.623 -178.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.436 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.7 OUTLIER -112.05 77.77 1.07 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.519 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.782 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -89.16 -169.48 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.643 -179.289 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -84.01 -50.35 8.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.765 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -63.01 -28.92 70.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.303 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.448 ' H ' HG12 ' A' ' 26' ' ' ILE . 67.6 m-85 -140.12 134.29 15.58 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.303 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 29' ' ' TYR . 21.9 Cg_exo -64.83 -166.99 0.09 OUTLIER 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.49 2.126 . . . . 0.0 111.828 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.436 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 93.7 m -58.32 103.72 0.17 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.999 0.428 . . . . 0.0 110.082 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.6 p -151.2 141.01 21.88 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.027 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 18.8 m -74.97 123.06 24.46 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 177.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.508 ' HG2' ' OG ' ' A' ' 24' ' ' SER . 21.1 mmm-85 -119.04 162.0 33.69 Favored Pre-proline 0 C--N 1.316 -0.869 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.674 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 32.7 Cg_exo -53.35 157.52 8.92 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.37 2.046 . . . . 0.0 111.589 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 1.3 tppp? -77.72 113.68 15.83 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.46 48.72 5.49 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 -177.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.1 p90 . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.862 -179.074 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.5 p -160.52 159.14 30.36 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 123.443 0.464 . . . . 0.0 109.956 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 92.4 mt -79.63 132.13 36.17 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.745 -179.32 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.43 -166.37 0.84 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.081 0.467 . . . . 0.0 111.786 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.572 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 12.3 pt-20 -73.1 132.06 42.83 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.15 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.99 36.85 9.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.48 -178.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -100.78 137.22 39.46 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.791 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -56.59 142.14 40.62 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.969 0.414 . . . . 0.0 111.553 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 22.2 p -153.03 171.77 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.3 0.572 . . . . 0.0 111.37 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.537 ' HB2' ' O ' ' A' ' 13' ' ' SER . 66.9 m -156.51 123.79 2.71 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.507 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 32.3 Cg_exo -63.82 -29.26 68.01 Favored 'Trans proline' 0 N--CA 1.474 0.38 0 C-N-CA 123.493 2.795 . . . . 0.0 113.399 -178.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 21.9 m-90 -78.85 -19.62 51.58 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.003 -179.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.537 ' O ' ' HB2' ' A' ' 10' ' ' SER . 9.4 t -178.17 126.29 0.12 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.372 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 159.32 164.61 14.89 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.92 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.88 158.01 29.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.062 0.458 . . . . 0.0 110.63 179.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.1 m -79.62 141.98 36.02 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.668 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.576 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 19.8 m -74.17 141.68 45.5 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.9 m -64.36 146.02 55.11 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 60.9 pttt -78.44 141.62 61.44 Favored Pre-proline 0 C--N 1.311 -1.09 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.571 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 79.6 Cg_endo -103.49 37.25 5.0 Favored 'Cis proline' 0 N--CA 1.453 -0.902 0 C-N-CA 123.906 -1.289 . . . . 0.0 113.779 1.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.944 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 58.2 m-85 -69.39 159.51 33.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.902 0.382 . . . . 0.0 110.773 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.584 HD23 ' HE1' ' A' ' 38' ' ' TRP . 36.8 tp -132.85 130.19 39.44 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.6 t -69.79 124.98 25.39 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.3 p -148.31 145.27 28.08 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.745 0.307 . . . . 0.0 110.845 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.427 ' SG ' ' N ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -113.17 65.78 0.65 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.873 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.887 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -82.28 -170.2 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.349 -178.762 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -83.16 -50.47 8.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.017 -178.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -59.96 -32.51 70.88 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.649 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -141.81 134.65 14.05 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.06 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.19 -160.75 0.05 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.293 1.995 . . . . 0.0 111.811 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.427 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 90.1 m -59.14 98.51 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.816 0.341 . . . . 0.0 110.104 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.442 ' O ' ' HG2' ' A' ' 34' ' ' ARG . 6.2 p -155.5 144.42 20.66 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.672 -178.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 32.9 m -70.08 110.05 4.91 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.749 -1.574 . . . . 0.0 106.749 177.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.645 ' HB2' ' CD1' ' A' ' 38' ' ' TRP . 12.2 mmm-85 -101.73 167.15 11.0 Favored Pre-proline 0 C--N 1.313 -1.001 0 O-C-N 124.143 0.902 . . . . 0.0 108.632 -178.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.944 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 17.8 Cg_endo -59.81 166.17 8.86 Favored 'Trans proline' 0 N--CA 1.465 -0.201 0 C-N-CA 121.822 1.681 . . . . 0.0 111.267 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 20.9 tptm -78.22 75.13 4.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.839 0.828 . . . . 0.0 109.428 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.84 47.55 0.05 OUTLIER Glycine 0 N--CA 1.447 -0.626 0 CA-C-N 114.019 -1.446 . . . . 0.0 109.549 -177.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.645 ' CD1' ' HB2' ' A' ' 34' ' ' ARG . 6.8 p-90 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.535 -0.745 . . . . 0.0 112.056 -178.856 . . . . . . . . 1 1 . 1 stop_ save_